data_5of1-assembly-1 # loop_ _atom_site.group_PDB _atom_site.id _atom_site.type_symbol _atom_site.label_atom_id _atom_site.label_alt_id _atom_site.label_comp_id _atom_site.label_asym_id _atom_site.label_entity_id _atom_site.label_seq_id _atom_site.pdbx_PDB_ins_code _atom_site.Cartn_x _atom_site.Cartn_y _atom_site.Cartn_z _atom_site.occupancy _atom_site.B_iso_or_equiv _atom_site.pdbx_formal_charge _atom_site.auth_seq_id _atom_site.auth_comp_id _atom_site.auth_asym_id _atom_site.auth_atom_id _atom_site.pdbx_PDB_model_num _atom_site.pdbe_label_seq_id _atom_site.orig_label_asym_id _atom_site.orig_auth_asym_id ATOM 1 N N . ASN A 1 1 ? 63.198 18.932 39.440 1.0 44.27 ? 30 ASN A N 1 1 . A ATOM 2 C CA . ASN A 1 1 ? 62.648 17.595 39.837 1.0 46.9 ? 30 ASN A CA 1 1 . A ATOM 3 C C . ASN A 1 1 ? 63.525 16.810 40.847 1.0 45.48 ? 30 ASN A C 1 1 . A ATOM 4 O O . ASN A 1 1 ? 62.994 15.966 41.611 1.0 39.05 ? 30 ASN A O 1 1 . A ATOM 5 C CB . ASN A 1 1 ? 62.410 16.739 38.578 1.0 49.0 ? 30 ASN A CB 1 1 . A ATOM 6 C CG . ASN A 1 1 ? 61.165 15.863 38.683 1.0 51.57 ? 30 ASN A CG 1 1 . A ATOM 7 O OD1 . ASN A 1 1 ? 60.696 15.541 39.775 1.0 53.77 ? 30 ASN A OD1 1 1 . A ATOM 8 N ND2 . ASN A 1 1 ? 60.635 15.465 37.541 1.0 49.97 ? 30 ASN A ND2 1 1 . A ATOM 9 N N . ASP A 1 2 ? 64.838 17.092 40.836 1.0 44.41 ? 31 ASP A N 1 2 . A ATOM 10 C CA . ASP A 1 2 ? 65.857 16.434 41.706 1.0 43.79 ? 31 ASP A CA 1 2 . A ATOM 11 C C . ASP A 1 2 ? 65.565 16.501 43.226 1.0 41.44 ? 31 ASP A C 1 2 . A ATOM 12 O O . ASP A 1 2 ? 65.181 17.543 43.759 1.0 40.11 ? 31 ASP A O 1 2 . A ATOM 13 C CB . ASP A 1 2 ? 67.252 17.043 41.452 1.0 46.76 ? 31 ASP A CB 1 2 . A ATOM 14 C CG . ASP A 1 2 ? 68.395 16.121 41.875 1.0 47.14 ? 31 ASP A CG 1 2 . A ATOM 15 O OD1 . ASP A 1 2 ? 68.698 15.188 41.105 1.0 50.95 ? 31 ASP A OD1 1 2 . A ATOM 16 O OD2 . ASP A 1 2 ? 69.011 16.354 42.939 1.0 47.75 ? 31 ASP A OD2 1 2 . A ATOM 17 N N . ILE A 1 3 ? 65.781 15.382 43.917 1.0 36.24 ? 32 ILE A N 1 3 . A ATOM 18 C CA . ILE A 1 3 ? 65.444 15.301 45.348 1.0 35.2 ? 32 ILE A CA 1 3 . A ATOM 19 C C . ILE A 1 3 ? 66.332 16.142 46.259 1.0 34.32 ? 32 ILE A C 1 3 . A ATOM 20 O O . ILE A 1 3 ? 65.894 16.552 47.338 1.0 31.05 ? 32 ILE A O 1 3 . A ATOM 21 C CB . ILE A 1 3 ? 65.418 13.841 45.856 1.0 34.31 ? 32 ILE A CB 1 3 . A ATOM 22 C CG1 . ILE A 1 3 ? 66.790 13.153 45.713 1.0 35.54 ? 32 ILE A CG1 1 3 . A ATOM 23 C CG2 . ILE A 1 3 ? 64.331 13.070 45.121 1.0 33.69 ? 32 ILE A CG2 1 3 . A ATOM 24 C CD1 . ILE A 1 3 ? 66.898 11.878 46.524 1.0 34.45 ? 32 ILE A CD1 1 3 . A ATOM 25 N N . LYS A 1 4 ? 67.563 16.397 45.832 1.0 38.94 ? 33 LYS A N 1 4 . A ATOM 26 C CA . LYS A 1 4 ? 68.505 17.181 46.641 1.0 42.9 ? 33 LYS A CA 1 4 . A ATOM 27 C C . LYS A 1 4 ? 68.245 18.684 46.542 1.0 49.24 ? 33 LYS A C 1 4 . A ATOM 28 O O . LYS A 1 4 ? 68.732 19.445 47.389 1.0 52.62 ? 33 LYS A O 1 4 . A ATOM 29 C CB . LYS A 1 4 ? 69.952 16.913 46.224 1.0 42.02 ? 33 LYS A CB 1 4 . A ATOM 30 C CG . LYS A 1 4 ? 70.359 15.446 46.126 1.0 41.38 ? 33 LYS A CG 1 4 . A ATOM 31 C CD . LYS A 1 4 ? 71.871 15.284 46.268 1.0 39.58 ? 33 LYS A CD 1 4 . A ATOM 32 C CE . LYS A 1 4 ? 72.658 15.693 45.029 1.0 38.16 ? 33 LYS A CE 1 4 . A ATOM 33 N NZ . LYS A 1 4 ? 73.999 16.240 45.371 1.0 38.43 ? 33 LYS A NZ 1 4 . A ATOM 34 N N . SER A 1 5 ? 67.501 19.106 45.509 1.0 50.26 ? 34 SER A N 1 5 . A ATOM 35 C CA . SER A 1 5 ? 67.242 20.523 45.241 1.0 53.83 ? 34 SER A CA 1 5 . A ATOM 36 C C . SER A 1 5 ? 66.461 21.163 46.382 1.0 58.88 ? 34 SER A C 1 5 . A ATOM 37 O O . SER A 1 5 ? 65.437 20.628 46.837 1.0 57.65 ? 34 SER A O 1 5 . A ATOM 38 C CB . SER A 1 5 ? 66.483 20.709 43.923 1.0 52.27 ? 34 SER A CB 1 5 . A ATOM 39 O OG . SER A 1 5 ? 67.281 20.306 42.817 1.0 53.86 ? 34 SER A OG 1 5 . A ATOM 40 N N . LYS A 1 6 ? 66.980 22.304 46.837 1.0 64.21 ? 35 LYS A N 1 6 . A ATOM 41 C CA . LYS A 1 6 ? 66.389 23.091 47.918 1.0 69.0 ? 35 LYS A CA 1 6 . A ATOM 42 C C . LYS A 1 6 ? 64.900 23.332 47.626 1.0 72.09 ? 35 LYS A C 1 6 . A ATOM 43 O O . LYS A 1 6 ? 64.540 23.693 46.502 1.0 75.42 ? 35 LYS A O 1 6 . A ATOM 44 C CB . LYS A 1 6 ? 67.145 24.424 48.050 1.0 68.99 ? 35 LYS A CB 1 6 . A ATOM 45 C CG . LYS A 1 6 ? 67.025 25.124 49.389 1.0 69.54 ? 35 LYS A CG 1 6 . A ATOM 46 C CD . LYS A 1 6 ? 67.726 26.475 49.331 1.0 71.41 ? 35 LYS A CD 1 6 . A ATOM 47 C CE . LYS A 1 6 ? 67.493 27.302 50.587 1.0 72.68 ? 35 LYS A CE 1 6 . A ATOM 48 N NZ . LYS A 1 6 ? 67.836 28.734 50.366 1.0 73.99 ? 35 LYS A NZ 1 6 . A ATOM 49 N N . ASP A 1 7 ? 64.043 23.085 48.616 1.0 72.96 ? 36 ASP A N 1 7 . A ATOM 50 C CA . ASP A 1 7 ? 62.592 23.311 48.454 1.0 73.84 ? 36 ASP A CA 1 7 . A ATOM 51 C C . ASP A 1 7 ? 62.232 24.806 48.394 1.0 74.14 ? 36 ASP A C 1 7 . A ATOM 52 O O . ASP A 1 7 ? 61.212 25.165 47.799 1.0 75.87 ? 36 ASP A O 1 7 . A ATOM 53 C CB . ASP A 1 7 ? 61.745 22.566 49.516 1.0 72.29 ? 36 ASP A CB 1 7 . A ATOM 54 C CG . ASP A 1 7 ? 62.325 22.651 50.917 1.0 71.64 ? 36 ASP A CG 1 7 . A ATOM 55 O OD1 . ASP A 1 7 ? 63.251 21.863 51.215 1.0 69.64 ? 36 ASP A OD1 1 7 . A ATOM 56 O OD2 . ASP A 1 7 ? 61.853 23.491 51.716 1.0 68.8 ? 36 ASP A OD2 1 7 . A ATOM 57 N N . ALA A 1 8 ? 63.065 25.657 49.006 1.0 73.97 ? 37 ALA A N 1 8 . A ATOM 58 C CA . ALA A 1 8 ? 62.949 27.121 48.902 1.0 75.35 ? 37 ALA A CA 1 8 . A ATOM 59 C C . ALA A 1 8 ? 63.911 27.657 47.837 1.0 75.95 ? 37 ALA A C 1 8 . A ATOM 60 O O . ALA A 1 8 ? 64.876 28.363 48.148 1.0 76.2 ? 37 ALA A O 1 8 . A ATOM 61 C CB . ALA A 1 8 ? 63.223 27.768 50.256 1.0 76.38 ? 37 ALA A CB 1 8 . A ATOM 62 N N . THR A 1 9 ? 63.625 27.318 46.579 1.0 74.54 ? 38 THR A N 1 9 . A ATOM 63 C CA . THR A 1 9 ? 64.491 27.650 45.440 1.0 69.76 ? 38 THR A CA 1 9 . A ATOM 64 C C . THR A 1 9 ? 63.952 28.872 44.673 1.0 67.87 ? 38 THR A C 1 9 . A ATOM 65 O O . THR A 1 9 ? 62.761 28.955 44.336 1.0 61.06 ? 38 THR A O 1 9 . A ATOM 66 C CB . THR A 1 9 ? 64.683 26.415 44.519 1.0 68.93 ? 38 THR A CB 1 9 . A ATOM 67 O OG1 . THR A 1 9 ? 65.649 25.542 45.114 1.0 71.85 ? 38 THR A OG1 1 9 . A ATOM 68 C CG2 . THR A 1 9 ? 65.184 26.782 43.122 1.0 69.19 ? 38 THR A CG2 1 9 . A ATOM 69 N N . PHE A 1 10 ? 64.858 29.810 44.402 1.0 65.01 ? 39 PHE A N 1 10 . A ATOM 70 C CA . PHE A 1 10 ? 64.536 31.024 43.659 1.0 64.02 ? 39 PHE A CA 1 10 . A ATOM 71 C C . PHE A 1 10 ? 64.423 30.757 42.148 1.0 60.79 ? 39 PHE A C 1 10 . A ATOM 72 O O . PHE A 1 10 ? 63.517 31.289 41.488 1.0 59.65 ? 39 PHE A O 1 10 . A ATOM 73 C CB . PHE A 1 10 ? 65.588 32.109 43.943 1.0 64.06 ? 39 PHE A CB 1 10 . A ATOM 74 C CG . PHE A 1 10 ? 65.354 33.386 43.188 1.0 64.11 ? 39 PHE A CG 1 10 . A ATOM 75 C CD1 . PHE A 1 10 ? 64.180 34.120 43.387 1.0 63.88 ? 39 PHE A CD1 1 10 . A ATOM 76 C CD2 . PHE A 1 10 ? 66.288 33.846 42.261 1.0 61.98 ? 39 PHE A CD2 1 10 . A ATOM 77 C CE1 . PHE A 1 10 ? 63.947 35.292 42.680 1.0 64.39 ? 39 PHE A CE1 1 10 . A ATOM 78 C CE2 . PHE A 1 10 ? 66.058 35.012 41.555 1.0 62.31 ? 39 PHE A CE2 1 10 . A ATOM 79 C CZ . PHE A 1 10 ? 64.893 35.741 41.767 1.0 64.28 ? 39 PHE A CZ 1 10 . A ATOM 80 N N . ALA A 1 11 ? 65.340 29.949 41.606 1.0 57.35 ? 40 ALA A N 1 11 . A ATOM 81 C CA . ALA A 1 11 ? 65.346 29.618 40.165 1.0 53.72 ? 40 ALA A CA 1 11 . A ATOM 82 C C . ALA A 1 11 ? 64.012 29.013 39.673 1.0 48.48 ? 40 ALA A C 1 11 . A ATOM 83 O O . ALA A 1 11 ? 63.375 28.225 40.383 1.0 42.5 ? 40 ALA A O 1 11 . A ATOM 84 C CB . ALA A 1 11 ? 66.501 28.673 39.834 1.0 52.97 ? 40 ALA A CB 1 11 . A ATOM 85 N N . SER A 1 12 ? 63.603 29.395 38.460 1.0 44.17 ? 41 SER A N 1 12 . A ATOM 86 C CA . SER A 1 12 ? 62.442 28.801 37.818 1.0 39.91 ? 41 SER A CA 1 12 . A ATOM 87 C C . SER A 1 12 ? 62.843 27.391 37.392 1.0 37.69 ? 41 SER A C 1 12 . A ATOM 88 O O . SER A 1 12 ? 63.913 27.185 36.815 1.0 39.17 ? 41 SER A O 1 12 . A ATOM 89 C CB . SER A 1 12 ? 61.963 29.639 36.605 1.0 42.56 ? 41 SER A CB 1 12 . A ATOM 90 O OG . SER A 1 12 ? 62.456 29.148 35.374 1.0 46.23 ? 41 SER A OG 1 12 . A ATOM 91 N N . GLY A 1 13 ? 62.011 26.409 37.703 1.0 32.57 ? 42 GLY A N 1 13 . A ATOM 92 C CA . GLY A 1 13 ? 62.221 25.059 37.180 1.0 32.64 ? 42 GLY A CA 1 13 . A ATOM 93 C C . GLY A 1 13 ? 62.098 25.045 35.664 1.0 32.09 ? 42 GLY A C 1 13 . A ATOM 94 O O . GLY A 1 13 ? 61.211 25.664 35.107 1.0 31.31 ? 42 GLY A O 1 13 . A ATOM 95 N N . THR A 1 14 ? 62.997 24.326 34.999 1.0 35.04 ? 43 THR A N 1 14 . A ATOM 96 C CA . THR A 1 14 ? 62.941 24.149 33.551 1.0 33.9 ? 43 THR A CA 1 14 . A ATOM 97 C C . THR A 1 14 ? 62.310 22.811 33.282 1.0 36.15 ? 43 THR A C 1 14 . A ATOM 98 O O . THR A 1 14 ? 62.855 21.789 33.689 1.0 36.63 ? 43 THR A O 1 14 . A ATOM 99 C CB . THR A 1 14 ? 64.348 24.264 32.913 1.0 38.46 ? 43 THR A CB 1 14 . A ATOM 100 O OG1 . THR A 1 14 ? 64.712 25.646 32.861 1.0 38.75 ? 43 THR A OG1 1 14 . A ATOM 101 C CG2 . THR A 1 14 ? 64.387 23.705 31.488 1.0 39.62 ? 43 THR A CG2 1 14 . A ATOM 102 N N . LEU A 1 15 ? 61.148 22.828 32.629 1.0 35.85 ? 44 LEU A N 1 15 . A ATOM 103 C CA . LEU A 1 15 ? 60.448 21.623 32.203 1.0 39.39 ? 44 LEU A CA 1 15 . A ATOM 104 C C . LEU A 1 15 ? 60.753 21.388 30.737 1.0 36.43 ? 44 LEU A C 1 15 . A ATOM 105 O O . LEU A 1 15 ? 60.521 22.261 29.912 1.0 33.39 ? 44 LEU A O 1 15 . A ATOM 106 C CB . LEU A 1 15 ? 58.947 21.787 32.408 1.0 42.71 ? 44 LEU A CB 1 15 . A ATOM 107 C CG . LEU A 1 15 ? 58.550 22.039 33.870 1.0 46.41 ? 44 LEU A CG 1 15 . A ATOM 108 C CD1 . LEU A 1 15 ? 57.160 22.644 33.960 1.0 46.83 ? 44 LEU A CD1 1 15 . A ATOM 109 C CD2 . LEU A 1 15 ? 58.629 20.753 34.683 1.0 48.6 ? 44 LEU A CD2 1 15 . A ATOM 110 N N . ASP A 1 16 ? 61.274 20.206 30.441 1.0 37.14 ? 45 ASP A N 1 16 . A ATOM 111 C CA . ASP A 1 16 ? 61.737 19.847 29.112 1.0 38.19 ? 45 ASP A CA 1 16 . A ATOM 112 C C . ASP A 1 16 ? 60.544 19.252 28.360 1.0 32.85 ? 45 ASP A C 1 16 . A ATOM 113 O O . ASP A 1 16 ? 60.106 18.147 28.690 1.0 29.92 ? 45 ASP A O 1 16 . A ATOM 114 C CB . ASP A 1 16 ? 62.884 18.825 29.246 1.0 42.12 ? 45 ASP A CB 1 16 . A ATOM 115 C CG . ASP A 1 16 ? 63.238 18.156 27.948 1.0 45.39 ? 45 ASP A CG 1 16 . A ATOM 116 O OD1 . ASP A 1 16 ? 63.267 18.847 26.915 1.0 46.23 ? 45 ASP A OD1 1 16 . A ATOM 117 O OD2 . ASP A 1 16 ? 63.494 16.934 27.959 1.0 48.46 ? 45 ASP A OD2 1 16 . A ATOM 118 N N . LEU A 1 17 ? 60.018 19.972 27.367 1.0 33.57 ? 46 LEU A N 1 17 . A ATOM 119 C CA . LEU A 1 17 ? 58.810 19.518 26.669 1.0 33.54 ? 46 LEU A CA 1 17 . A ATOM 120 C C . LEU A 1 17 ? 59.013 18.269 25.792 1.0 37.06 ? 46 LEU A C 1 17 . A ATOM 121 O O . LEU A 1 17 ? 58.027 17.695 25.327 1.0 37.07 ? 46 LEU A O 1 17 . A ATOM 122 C CB . LEU A 1 17 ? 58.165 20.659 25.859 1.0 32.37 ? 46 LEU A CB 1 17 . A ATOM 123 C CG . LEU A 1 17 ? 57.457 21.801 26.610 1.0 33.29 ? 46 LEU A CG 1 17 . A ATOM 124 C CD1 . LEU A 1 17 ? 57.015 22.922 25.674 1.0 36.53 ? 46 LEU A CD1 1 17 . A ATOM 125 C CD2 . LEU A 1 17 ? 56.267 21.270 27.391 1.0 33.17 ? 46 LEU A CD2 1 17 . A ATOM 126 N N . SER A 1 18 ? 60.270 17.844 25.575 1.0 38.34 ? 47 SER A N 1 18 . A ATOM 127 C CA . SER A 1 18 ? 60.539 16.540 24.942 1.0 42.87 ? 47 SER A CA 1 18 . A ATOM 128 C C . SER A 1 18 ? 60.210 15.352 25.878 1.0 47.1 ? 47 SER A C 1 18 . A ATOM 129 O O . SER A 1 18 ? 60.181 14.197 25.437 1.0 49.47 ? 47 SER A O 1 18 . A ATOM 130 C CB . SER A 1 18 ? 61.968 16.482 24.390 1.0 44.67 ? 47 SER A CB 1 18 . A ATOM 131 O OG . SER A 1 18 ? 62.945 16.753 25.380 1.0 44.57 ? 47 SER A OG 1 18 . A ATOM 132 N N . ALA A 1 19 ? 59.981 15.651 27.162 1.0 51.69 ? 48 ALA A N 1 19 . A ATOM 133 C CA . ALA A 1 19 ? 59.209 14.800 28.087 1.0 55.36 ? 48 ALA A CA 1 19 . A ATOM 134 C C . ALA A 1 19 ? 59.852 13.484 28.523 1.0 60.87 ? 48 ALA A C 1 19 . A ATOM 135 O O . ALA A 1 19 ? 59.313 12.402 28.261 1.0 65.42 ? 48 ALA A O 1 19 . A ATOM 136 C CB . ALA A 1 19 ? 57.795 14.566 27.545 1.0 55.27 ? 48 ALA A CB 1 19 . A ATOM 137 N N . LYS A 1 20 ? 60.989 13.582 29.213 1.0 64.3 ? 49 LYS A N 1 20 . A ATOM 138 C CA . LYS A 1 20 ? 61.574 12.428 29.913 1.0 65.07 ? 49 LYS A CA 1 20 . A ATOM 139 C C . LYS A 1 20 ? 60.669 12.135 31.105 1.0 66.96 ? 49 LYS A C 1 20 . A ATOM 140 O O . LYS A 1 20 ? 60.078 11.056 31.207 1.0 69.23 ? 49 LYS A O 1 20 . A ATOM 141 C CB . LYS A 1 20 ? 63.013 12.720 30.372 1.0 65.45 ? 49 LYS A CB 1 20 . A ATOM 142 N N . GLU A 1 21 ? 60.563 13.125 31.988 1.0 66.16 ? 50 GLU A N 1 21 . A ATOM 143 C CA . GLU A 1 21 ? 59.527 13.186 33.026 1.0 62.73 ? 50 GLU A CA 1 21 . A ATOM 144 C C . GLU A 1 21 ? 59.148 14.654 33.168 1.0 55.41 ? 50 GLU A C 1 21 . A ATOM 145 O O . GLU A 1 21 ? 59.996 15.530 32.928 1.0 58.13 ? 50 GLU A O 1 21 . A ATOM 146 C CB . GLU A 1 21 ? 60.042 12.618 34.354 1.0 64.42 ? 50 GLU A CB 1 21 . A ATOM 147 C CG . GLU A 1 21 ? 61.360 13.223 34.846 1.0 66.43 ? 50 GLU A CG 1 21 . A ATOM 148 C CD . GLU A 1 21 ? 61.875 12.599 36.136 1.0 66.8 ? 50 GLU A CD 1 21 . A ATOM 149 O OE1 . GLU A 1 21 ? 61.349 11.547 36.573 1.0 67.69 ? 50 GLU A OE1 1 21 . A ATOM 150 O OE2 . GLU A 1 21 ? 62.820 13.171 36.718 1.0 67.55 ? 50 GLU A OE2 1 21 . A ATOM 151 N N . ASN A 1 22 ? 57.900 14.938 33.550 1.0 46.47 ? 51 ASN A N 1 22 . A ATOM 152 C CA . ASN A 1 22 ? 57.442 16.333 33.619 1.0 38.99 ? 51 ASN A CA 1 22 . A ATOM 153 C C . ASN A 1 22 ? 56.441 16.587 34.744 1.0 31.48 ? 51 ASN A C 1 22 . A ATOM 154 O O . ASN A 1 22 ? 55.229 16.602 34.554 1.0 23.06 ? 51 ASN A O 1 22 . A ATOM 155 C CB . ASN A 1 22 ? 56.895 16.797 32.257 1.0 43.58 ? 51 ASN A CB 1 22 . A ATOM 156 C CG . ASN A 1 22 ? 57.973 17.438 31.376 1.0 48.78 ? 51 ASN A CG 1 22 . A ATOM 157 O OD1 . ASN A 1 22 ? 58.805 18.225 31.851 1.0 53.89 ? 51 ASN A OD1 1 22 . A ATOM 158 N ND2 . ASN A 1 22 ? 57.945 17.128 30.086 1.0 51.01 ? 51 ASN A ND2 1 22 . A ATOM 159 N N . SER A 1 23 ? 56.988 16.787 35.921 1.0 28.97 ? 52 SER A N 1 23 . A ATOM 160 C CA . SER A 1 23 ? 56.161 16.923 37.114 1.0 28.76 ? 52 SER A CA 1 23 . A ATOM 161 C C . SER A 1 23 ? 56.792 17.914 38.035 1.0 26.44 ? 52 SER A C 1 23 . A ATOM 162 O O . SER A 1 23 ? 57.957 18.285 37.889 1.0 25.02 ? 52 SER A O 1 23 . A ATOM 163 C CB . SER A 1 23 ? 56.067 15.590 37.838 1.0 31.55 ? 52 SER A CB 1 23 . A ATOM 164 O OG . SER A 1 23 ? 57.367 15.202 38.277 1.0 37.51 ? 52 SER A OG 1 23 . A ATOM 165 N N . ALA A 1 24 ? 56.031 18.325 39.033 1.0 22.81 ? 53 ALA A N 1 24 . A ATOM 166 C CA . ALA A 1 24 ? 56.594 19.151 40.071 1.0 23.42 ? 53 ALA A CA 1 24 . A ATOM 167 C C . ALA A 1 24 ? 55.923 18.702 41.333 1.0 23.99 ? 53 ALA A C 1 24 . A ATOM 168 O O . ALA A 1 24 ? 54.710 18.669 41.382 1.0 23.66 ? 53 ALA A O 1 24 . A ATOM 169 C CB . ALA A 1 24 ? 56.340 20.623 39.822 1.0 25.62 ? 53 ALA A CB 1 24 . A ATOM 170 N N . SER A 1 25 ? 56.712 18.305 42.326 1.0 23.85 ? 54 SER A N 1 25 . A ATOM 171 C CA . SER A 1 25 ? 56.128 17.880 43.574 1.0 25.36 ? 54 SER A CA 1 25 . A ATOM 172 C C . SER A 1 25 ? 56.405 18.906 44.657 1.0 25.35 ? 54 SER A C 1 25 . A ATOM 173 O O . SER A 1 25 ? 57.417 19.631 44.639 1.0 24.87 ? 54 SER A O 1 25 . A ATOM 174 C CB . SER A 1 25 ? 56.645 16.513 43.943 1.0 29.37 ? 54 SER A CB 1 25 . A ATOM 175 O OG . SER A 1 25 ? 58.030 16.614 44.178 1.0 33.35 ? 54 SER A OG 1 25 . A ATOM 176 N N . VAL A 1 26 ? 55.489 18.977 45.608 1.0 23.86 ? 55 VAL A N 1 26 . A ATOM 177 C CA . VAL A 1 26 ? 55.666 19.910 46.690 1.0 25.12 ? 55 VAL A CA 1 26 . A ATOM 178 C C . VAL A 1 26 ? 54.986 19.387 47.938 1.0 21.84 ? 55 VAL A C 1 26 . A ATOM 179 O O . VAL A 1 26 ? 53.957 18.767 47.876 1.0 21.77 ? 55 VAL A O 1 26 . A ATOM 180 C CB . VAL A 1 26 ? 55.195 21.320 46.329 1.0 27.63 ? 55 VAL A CB 1 26 . A ATOM 181 C CG1 . VAL A 1 26 ? 53.686 21.357 46.152 1.0 28.04 ? 55 VAL A CG1 1 26 . A ATOM 182 C CG2 . VAL A 1 26 ? 55.660 22.331 47.366 1.0 28.43 ? 55 VAL A CG2 1 26 . A ATOM 183 N N . ASN A 1 27 ? 55.662 19.523 49.069 1.0 22.99 ? 56 ASN A N 1 27 . A ATOM 184 C CA . ASN A 1 27 ? 55.116 19.040 50.317 1.0 26.89 ? 56 ASN A CA 1 27 . A ATOM 185 C C . ASN A 1 27 ? 54.500 20.235 51.000 1.0 25.54 ? 56 ASN A C 1 27 . A ATOM 186 O O . ASN A 1 27 ? 55.101 21.290 51.014 1.0 27.27 ? 56 ASN A O 1 27 . A ATOM 187 C CB . ASN A 1 27 ? 56.231 18.474 51.177 1.0 30.6 ? 56 ASN A CB 1 27 . A ATOM 188 C CG . ASN A 1 27 ? 56.954 17.335 50.501 1.0 36.49 ? 56 ASN A CG 1 27 . A ATOM 189 O OD1 . ASN A 1 27 ? 56.366 16.288 50.231 1.0 40.12 ? 56 ASN A OD1 1 27 . A ATOM 190 N ND2 . ASN A 1 27 ? 58.245 17.529 50.222 1.0 41.32 ? 56 ASN A ND2 1 27 . A ATOM 191 N N . LEU A 1 28 ? 53.298 20.063 51.534 1.0 21.56 ? 57 LEU A N 1 28 . A ATOM 192 C CA . LEU A 1 28 ? 52.621 21.096 52.310 1.0 21.04 ? 57 LEU A CA 1 28 . A ATOM 193 C C . LEU A 1 28 ? 52.738 20.617 53.747 1.0 21.66 ? 57 LEU A C 1 28 . A ATOM 194 O O . LEU A 1 28 ? 51.992 19.733 54.197 1.0 21.0 ? 57 LEU A O 1 28 . A ATOM 195 C CB . LEU A 1 28 ? 51.168 21.263 51.859 1.0 22.08 ? 57 LEU A CB 1 28 . A ATOM 196 C CG . LEU A 1 28 ? 50.913 21.709 50.417 1.0 22.58 ? 57 LEU A CG 1 28 . A ATOM 197 C CD1 . LEU A 1 28 ? 49.441 21.642 50.102 1.0 20.5 ? 57 LEU A CD1 1 28 . A ATOM 198 C CD2 . LEU A 1 28 ? 51.514 23.037 50.021 1.0 23.84 ? 57 LEU A CD2 1 28 . A ATOM 199 N N . SER A 1 29 ? 53.759 21.135 54.419 1.0 22.83 ? 58 SER A N 1 29 . A ATOM 200 C CA A SER A 1 29 ? 54.090 20.735 55.783 0.61 23.69 ? 58 SER A CA 1 29 . A ATOM 201 C CA B SER A 1 29 ? 54.053 20.747 55.790 0.39 22.9 ? 58 SER A CA 1 29 . A ATOM 202 C C . SER A 1 29 ? 54.411 21.966 56.634 1.0 23.39 ? 58 SER A C 1 29 . A ATOM 203 O O . SER A 1 29 ? 54.987 22.923 56.140 1.0 24.9 ? 58 SER A O 1 29 . A ATOM 204 C CB A SER A 1 29 ? 55.292 19.789 55.808 0.61 24.8 ? 58 SER A CB 1 29 . A ATOM 205 C CB B SER A 1 29 ? 55.190 19.730 55.847 0.39 22.72 ? 58 SER A CB 1 29 . A ATOM 206 O OG A SER A 1 29 ? 56.492 20.472 55.462 0.61 26.62 ? 58 SER A OG 1 29 . A ATOM 207 O OG B SER A 1 29 ? 55.255 19.133 57.128 0.39 21.77 ? 58 SER A OG 1 29 . A ATOM 208 N N . ASN A 1 30 ? 54.027 21.903 57.893 1.0 25.45 ? 59 ASN A N 1 30 . A ATOM 209 C CA A ASN A 1 30 ? 54.389 22.913 58.912 0.49 27.22 ? 59 ASN A CA 1 30 . A ATOM 210 C CA B ASN A 1 30 ? 54.402 22.914 58.905 0.51 27.74 ? 59 ASN A CA 1 30 . A ATOM 211 C C . ASN A 1 30 ? 53.868 24.301 58.557 1.0 28.7 ? 59 ASN A C 1 30 . A ATOM 212 O O . ASN A 1 30 ? 54.503 25.313 58.864 1.0 28.9 ? 59 ASN A O 1 30 . A ATOM 213 C CB A ASN A 1 30 ? 55.911 22.951 59.137 0.49 29.04 ? 59 ASN A CB 1 30 . A ATOM 214 C CB B ASN A 1 30 ? 55.930 22.982 59.094 0.51 30.46 ? 59 ASN A CB 1 30 . A ATOM 215 C CG A ASN A 1 30 ? 56.295 23.568 60.482 0.49 28.73 ? 59 ASN A CG 1 30 . A ATOM 216 C CG B ASN A 1 30 ? 56.550 21.637 59.444 0.51 31.0 ? 59 ASN A CG 1 30 . A ATOM 217 O OD1 A ASN A 1 30 ? 55.632 23.349 61.486 0.49 27.81 ? 59 ASN A OD1 1 30 . A ATOM 218 O OD1 B ASN A 1 30 ? 56.048 20.901 60.299 0.51 34.66 ? 59 ASN A OD1 1 30 . A ATOM 219 N ND2 A ASN A 1 30 ? 57.375 24.336 60.497 0.49 30.14 ? 59 ASN A ND2 1 30 . A ATOM 220 N ND2 B ASN A 1 30 ? 57.662 21.322 58.799 0.51 31.37 ? 59 ASN A ND2 1 30 . A ATOM 221 N N . LEU A 1 31 ? 52.698 24.333 57.910 1.0 28.69 ? 60 LEU A N 1 31 . A ATOM 222 C CA . LEU A 1 31 ? 52.103 25.577 57.463 1.0 26.72 ? 60 LEU A CA 1 31 . A ATOM 223 C C . LEU A 1 31 ? 51.032 26.046 58.404 1.0 26.14 ? 60 LEU A C 1 31 . A ATOM 224 O O . LEU A 1 31 ? 50.527 25.295 59.248 1.0 28.11 ? 60 LEU A O 1 31 . A ATOM 225 C CB . LEU A 1 31 ? 51.502 25.386 56.072 1.0 26.74 ? 60 LEU A CB 1 31 . A ATOM 226 C CG . LEU A 1 31 ? 52.444 24.880 54.994 1.0 25.86 ? 60 LEU A CG 1 31 . A ATOM 227 C CD1 . LEU A 1 31 ? 51.651 24.727 53.689 1.0 24.89 ? 60 LEU A CD1 1 31 . A ATOM 228 C CD2 . LEU A 1 31 ? 53.695 25.743 54.848 1.0 29.27 ? 60 LEU A CD2 1 31 . A ATOM 229 N N . LYS A 1 32 ? 50.680 27.319 58.251 1.0 21.74 ? 61 LYS A N 1 32 . A ATOM 230 C CA . LYS A 1 32 ? 49.635 27.908 59.016 1.0 23.25 ? 61 LYS A CA 1 32 . A ATOM 231 C C . LYS A 1 32 ? 48.838 28.761 58.027 1.0 18.81 ? 61 LYS A C 1 32 . A ATOM 232 O O . LYS A 1 32 ? 49.427 29.168 57.037 1.0 17.82 ? 61 LYS A O 1 32 . A ATOM 233 C CB . LYS A 1 32 ? 50.174 28.770 60.150 1.0 28.9 ? 61 LYS A CB 1 32 . A ATOM 234 C CG . LYS A 1 32 ? 51.183 29.837 59.731 1.0 31.91 ? 61 LYS A CG 1 32 . A ATOM 235 C CD . LYS A 1 32 ? 51.890 30.480 60.935 1.0 33.85 ? 61 LYS A CD 1 32 . A ATOM 236 C CE . LYS A 1 32 ? 51.043 31.524 61.653 1.0 34.63 ? 61 LYS A CE 1 32 . A ATOM 237 N NZ . LYS A 1 32 ? 50.682 32.705 60.799 1.0 35.01 ? 61 LYS A NZ 1 32 . A ATOM 238 N N . PRO A 1 33 ? 47.552 28.959 58.322 1.0 19.15 ? 62 PRO A N 1 33 . A ATOM 239 C CA . PRO A 1 33 ? 46.781 29.818 57.443 1.0 16.41 ? 62 PRO A CA 1 33 . A ATOM 240 C C . PRO A 1 33 ? 47.494 31.118 57.059 1.0 16.23 ? 62 PRO A C 1 33 . A ATOM 241 O O . PRO A 1 33 ? 48.183 31.779 57.865 1.0 19.19 ? 62 PRO A O 1 33 . A ATOM 242 C CB . PRO A 1 33 ? 45.477 29.948 58.195 1.0 16.98 ? 62 PRO A CB 1 33 . A ATOM 243 C CG . PRO A 1 33 ? 45.312 28.630 58.941 1.0 17.04 ? 62 PRO A CG 1 33 . A ATOM 244 C CD . PRO A 1 33 ? 46.708 28.474 59.442 1.0 18.72 ? 62 PRO A CD 1 33 . A ATOM 245 N N . GLY A 1 34 ? 47.301 31.475 55.794 1.0 15.18 ? 63 GLY A N 1 34 . A ATOM 246 C CA . GLY A 1 34 ? 47.856 32.686 55.191 1.0 17.9 ? 63 GLY A CA 1 34 . A ATOM 247 C C . GLY A 1 34 ? 49.212 32.482 54.551 1.0 19.65 ? 63 GLY A C 1 34 . A ATOM 248 O O . GLY A 1 34 ? 49.662 33.334 53.742 1.0 22.26 ? 63 GLY A O 1 34 . A ATOM 249 N N . ASP A 1 35 ? 49.884 31.354 54.839 1.0 17.6 ? 64 ASP A N 1 35 . A ATOM 250 C CA . ASP A 1 35 ? 51.191 31.059 54.222 1.0 19.85 ? 64 ASP A CA 1 35 . A ATOM 251 C C . ASP A 1 35 ? 50.999 30.773 52.711 1.0 21.22 ? 64 ASP A C 1 35 . A ATOM 252 O O . ASP A 1 35 ? 49.938 30.281 52.259 1.0 21.7 ? 64 ASP A O 1 35 . A ATOM 253 C CB . ASP A 1 35 ? 51.912 29.819 54.833 1.0 21.06 ? 64 ASP A CB 1 35 . A ATOM 254 C CG . ASP A 1 35 ? 52.456 30.031 56.256 1.0 23.85 ? 64 ASP A CG 1 35 . A ATOM 255 O OD1 . ASP A 1 35 ? 52.368 31.149 56.814 1.0 26.18 ? 64 ASP A OD1 1 35 . A ATOM 256 O OD2 . ASP A 1 35 ? 52.904 28.979 56.825 1.0 25.99 ? 64 ASP A OD2 1 35 . A ATOM 257 N N . LYS A 1 36 ? 52.045 31.097 51.967 1.0 22.48 ? 65 LYS A N 1 36 . A ATOM 258 C CA . LYS A 1 36 ? 52.085 31.004 50.528 1.0 22.38 ? 65 LYS A CA 1 36 . A ATOM 259 C C . LYS A 1 36 ? 53.368 30.315 50.054 1.0 21.31 ? 65 LYS A C 1 36 . A ATOM 260 O O . LYS A 1 36 ? 54.411 30.339 50.743 1.0 23.55 ? 65 LYS A O 1 36 . A ATOM 261 C CB . LYS A 1 36 ? 52.013 32.403 49.907 1.0 26.0 ? 65 LYS A CB 1 36 . A ATOM 262 C CG . LYS A 1 36 ? 50.744 33.203 50.198 1.0 30.02 ? 65 LYS A CG 1 36 . A ATOM 263 C CD . LYS A 1 36 ? 50.793 34.530 49.433 1.0 34.88 ? 65 LYS A CD 1 36 . A ATOM 264 C CE . LYS A 1 36 ? 49.597 35.425 49.714 1.0 35.3 ? 65 LYS A CE 1 36 . A ATOM 265 N NZ . LYS A 1 36 ? 49.628 36.698 48.901 1.0 35.82 ? 65 LYS A NZ 1 36 . A ATOM 266 N N . LEU A 1 37 ? 53.280 29.657 48.904 1.0 18.8 ? 66 LEU A N 1 37 . A ATOM 267 C CA . LEU A 1 37 ? 54.422 28.974 48.303 1.0 19.78 ? 66 LEU A CA 1 37 . A ATOM 268 C C . LEU A 1 37 ? 54.374 29.376 46.833 1.0 20.8 ? 66 LEU A C 1 37 . A ATOM 269 O O . LEU A 1 37 ? 53.313 29.280 46.217 1.0 21.47 ? 66 LEU A O 1 37 . A ATOM 270 C CB . LEU A 1 37 ? 54.303 27.455 48.424 1.0 23.21 ? 66 LEU A CB 1 37 . A ATOM 271 C CG . LEU A 1 37 ? 54.765 26.789 49.731 1.0 25.39 ? 66 LEU A CG 1 37 . A ATOM 272 C CD1 . LEU A 1 37 ? 54.598 25.281 49.614 1.0 27.33 ? 66 LEU A CD1 1 37 . A ATOM 273 C CD2 . LEU A 1 37 ? 56.218 27.152 50.071 1.0 26.0 ? 66 LEU A CD2 1 37 . A ATOM 274 N N . THR A 1 38 ? 55.482 29.878 46.295 1.0 21.86 ? 67 THR A N 1 38 . A ATOM 275 C CA . THR A 1 38 ? 55.516 30.376 44.907 1.0 22.66 ? 67 THR A CA 1 38 . A ATOM 276 C C . THR A 1 38 ? 56.536 29.572 44.108 1.0 22.13 ? 67 THR A C 1 38 . A ATOM 277 O O . THR A 1 38 ? 57.501 29.015 44.656 1.0 26.56 ? 67 THR A O 1 38 . A ATOM 278 C CB . THR A 1 38 ? 55.796 31.909 44.830 1.0 27.11 ? 67 THR A CB 1 38 . A ATOM 279 O OG1 . THR A 1 38 ? 54.912 32.622 45.706 1.0 33.5 ? 67 THR A OG1 1 38 . A ATOM 280 C CG2 . THR A 1 38 ? 55.568 32.448 43.437 1.0 29.7 ? 67 THR A CG2 1 38 . A ATOM 281 N N . LYS A 1 39 ? 56.307 29.416 42.818 1.0 23.59 ? 68 LYS A N 1 39 . A ATOM 282 C CA . LYS A 1 39 ? 57.287 28.746 41.928 1.0 24.61 ? 68 LYS A CA 1 39 . A ATOM 283 C C . LYS A 1 39 ? 57.069 29.152 40.493 1.0 25.22 ? 68 LYS A C 1 39 . A ATOM 284 O O . LYS A 1 39 ? 55.933 29.156 40.017 1.0 23.5 ? 68 LYS A O 1 39 . A ATOM 285 C CB . LYS A 1 39 ? 57.204 27.209 41.998 1.0 27.78 ? 68 LYS A CB 1 39 . A ATOM 286 C CG . LYS A 1 39 ? 58.354 26.443 41.307 1.0 30.99 ? 68 LYS A CG 1 39 . A ATOM 287 C CD . LYS A 1 39 ? 59.411 25.912 42.274 1.0 33.85 ? 68 LYS A CD 1 39 . A ATOM 288 C CE . LYS A 1 39 ? 60.599 25.253 41.553 1.0 36.96 ? 68 LYS A CE 1 39 . A ATOM 289 N NZ . LYS A 1 39 ? 61.860 26.064 41.520 1.0 38.53 ? 68 LYS A NZ 1 39 . A ATOM 290 N N . ASP A 1 40 ? 58.175 29.497 39.814 1.0 25.22 ? 69 ASP A N 1 40 . A ATOM 291 C CA . ASP A 1 40 ? 58.179 29.789 38.381 1.0 25.28 ? 69 ASP A CA 1 40 . A ATOM 292 C C . ASP A 1 40 ? 58.602 28.554 37.580 1.0 25.3 ? 69 ASP A C 1 40 . A ATOM 293 O O . ASP A 1 40 ? 59.444 27.749 38.046 1.0 24.29 ? 69 ASP A O 1 40 . A ATOM 294 C CB . ASP A 1 40 ? 59.152 30.934 38.072 1.0 28.58 ? 69 ASP A CB 1 40 . A ATOM 295 C CG . ASP A 1 40 ? 58.810 32.220 38.787 1.0 34.46 ? 69 ASP A CG 1 40 . A ATOM 296 O OD1 . ASP A 1 40 ? 57.634 32.442 39.093 1.0 34.19 ? 69 ASP A OD1 1 40 . A ATOM 297 O OD2 . ASP A 1 40 ? 59.729 33.040 39.008 1.0 41.07 ? 69 ASP A OD2 1 40 . A ATOM 298 N N . PHE A 1 41 ? 58.037 28.410 36.380 1.0 21.99 ? 70 PHE A N 1 41 . A ATOM 299 C CA . PHE A 1 41 ? 58.342 27.287 35.478 1.0 22.92 ? 70 PHE A CA 1 41 . A ATOM 300 C C . PHE A 1 41 ? 58.585 27.807 34.073 1.0 23.48 ? 70 PHE A C 1 41 . A ATOM 301 O O . PHE A 1 41 ? 57.841 28.676 33.588 1.0 23.35 ? 70 PHE A O 1 41 . A ATOM 302 C CB . PHE A 1 41 ? 57.181 26.298 35.395 1.0 23.56 ? 70 PHE A CB 1 41 . A ATOM 303 C CG . PHE A 1 41 ? 56.879 25.615 36.670 1.0 24.8 ? 70 PHE A CG 1 41 . A ATOM 304 C CD1 . PHE A 1 41 ? 57.546 24.442 37.004 1.0 28.75 ? 70 PHE A CD1 1 41 . A ATOM 305 C CD2 . PHE A 1 41 ? 55.933 26.123 37.545 1.0 26.83 ? 70 PHE A CD2 1 41 . A ATOM 306 C CE1 . PHE A 1 41 ? 57.292 23.786 38.195 1.0 32.0 ? 70 PHE A CE1 1 41 . A ATOM 307 C CE2 . PHE A 1 41 ? 55.676 25.455 38.751 1.0 27.21 ? 70 PHE A CE2 1 41 . A ATOM 308 C CZ . PHE A 1 41 ? 56.343 24.289 39.059 1.0 30.8 ? 70 PHE A CZ 1 41 . A ATOM 309 N N . GLN A 1 42 ? 59.606 27.266 33.410 1.0 26.09 ? 71 GLN A N 1 42 . A ATOM 310 C CA . GLN A 1 42 ? 59.865 27.608 31.997 1.0 27.33 ? 71 GLN A CA 1 42 . A ATOM 311 C C . GLN A 1 42 ? 59.847 26.308 31.186 1.0 25.05 ? 71 GLN A C 1 42 . A ATOM 312 O O . GLN A 1 42 ? 60.384 25.286 31.583 1.0 29.63 ? 71 GLN A O 1 42 . A ATOM 313 C CB . GLN A 1 42 ? 61.189 28.383 31.813 1.0 28.74 ? 71 GLN A CB 1 42 . A ATOM 314 N N . PHE A 1 43 ? 59.129 26.347 30.066 1.0 28.56 ? 72 PHE A N 1 43 . A ATOM 315 C CA . PHE A 1 43 ? 58.994 25.207 29.182 1.0 32.26 ? 72 PHE A CA 1 43 . A ATOM 316 C C . PHE A 1 43 ? 60.085 25.287 28.124 1.0 36.44 ? 72 PHE A C 1 43 . A ATOM 317 O O . PHE A 1 43 ? 60.187 26.294 27.418 1.0 38.42 ? 72 PHE A O 1 43 . A ATOM 318 C CB . PHE A 1 43 ? 57.605 25.207 28.512 1.0 32.2 ? 72 PHE A CB 1 43 . A ATOM 319 C CG . PHE A 1 43 ? 56.449 25.122 29.477 1.0 33.95 ? 72 PHE A CG 1 43 . A ATOM 320 C CD1 . PHE A 1 43 ? 56.439 24.191 30.518 1.0 36.18 ? 72 PHE A CD1 1 43 . A ATOM 321 C CD2 . PHE A 1 43 ? 55.344 25.950 29.328 1.0 35.03 ? 72 PHE A CD2 1 43 . A ATOM 322 C CE1 . PHE A 1 43 ? 55.372 24.118 31.417 1.0 35.09 ? 72 PHE A CE1 1 43 . A ATOM 323 C CE2 . PHE A 1 43 ? 54.270 25.863 30.192 1.0 33.99 ? 72 PHE A CE2 1 43 . A ATOM 324 C CZ . PHE A 1 43 ? 54.282 24.944 31.245 1.0 35.83 ? 72 PHE A CZ 1 43 . A ATOM 325 N N . GLU A 1 44 ? 60.912 24.246 28.039 1.0 36.68 ? 73 GLU A N 1 44 . A ATOM 326 C CA . GLU A 1 44 ? 61.988 24.176 27.036 1.0 40.38 ? 73 GLU A CA 1 44 . A ATOM 327 C C . GLU A 1 44 ? 61.654 23.135 25.992 1.0 40.71 ? 73 GLU A C 1 44 . A ATOM 328 O O . GLU A 1 44 ? 61.041 22.101 26.275 1.0 38.49 ? 73 GLU A O 1 44 . A ATOM 329 C CB . GLU A 1 44 ? 63.351 23.890 27.671 1.0 39.98 ? 73 GLU A CB 1 44 . A ATOM 330 C CG . GLU A 1 44 ? 64.064 25.151 28.138 1.0 40.77 ? 73 GLU A CG 1 44 . A ATOM 331 C CD . GLU A 1 44 ? 65.563 24.987 28.349 1.0 45.69 ? 73 GLU A CD 1 44 . A ATOM 332 O OE1 . GLU A 1 44 ? 66.150 23.978 27.891 1.0 51.12 ? 73 GLU A OE1 1 44 . A ATOM 333 O OE2 . GLU A 1 44 ? 66.168 25.899 28.968 1.0 48.4 ? 73 GLU A OE2 1 44 . A ATOM 334 N N . ASN A 1 45 ? 62.060 23.430 24.766 1.0 46.19 ? 74 ASN A N 1 45 . A ATOM 335 C CA . ASN A 1 45 ? 61.669 22.648 23.612 1.0 49.96 ? 74 ASN A CA 1 45 . A ATOM 336 C C . ASN A 1 45 ? 62.774 22.831 22.582 1.0 51.17 ? 74 ASN A C 1 45 . A ATOM 337 O O . ASN A 1 45 ? 62.601 23.493 21.549 1.0 53.2 ? 74 ASN A O 1 45 . A ATOM 338 C CB . ASN A 1 45 ? 60.301 23.142 23.104 1.0 50.51 ? 74 ASN A CB 1 45 . A ATOM 339 C CG . ASN A 1 45 ? 59.700 22.238 22.044 1.0 52.16 ? 74 ASN A CG 1 45 . A ATOM 340 O OD1 . ASN A 1 45 ? 60.035 21.045 21.952 1.0 57.97 ? 74 ASN A OD1 1 45 . A ATOM 341 N ND2 . ASN A 1 45 ? 58.790 22.795 21.242 1.0 48.93 ? 74 ASN A ND2 1 45 . A ATOM 342 N N . ASN A 1 46 ? 63.924 22.238 22.894 1.0 50.55 ? 75 ASN A N 1 46 . A ATOM 343 C CA . ASN A 1 46 ? 65.154 22.440 22.111 1.0 48.51 ? 75 ASN A CA 1 46 . A ATOM 344 C C . ASN A 1 46 ? 65.204 21.678 20.798 1.0 48.79 ? 75 ASN A C 1 46 . A ATOM 345 O O . ASN A 1 46 ? 66.036 21.997 19.936 1.0 44.24 ? 75 ASN A O 1 46 . A ATOM 346 C CB . ASN A 1 46 ? 66.381 22.109 22.965 1.0 48.41 ? 75 ASN A CB 1 46 . A ATOM 347 C CG . ASN A 1 46 ? 66.517 23.036 24.151 1.0 48.47 ? 75 ASN A CG 1 46 . A ATOM 348 O OD1 . ASN A 1 46 ? 66.631 22.594 25.294 1.0 43.82 ? 75 ASN A OD1 1 46 . A ATOM 349 N ND2 . ASN A 1 46 ? 66.477 24.333 23.887 1.0 48.11 ? 75 ASN A ND2 1 46 . A ATOM 350 N N . GLY A 1 47 ? 64.333 20.682 20.638 1.0 51.21 ? 76 GLY A N 1 47 . A ATOM 351 C CA . GLY A 1 47 ? 64.143 20.019 19.344 1.0 51.61 ? 76 GLY A CA 1 47 . A ATOM 352 C C . GLY A 1 47 ? 63.079 20.664 18.476 1.0 50.26 ? 76 GLY A C 1 47 . A ATOM 353 O O . GLY A 1 47 ? 62.907 20.275 17.317 1.0 49.14 ? 76 GLY A O 1 47 . A ATOM 354 N N . SER A 1 48 ? 62.394 21.671 19.025 1.0 49.69 ? 77 SER A N 1 48 . A ATOM 355 C CA . SER A 1 48 ? 61.186 22.265 18.438 1.0 49.8 ? 77 SER A CA 1 48 . A ATOM 356 C C . SER A 1 48 ? 60.207 21.198 17.927 1.0 48.15 ? 77 SER A C 1 48 . A ATOM 357 O O . SER A 1 48 ? 60.067 20.968 16.726 1.0 46.79 ? 77 SER A O 1 48 . A ATOM 358 C CB . SER A 1 48 ? 61.498 23.372 17.397 1.0 49.44 ? 77 SER A CB 1 48 . A ATOM 359 O OG . SER A 1 48 ? 62.829 23.360 16.925 1.0 49.16 ? 77 SER A OG 1 48 . A ATOM 360 N N . LEU A 1 49 ? 59.572 20.522 18.882 1.0 47.47 ? 78 LEU A N 1 49 . A ATOM 361 C CA . LEU A 1 49 ? 58.412 19.678 18.597 1.0 46.31 ? 78 LEU A CA 1 49 . A ATOM 362 C C . LEU A 1 49 ? 57.206 20.559 18.331 1.0 41.93 ? 78 LEU A C 1 49 . A ATOM 363 O O . LEU A 1 49 ? 57.154 21.726 18.766 1.0 43.07 ? 78 LEU A O 1 49 . A ATOM 364 C CB . LEU A 1 49 ? 58.100 18.724 19.756 1.0 47.16 ? 78 LEU A CB 1 49 . A ATOM 365 C CG . LEU A 1 49 ? 59.077 17.564 19.978 1.0 48.91 ? 78 LEU A CG 1 49 . A ATOM 366 C CD1 . LEU A 1 49 ? 58.761 16.858 21.289 1.0 48.97 ? 78 LEU A CD1 1 49 . A ATOM 367 C CD2 . LEU A 1 49 ? 59.056 16.573 18.819 1.0 47.64 ? 78 LEU A CD2 1 49 . A ATOM 368 N N . ALA A 1 50 ? 56.245 19.972 17.618 1.0 35.3 ? 79 ALA A N 1 50 . A ATOM 369 C CA . ALA A 1 50 ? 54.992 20.606 17.271 1.0 32.32 ? 79 ALA A CA 1 50 . A ATOM 370 C C . ALA A 1 50 ? 53.967 20.487 18.406 1.0 29.38 ? 79 ALA A C 1 50 . A ATOM 371 O O . ALA A 1 50 ? 53.005 19.723 18.314 1.0 25.55 ? 79 ALA A O 1 50 . A ATOM 372 C CB . ALA A 1 50 ? 54.442 19.982 15.996 1.0 33.03 ? 79 ALA A CB 1 50 . A ATOM 373 N N . ILE A 1 51 ? 54.161 21.305 19.433 1.0 27.07 ? 80 ILE A N 1 51 . A ATOM 374 C CA . ILE A 1 51 ? 53.312 21.268 20.652 1.0 26.02 ? 80 ILE A CA 1 51 . A ATOM 375 C C . ILE A 1 51 ? 52.143 22.261 20.597 1.0 21.15 ? 80 ILE A C 1 51 . A ATOM 376 O O . ILE A 1 51 ? 52.345 23.480 20.440 1.0 23.07 ? 80 ILE A O 1 51 . A ATOM 377 C CB . ILE A 1 51 ? 54.171 21.575 21.901 1.0 27.3 ? 80 ILE A CB 1 51 . A ATOM 378 C CG1 . ILE A 1 51 ? 55.338 20.585 22.017 1.0 30.54 ? 80 ILE A CG1 1 51 . A ATOM 379 C CG2 . ILE A 1 51 ? 53.325 21.514 23.187 1.0 27.39 ? 80 ILE A CG2 1 51 . A ATOM 380 C CD1 . ILE A 1 51 ? 56.505 21.121 22.811 1.0 29.88 ? 80 ILE A CD1 1 51 . A ATOM 381 N N . LYS A 1 52 ? 50.912 21.755 20.736 1.0 17.83 ? 81 LYS A N 1 52 . A ATOM 382 C CA . LYS A 1 52 ? 49.741 22.580 20.781 1.0 16.05 ? 81 LYS A CA 1 52 . A ATOM 383 C C . LYS A 1 52 ? 49.377 23.078 22.179 1.0 15.5 ? 81 LYS A C 1 52 . A ATOM 384 O O . LYS A 1 52 ? 49.058 24.265 22.342 1.0 17.81 ? 81 LYS A O 1 52 . A ATOM 385 C CB . LYS A 1 52 ? 48.544 21.873 20.135 1.0 16.82 ? 81 LYS A CB 1 52 . A ATOM 386 C CG . LYS A 1 52 ? 47.296 22.711 20.092 1.0 18.04 ? 81 LYS A CG 1 52 . A ATOM 387 C CD . LYS A 1 52 ? 46.163 22.031 19.355 1.0 18.8 ? 81 LYS A CD 1 52 . A ATOM 388 C CE . LYS A 1 52 ? 45.592 20.818 20.079 1.0 19.68 ? 81 LYS A CE 1 52 . A ATOM 389 N NZ . LYS A 1 52 ? 44.255 20.447 19.525 1.0 21.46 ? 81 LYS A NZ 1 52 . A ATOM 390 N N . GLU A 1 53 ? 49.392 22.175 23.154 1.0 15.13 ? 82 GLU A N 1 53 . A ATOM 391 C CA . GLU A 1 53 ? 48.959 22.515 24.546 1.0 15.76 ? 82 GLU A CA 1 53 . A ATOM 392 C C . GLU A 1 53 ? 49.960 21.913 25.473 1.0 14.62 ? 82 GLU A C 1 53 . A ATOM 393 O O . GLU A 1 53 ? 50.631 20.914 25.098 1.0 14.07 ? 82 GLU A O 1 53 . A ATOM 394 C CB . GLU A 1 53 ? 47.575 21.976 24.909 1.0 16.97 ? 82 GLU A CB 1 53 . A ATOM 395 C CG . GLU A 1 53 ? 46.438 22.209 23.913 1.0 20.43 ? 82 GLU A CG 1 53 . A ATOM 396 C CD . GLU A 1 53 ? 45.438 21.061 23.938 1.0 25.83 ? 82 GLU A CD 1 53 . A ATOM 397 O OE1 . GLU A 1 53 ? 44.267 21.360 24.276 1.0 29.67 ? 82 GLU A OE1 1 53 . A ATOM 398 O OE2 . GLU A 1 53 ? 45.785 19.862 23.647 1.0 27.19 ? 82 GLU A OE2 1 53 . A ATOM 399 N N . VAL A 1 54 ? 49.957 22.422 26.699 1.0 14.83 ? 83 VAL A N 1 54 . A ATOM 400 C CA . VAL A 1 54 ? 50.662 21.749 27.784 1.0 15.27 ? 83 VAL A CA 1 54 . A ATOM 401 C C . VAL A 1 54 ? 49.621 21.636 28.874 1.0 13.96 ? 83 VAL A C 1 54 . A ATOM 402 O O . VAL A 1 54 ? 49.201 22.681 29.418 1.0 13.38 ? 83 VAL A O 1 54 . A ATOM 403 C CB . VAL A 1 54 ? 51.952 22.460 28.214 1.0 15.92 ? 83 VAL A CB 1 54 . A ATOM 404 C CG1 . VAL A 1 54 ? 52.543 21.787 29.474 1.0 16.34 ? 83 VAL A CG1 1 54 . A ATOM 405 C CG2 . VAL A 1 54 ? 52.932 22.477 27.059 1.0 17.49 ? 83 VAL A CG2 1 54 . A ATOM 406 N N . LEU A 1 55 ? 49.243 20.392 29.160 1.0 12.93 ? 84 LEU A N 1 55 . A ATOM 407 C CA . LEU A 1 55 ? 48.012 20.155 29.991 1.0 13.94 ? 84 LEU A CA 1 55 . A ATOM 408 C C . LEU A 1 55 ? 48.449 19.830 31.387 1.0 15.49 ? 84 LEU A C 1 55 . A ATOM 409 O O . LEU A 1 55 ? 49.136 18.849 31.588 1.0 15.8 ? 84 LEU A O 1 55 . A ATOM 410 C CB . LEU A 1 55 ? 47.089 19.100 29.406 1.0 14.64 ? 84 LEU A CB 1 55 . A ATOM 411 C CG . LEU A 1 55 ? 46.471 19.370 28.027 1.0 15.07 ? 84 LEU A CG 1 55 . A ATOM 412 C CD1 . LEU A 1 55 ? 45.527 18.297 27.435 1.0 15.49 ? 84 LEU A CD1 1 55 . A ATOM 413 C CD2 . LEU A 1 55 ? 45.764 20.722 28.073 1.0 15.42 ? 84 LEU A CD2 1 55 . A HETATM 414 N N . MSE A 1 56 ? 47.971 20.603 32.352 1.0 12.9 ? 85 MSE A N 1 56 . A HETATM 415 C CA . MSE A 1 56 ? 48.280 20.361 33.761 1.0 14.02 ? 85 MSE A CA 1 56 . A HETATM 416 C C . MSE A 1 56 ? 47.195 19.664 34.508 1.0 16.42 ? 85 MSE A C 1 56 . A HETATM 417 O O . MSE A 1 56 ? 45.982 19.882 34.317 1.0 16.87 ? 85 MSE A O 1 56 . A HETATM 418 C CB . MSE A 1 56 ? 48.533 21.723 34.422 1.0 15.99 ? 85 MSE A CB 1 56 . A HETATM 419 C CG . MSE A 1 56 ? 49.265 21.591 35.732 1.0 17.12 ? 85 MSE A CG 1 56 . A HETATM 420 SE SE . MSE A 1 56 ? 49.479 23.265 36.687 1.0 17.26 ? 85 MSE A SE 1 56 . A HETATM 421 C CE . MSE A 1 56 ? 47.618 23.506 37.167 1.0 20.39 ? 85 MSE A CE 1 56 . A ATOM 422 N N . ALA A 1 57 ? 47.644 18.801 35.414 1.0 16.69 ? 86 ALA A N 1 57 . A ATOM 423 C CA . ALA A 1 57 ? 46.737 18.081 36.313 1.0 15.65 ? 86 ALA A CA 1 57 . A ATOM 424 C C . ALA A 1 57 ? 47.381 18.033 37.702 1.0 15.85 ? 86 ALA A C 1 57 . A ATOM 425 O O . ALA A 1 57 ? 48.586 18.182 37.851 1.0 15.54 ? 86 ALA A O 1 57 . A ATOM 426 C CB . ALA A 1 57 ? 46.463 16.692 35.780 1.0 17.78 ? 86 ALA A CB 1 57 . A ATOM 427 N N . LEU A 1 58 ? 46.548 17.870 38.714 1.0 16.13 ? 87 LEU A N 1 58 . A ATOM 428 C CA . LEU A 1 58 ? 46.991 17.715 40.114 1.0 15.41 ? 87 LEU A CA 1 58 . A ATOM 429 C C . LEU A 1 58 ? 46.712 16.309 40.633 1.0 16.34 ? 87 LEU A C 1 58 . A ATOM 430 O O . LEU A 1 58 ? 45.644 15.760 40.379 1.0 18.0 ? 87 LEU A O 1 58 . A ATOM 431 C CB . LEU A 1 58 ? 46.255 18.700 40.970 1.0 16.2 ? 87 LEU A CB 1 58 . A ATOM 432 C CG . LEU A 1 58 ? 46.469 18.639 42.460 1.0 16.35 ? 87 LEU A CG 1 58 . A ATOM 433 C CD1 . LEU A 1 58 ? 47.933 18.819 42.827 1.0 18.42 ? 87 LEU A CD1 1 58 . A ATOM 434 C CD2 . LEU A 1 58 ? 45.591 19.720 43.095 1.0 18.36 ? 87 LEU A CD2 1 58 . A ATOM 435 N N . ASN A 1 59 ? 47.658 15.748 41.403 1.0 16.18 ? 88 ASN A N 1 59 . A ATOM 436 C CA . ASN A 1 59 ? 47.445 14.559 42.210 1.0 16.99 ? 88 ASN A CA 1 59 . A ATOM 437 C C . ASN A 1 59 ? 47.971 14.879 43.617 1.0 15.76 ? 88 ASN A C 1 59 . A ATOM 438 O O . ASN A 1 59 ? 48.709 15.868 43.846 1.0 15.84 ? 88 ASN A O 1 59 . A ATOM 439 C CB . ASN A 1 59 ? 48.151 13.292 41.638 1.0 18.63 ? 88 ASN A CB 1 59 . A ATOM 440 C CG . ASN A 1 59 ? 47.520 11.988 42.127 1.0 19.76 ? 88 ASN A CG 1 59 . A ATOM 441 O OD1 . ASN A 1 59 ? 46.566 11.995 42.928 1.0 18.5 ? 88 ASN A OD1 1 59 . A ATOM 442 N ND2 . ASN A 1 59 ? 47.985 10.857 41.566 1.0 21.99 ? 88 ASN A ND2 1 59 . A ATOM 443 N N . TYR A 1 60 ? 47.541 14.075 44.605 1.0 14.66 ? 89 TYR A N 1 60 . A ATOM 444 C CA . TYR A 1 60 ? 47.914 14.326 46.005 1.0 14.74 ? 89 TYR A CA 1 60 . A ATOM 445 C C . TYR A 1 60 ? 47.992 12.989 46.685 1.0 14.3 ? 89 TYR A C 1 60 . A ATOM 446 O O . TYR A 1 60 ? 47.433 12.014 46.228 1.0 15.52 ? 89 TYR A O 1 60 . A ATOM 447 C CB . TYR A 1 60 ? 46.910 15.196 46.786 1.0 13.95 ? 89 TYR A CB 1 60 . A ATOM 448 C CG . TYR A 1 60 ? 45.622 14.566 47.160 1.0 15.11 ? 89 TYR A CG 1 60 . A ATOM 449 C CD1 . TYR A 1 60 ? 44.563 14.598 46.321 1.0 14.15 ? 89 TYR A CD1 1 60 . A ATOM 450 C CD2 . TYR A 1 60 ? 45.523 13.786 48.313 1.0 16.73 ? 89 TYR A CD2 1 60 . A ATOM 451 C CE1 . TYR A 1 60 ? 43.325 14.053 46.654 1.0 14.11 ? 89 TYR A CE1 1 60 . A ATOM 452 C CE2 . TYR A 1 60 ? 44.315 13.189 48.650 1.0 18.22 ? 89 TYR A CE2 1 60 . A ATOM 453 C CZ . TYR A 1 60 ? 43.219 13.308 47.798 1.0 19.7 ? 89 TYR A CZ 1 60 . A ATOM 454 O OH . TYR A 1 60 ? 41.968 12.779 48.074 1.0 24.55 ? 89 TYR A OH 1 60 . A ATOM 455 N N . GLY A 1 61 ? 48.598 13.026 47.848 1.0 13.92 ? 90 GLY A N 1 61 . A ATOM 456 C CA . GLY A 1 61 ? 48.801 11.846 48.651 1.0 16.51 ? 90 GLY A CA 1 61 . A ATOM 457 C C . GLY A 1 61 ? 49.584 12.091 49.911 1.0 15.86 ? 90 GLY A C 1 61 . A ATOM 458 O O . GLY A 1 61 ? 50.097 13.197 50.206 1.0 17.47 ? 90 GLY A O 1 61 . A ATOM 459 N N . ASP A 1 62 ? 49.683 10.988 50.651 1.0 17.08 ? 91 ASP A N 1 62 . A ATOM 460 C CA . ASP A 1 62 ? 50.484 10.965 51.867 1.0 17.79 ? 91 ASP A CA 1 62 . A ATOM 461 C C . ASP A 1 62 ? 50.021 11.991 52.865 1.0 14.51 ? 91 ASP A C 1 62 . A ATOM 462 O O . ASP A 1 62 ? 50.824 12.664 53.555 1.0 17.85 ? 91 ASP A O 1 62 . A ATOM 463 C CB . ASP A 1 62 ? 51.964 11.235 51.563 1.0 20.64 ? 91 ASP A CB 1 62 . A ATOM 464 C CG . ASP A 1 62 ? 52.633 10.079 50.878 1.0 26.69 ? 91 ASP A CG 1 62 . A ATOM 465 O OD1 . ASP A 1 62 ? 52.049 8.984 50.747 1.0 31.92 ? 91 ASP A OD1 1 62 . A ATOM 466 O OD2 . ASP A 1 62 ? 53.798 10.288 50.507 1.0 32.39 ? 91 ASP A OD2 1 62 . A ATOM 467 N N . PHE A 1 63 ? 48.718 12.121 52.956 1.0 13.75 ? 92 PHE A N 1 63 . A ATOM 468 C CA . PHE A 1 63 ? 48.215 12.883 54.070 1.0 13.74 ? 92 PHE A CA 1 63 . A ATOM 469 C C . PHE A 1 63 ? 48.660 12.265 55.410 1.0 14.44 ? 92 PHE A C 1 63 . A ATOM 470 O O . PHE A 1 63 ? 48.570 11.045 55.640 1.0 15.85 ? 92 PHE A O 1 63 . A ATOM 471 C CB . PHE A 1 63 ? 46.700 13.020 54.021 1.0 13.9 ? 92 PHE A CB 1 63 . A ATOM 472 C CG . PHE A 1 63 ? 46.128 13.682 55.217 1.0 12.89 ? 92 PHE A CG 1 63 . A ATOM 473 C CD1 . PHE A 1 63 ? 46.178 15.029 55.323 1.0 13.78 ? 92 PHE A CD1 1 63 . A ATOM 474 C CD2 . PHE A 1 63 ? 45.620 12.931 56.295 1.0 14.09 ? 92 PHE A CD2 1 63 . A ATOM 475 C CE1 . PHE A 1 63 ? 45.606 15.683 56.429 1.0 13.63 ? 92 PHE A CE1 1 63 . A ATOM 476 C CE2 . PHE A 1 63 ? 45.078 13.551 57.403 1.0 14.84 ? 92 PHE A CE2 1 63 . A ATOM 477 C CZ . PHE A 1 63 ? 45.128 14.931 57.501 1.0 14.24 ? 92 PHE A CZ 1 63 . A ATOM 478 N N . LYS A 1 64 ? 49.051 13.155 56.314 1.0 15.12 ? 93 LYS A N 1 64 . A ATOM 479 C CA . LYS A 1 64 ? 49.269 12.765 57.706 1.0 15.52 ? 93 LYS A CA 1 64 . A ATOM 480 C C . LYS A 1 64 ? 48.686 13.762 58.655 1.0 15.07 ? 93 LYS A C 1 64 . A ATOM 481 O O . LYS A 1 64 ? 48.853 14.969 58.446 1.0 15.24 ? 93 LYS A O 1 64 . A ATOM 482 C CB . LYS A 1 64 ? 50.762 12.605 58.014 1.0 16.87 ? 93 LYS A CB 1 64 . A ATOM 483 C CG . LYS A 1 64 ? 51.390 11.357 57.402 1.0 19.83 ? 93 LYS A CG 1 64 . A ATOM 484 C CD . LYS A 1 64 ? 52.807 11.118 57.899 1.0 24.28 ? 93 LYS A CD 1 64 . A ATOM 485 C CE . LYS A 1 64 ? 52.870 10.764 59.366 1.0 27.17 ? 93 LYS A CE 1 64 . A ATOM 486 N NZ . LYS A 1 64 ? 52.635 9.314 59.669 1.0 30.09 ? 93 LYS A NZ 1 64 . A ATOM 487 N N . ALA A 1 65 ? 47.961 13.278 59.668 1.0 16.85 ? 94 ALA A N 1 65 . A ATOM 488 C CA . ALA A 1 65 ? 47.446 14.215 60.668 1.0 16.52 ? 94 ALA A CA 1 65 . A ATOM 489 C C . ALA A 1 65 ? 48.519 14.817 61.546 1.0 16.75 ? 94 ALA A C 1 65 . A ATOM 490 O O . ALA A 1 65 ? 48.450 15.984 61.882 1.0 15.2 ? 94 ALA A O 1 65 . A ATOM 491 C CB . ALA A 1 65 ? 46.339 13.651 61.540 1.0 16.89 ? 94 ALA A CB 1 65 . A ATOM 492 N N . ASN A 1 66 ? 49.511 14.037 61.942 1.0 16.04 ? 95 ASN A N 1 66 . A ATOM 493 C CA . ASN A 1 66 ? 50.559 14.560 62.815 1.0 17.13 ? 95 ASN A CA 1 66 . A ATOM 494 C C . ASN A 1 66 ? 50.031 15.260 64.081 1.0 15.61 ? 95 ASN A C 1 66 . A ATOM 495 O O . ASN A 1 66 ? 50.513 16.333 64.475 1.0 18.27 ? 95 ASN A O 1 66 . A ATOM 496 C CB . ASN A 1 66 ? 51.475 15.542 62.089 1.0 16.54 ? 95 ASN A CB 1 66 . A ATOM 497 C CG . ASN A 1 66 ? 52.129 14.950 60.867 1.0 17.11 ? 95 ASN A CG 1 66 . A ATOM 498 O OD1 . ASN A 1 66 ? 52.664 13.826 60.924 1.0 20.45 ? 95 ASN A OD1 1 66 . A ATOM 499 N ND2 . ASN A 1 66 ? 52.008 15.661 59.727 1.0 17.84 ? 95 ASN A ND2 1 66 . A ATOM 500 N N . GLY A 1 67 ? 49.012 14.632 64.649 1.0 15.17 ? 96 GLY A N 1 67 . A ATOM 501 C CA . GLY A 1 67 ? 48.429 15.126 65.896 1.0 16.22 ? 96 GLY A CA 1 67 . A ATOM 502 C C . GLY A 1 67 ? 47.428 16.246 65.816 1.0 18.68 ? 96 GLY A C 1 67 . A ATOM 503 O O . GLY A 1 67 ? 46.961 16.668 66.846 1.0 19.35 ? 96 GLY A O 1 67 . A ATOM 504 N N . GLY A 1 68 ? 47.059 16.758 64.625 1.0 16.25 ? 97 GLY A N 1 68 . A ATOM 505 C CA . GLY A 1 68 ? 45.952 17.662 64.583 1.0 17.5 ? 97 GLY A CA 1 68 . A ATOM 506 C C . GLY A 1 68 ? 44.679 16.857 64.606 1.0 14.15 ? 97 GLY A C 1 68 . A ATOM 507 O O . GLY A 1 68 ? 44.676 15.661 64.326 1.0 16.7 ? 97 GLY A O 1 68 . A ATOM 508 N N . SER A 1 69 ? 43.575 17.511 64.957 1.0 13.18 ? 98 SER A N 1 69 . A ATOM 509 C CA . SER A 1 69 ? 42.260 16.858 65.048 1.0 15.41 ? 98 SER A CA 1 69 . A ATOM 510 C C . SER A 1 69 ? 41.750 16.352 63.715 1.0 13.44 ? 98 SER A C 1 69 . A ATOM 511 O O . SER A 1 69 ? 41.231 15.235 63.659 1.0 16.89 ? 98 SER A O 1 69 . A ATOM 512 C CB . SER A 1 69 ? 41.177 17.648 65.788 1.0 18.02 ? 98 SER A CB 1 69 . A ATOM 513 O OG . SER A 1 69 ? 40.897 18.857 65.120 1.0 26.81 ? 98 SER A OG 1 69 . A ATOM 514 N N . ASN A 1 70 ? 41.956 17.109 62.654 1.0 12.26 ? 99 ASN A N 1 70 . A ATOM 515 C CA . ASN A 1 70 ? 41.580 16.661 61.345 1.0 12.84 ? 99 ASN A CA 1 70 . A ATOM 516 C C . ASN A 1 70 ? 42.350 15.420 60.886 1.0 12.86 ? 99 ASN A C 1 70 . A ATOM 517 O O . ASN A 1 70 ? 43.613 15.437 60.785 1.0 14.95 ? 99 ASN A O 1 70 . A ATOM 518 C CB . ASN A 1 70 ? 41.765 17.739 60.284 1.0 12.18 ? 99 ASN A CB 1 70 . A ATOM 519 C CG . ASN A 1 70 ? 41.402 17.251 58.911 1.0 12.26 ? 99 ASN A CG 1 70 . A ATOM 520 O OD1 . ASN A 1 70 ? 40.251 16.855 58.642 1.0 13.81 ? 99 ASN A OD1 1 70 . A ATOM 521 N ND2 . ASN A 1 70 ? 42.382 17.199 58.033 1.0 12.52 ? 99 ASN A ND2 1 70 . A ATOM 522 N N . THR A 1 71 ? 41.589 14.392 60.516 1.0 15.89 ? 100 THR A N 1 71 . A ATOM 523 C CA . THR A 1 71 ? 42.154 13.161 59.922 1.0 15.32 ? 100 THR A CA 1 71 . A ATOM 524 C C . THR A 1 71 ? 41.659 12.936 58.483 1.0 15.05 ? 100 THR A C 1 71 . A ATOM 525 O O . THR A 1 71 ? 42.017 11.922 57.830 1.0 14.78 ? 100 THR A O 1 71 . A ATOM 526 C CB . THR A 1 71 ? 41.816 11.933 60.795 1.0 16.56 ? 100 THR A CB 1 71 . A ATOM 527 O OG1 . THR A 1 71 ? 40.404 11.914 61.009 1.0 16.91 ? 100 THR A OG1 1 71 . A ATOM 528 C CG2 . THR A 1 71 ? 42.499 11.972 62.151 1.0 18.23 ? 100 THR A CG2 1 71 . A ATOM 529 N N . SER A 1 72 ? 40.988 13.932 57.887 1.0 13.71 ? 101 SER A N 1 72 . A ATOM 530 C CA . SER A 1 72 ? 40.529 13.812 56.526 1.0 15.29 ? 101 SER A CA 1 72 . A ATOM 531 C C . SER A 1 72 ? 41.477 14.421 55.535 1.0 13.55 ? 101 SER A C 1 72 . A ATOM 532 O O . SER A 1 72 ? 41.720 15.645 55.569 1.0 12.7 ? 101 SER A O 1 72 . A ATOM 533 C CB . SER A 1 72 ? 39.170 14.412 56.340 1.0 16.39 ? 101 SER A CB 1 72 . A ATOM 534 O OG . SER A 1 72 ? 38.881 14.676 54.947 1.0 17.1 ? 101 SER A OG 1 72 . A ATOM 535 N N . PRO A 1 73 ? 41.959 13.580 54.593 1.0 13.99 ? 102 PRO A N 1 73 . A ATOM 536 C CA . PRO A 1 73 ? 42.855 14.150 53.604 1.0 13.29 ? 102 PRO A CA 1 73 . A ATOM 537 C C . PRO A 1 73 ? 42.279 15.282 52.735 1.0 13.46 ? 102 PRO A C 1 73 . A ATOM 538 O O . PRO A 1 73 ? 42.889 16.307 52.504 1.0 14.18 ? 102 PRO A O 1 73 . A ATOM 539 C CB . PRO A 1 73 ? 43.221 12.938 52.737 1.0 13.69 ? 102 PRO A CB 1 73 . A ATOM 540 C CG . PRO A 1 73 ? 43.102 11.778 53.659 1.0 13.47 ? 102 PRO A CG 1 73 . A ATOM 541 C CD . PRO A 1 73 ? 41.946 12.084 54.532 1.0 12.27 ? 102 PRO A CD 1 73 . A ATOM 542 N N . GLU A 1 74 ? 41.019 15.096 52.338 1.0 15.9 ? 103 GLU A N 1 74 . A ATOM 543 C CA . GLU A 1 74 ? 40.375 16.020 51.388 1.0 17.54 ? 103 GLU A CA 1 74 . A ATOM 544 C C . GLU A 1 74 ? 40.018 17.332 52.066 1.0 14.97 ? 103 GLU A C 1 74 . A ATOM 545 O O . GLU A 1 74 ? 40.081 18.431 51.429 1.0 15.17 ? 103 GLU A O 1 74 . A ATOM 546 C CB . GLU A 1 74 ? 39.126 15.361 50.845 1.0 21.7 ? 103 GLU A CB 1 74 . A ATOM 547 C CG . GLU A 1 74 ? 38.684 15.861 49.541 1.0 25.7 ? 103 GLU A CG 1 74 . A ATOM 548 C CD . GLU A 1 74 ? 37.531 15.004 49.043 1.0 29.21 ? 103 GLU A CD 1 74 . A ATOM 549 O OE1 . GLU A 1 74 ? 36.446 15.035 49.686 1.0 35.58 ? 103 GLU A OE1 1 74 . A ATOM 550 O OE2 . GLU A 1 74 ? 37.761 14.284 48.070 1.0 32.27 ? 103 GLU A OE2 1 74 . A ATOM 551 N N . ASP A 1 75 ? 39.557 17.272 53.320 1.0 15.03 ? 104 ASP A N 1 75 . A ATOM 552 C CA . ASP A 1 75 ? 39.329 18.494 54.069 1.0 13.19 ? 104 ASP A CA 1 75 . A ATOM 553 C C . ASP A 1 75 ? 40.603 19.347 54.182 1.0 14.29 ? 104 ASP A C 1 75 . A ATOM 554 O O . ASP A 1 75 ? 40.562 20.619 54.088 1.0 13.97 ? 104 ASP A O 1 75 . A ATOM 555 C CB . ASP A 1 75 ? 38.767 18.200 55.417 1.0 15.85 ? 104 ASP A CB 1 75 . A ATOM 556 C CG . ASP A 1 75 ? 37.389 17.604 55.351 1.0 18.08 ? 104 ASP A CG 1 75 . A ATOM 557 O OD1 . ASP A 1 75 ? 36.814 17.426 54.246 1.0 23.32 ? 104 ASP A OD1 1 75 . A ATOM 558 O OD2 . ASP A 1 75 ? 36.930 17.297 56.457 1.0 23.08 ? 104 ASP A OD2 1 75 . A ATOM 559 N N . PHE A 1 76 ? 41.749 18.706 54.443 1.0 12.3 ? 105 PHE A N 1 76 . A ATOM 560 C CA . PHE A 1 76 ? 42.974 19.468 54.419 1.0 12.21 ? 105 PHE A CA 1 76 . A ATOM 561 C C . PHE A 1 76 ? 43.384 20.078 53.054 1.0 11.39 ? 105 PHE A C 1 76 . A ATOM 562 O O . PHE A 1 76 ? 43.690 21.234 52.912 1.0 12.89 ? 105 PHE A O 1 76 . A ATOM 563 C CB . PHE A 1 76 ? 44.090 18.632 55.040 1.0 11.9 ? 105 PHE A CB 1 76 . A ATOM 564 C CG . PHE A 1 76 ? 45.411 19.399 55.242 1.0 11.74 ? 105 PHE A CG 1 76 . A ATOM 565 C CD1 . PHE A 1 76 ? 45.490 20.623 55.939 1.0 11.6 ? 105 PHE A CD1 1 76 . A ATOM 566 C CD2 . PHE A 1 76 ? 46.584 18.936 54.661 1.0 12.67 ? 105 PHE A CD2 1 76 . A ATOM 567 C CE1 . PHE A 1 76 ? 46.710 21.287 56.078 1.0 11.75 ? 105 PHE A CE1 1 76 . A ATOM 568 C CE2 . PHE A 1 76 ? 47.792 19.612 54.809 1.0 12.73 ? 105 PHE A CE2 1 76 . A ATOM 569 C CZ . PHE A 1 76 ? 47.877 20.793 55.493 1.0 12.77 ? 105 PHE A CZ 1 76 . A ATOM 570 N N . LEU A 1 77 ? 43.254 19.245 52.042 1.0 11.91 ? 106 LEU A N 1 77 . A ATOM 571 C CA . LEU A 1 77 ? 43.448 19.642 50.665 1.0 12.87 ? 106 LEU A CA 1 77 . A ATOM 572 C C . LEU A 1 77 ? 42.608 20.871 50.326 1.0 12.29 ? 106 LEU A C 1 77 . A ATOM 573 O O . LEU A 1 77 ? 43.084 21.828 49.688 1.0 14.45 ? 106 LEU A O 1 77 . A ATOM 574 C CB . LEU A 1 77 ? 43.100 18.523 49.732 1.0 13.41 ? 106 LEU A CB 1 77 . A ATOM 575 C CG . LEU A 1 77 ? 43.648 18.771 48.323 1.0 14.2 ? 106 LEU A CG 1 77 . A ATOM 576 C CD1 . LEU A 1 77 ? 45.172 18.958 48.153 1.0 15.56 ? 106 LEU A CD1 1 77 . A ATOM 577 C CD2 . LEU A 1 77 ? 43.145 17.734 47.305 1.0 14.59 ? 106 LEU A CD2 1 77 . A ATOM 578 N N . SER A 1 78 ? 41.364 20.874 50.812 1.0 12.72 ? 107 SER A N 1 78 . A ATOM 579 C CA A SER A 1 78 ? 40.403 21.933 50.535 0.61 14.49 ? 107 SER A CA 1 78 . A ATOM 580 C CA B SER A 1 78 ? 40.436 21.955 50.470 0.39 13.59 ? 107 SER A CA 1 78 . A ATOM 581 C C . SER A 1 78 ? 40.732 23.270 51.215 1.0 13.22 ? 107 SER A C 1 78 . A ATOM 582 O O . SER A 1 78 ? 40.014 24.307 50.992 1.0 14.02 ? 107 SER A O 1 78 . A ATOM 583 C CB A SER A 1 78 ? 39.012 21.453 50.983 0.61 14.91 ? 107 SER A CB 1 78 . A ATOM 584 C CB B SER A 1 78 ? 38.975 21.507 50.673 0.39 13.41 ? 107 SER A CB 1 78 . A ATOM 585 O OG A SER A 1 78 ? 38.684 20.222 50.383 0.61 16.53 ? 107 SER A OG 1 78 . A ATOM 586 O OG B SER A 1 78 ? 38.507 21.735 52.000 0.39 13.29 ? 107 SER A OG 1 78 . A ATOM 587 N N . GLN A 1 79 ? 41.754 23.311 52.080 1.0 13.14 ? 108 GLN A N 1 79 . A ATOM 588 C CA . GLN A 1 79 ? 42.179 24.557 52.706 1.0 12.67 ? 108 GLN A CA 1 79 . A ATOM 589 C C . GLN A 1 79 ? 43.135 25.391 51.818 1.0 12.89 ? 108 GLN A C 1 79 . A ATOM 590 O O . GLN A 1 79 ? 43.445 26.551 52.155 1.0 15.96 ? 108 GLN A O 1 79 . A ATOM 591 C CB . GLN A 1 79 ? 42.834 24.330 54.061 1.0 13.4 ? 108 GLN A CB 1 79 . A ATOM 592 C CG . GLN A 1 79 ? 42.055 23.468 55.002 1.0 13.28 ? 108 GLN A CG 1 79 . A ATOM 593 C CD . GLN A 1 79 ? 40.681 24.049 55.211 1.0 14.33 ? 108 GLN A CD 1 79 . A ATOM 594 O OE1 . GLN A 1 79 ? 40.554 25.234 55.608 1.0 15.87 ? 108 GLN A OE1 1 79 . A ATOM 595 N NE2 . GLN A 1 79 ? 39.650 23.268 54.916 1.0 16.06 ? 108 GLN A NE2 1 79 . A ATOM 596 N N . PHE A 1 80 ? 43.564 24.815 50.664 1.0 12.01 ? 109 PHE A N 1 80 . A ATOM 597 C CA . PHE A 1 80 ? 44.558 25.470 49.815 1.0 13.86 ? 109 PHE A CA 1 80 . A ATOM 598 C C . PHE A 1 80 ? 43.966 25.882 48.484 1.0 13.35 ? 109 PHE A C 1 80 . A ATOM 599 O O . PHE A 1 80 ? 43.087 25.207 47.981 1.0 13.0 ? 109 PHE A O 1 80 . A ATOM 600 C CB . PHE A 1 80 ? 45.729 24.541 49.521 1.0 14.98 ? 109 PHE A CB 1 80 . A ATOM 601 C CG . PHE A 1 80 ? 46.474 24.135 50.769 1.0 14.36 ? 109 PHE A CG 1 80 . A ATOM 602 C CD1 . PHE A 1 80 ? 46.002 23.067 51.570 1.0 14.76 ? 109 PHE A CD1 1 80 . A ATOM 603 C CD2 . PHE A 1 80 ? 47.566 24.863 51.165 1.0 16.38 ? 109 PHE A CD2 1 80 . A ATOM 604 C CE1 . PHE A 1 80 ? 46.653 22.739 52.750 1.0 14.99 ? 109 PHE A CE1 1 80 . A ATOM 605 C CE2 . PHE A 1 80 ? 48.231 24.545 52.339 1.0 15.94 ? 109 PHE A CE2 1 80 . A ATOM 606 C CZ . PHE A 1 80 ? 47.790 23.480 53.111 1.0 15.92 ? 109 PHE A CZ 1 80 . A ATOM 607 N N . GLU A 1 81 ? 44.440 27.033 47.988 1.0 13.93 ? 110 GLU A N 1 81 . A ATOM 608 C CA . GLU A 1 81 ? 44.011 27.549 46.684 1.0 14.8 ? 110 GLU A CA 1 81 . A ATOM 609 C C . GLU A 1 81 ? 45.243 27.772 45.849 1.0 15.55 ? 110 GLU A C 1 81 . A ATOM 610 O O . GLU A 1 81 ? 46.334 28.111 46.403 1.0 17.15 ? 110 GLU A O 1 81 . A ATOM 611 C CB . GLU A 1 81 ? 43.281 28.857 46.866 1.0 15.53 ? 110 GLU A CB 1 81 . A ATOM 612 C CG . GLU A 1 81 ? 42.075 28.816 47.771 1.0 17.45 ? 110 GLU A CG 1 81 . A ATOM 613 C CD . GLU A 1 81 ? 41.773 30.198 48.329 1.0 21.39 ? 110 GLU A CD 1 81 . A ATOM 614 O OE1 . GLU A 1 81 ? 42.653 31.124 48.329 1.0 21.03 ? 110 GLU A OE1 1 81 . A ATOM 615 O OE2 . GLU A 1 81 ? 40.661 30.291 48.853 1.0 26.09 ? 110 GLU A OE2 1 81 . A ATOM 616 N N . VAL A 1 82 ? 45.094 27.614 44.511 1.0 15.6 ? 111 VAL A N 1 82 . A ATOM 617 C CA . VAL A 1 82 ? 46.174 27.889 43.593 1.0 15.35 ? 111 VAL A CA 1 82 . A ATOM 618 C C . VAL A 1 82 ? 45.873 29.026 42.624 1.0 14.51 ? 111 VAL A C 1 82 . A ATOM 619 O O . VAL A 1 82 ? 44.750 29.091 42.045 1.0 15.92 ? 111 VAL A O 1 82 . A ATOM 620 C CB . VAL A 1 82 ? 46.633 26.645 42.832 1.0 18.28 ? 111 VAL A CB 1 82 . A ATOM 621 C CG1 . VAL A 1 82 ? 45.577 26.035 41.965 1.0 17.74 ? 111 VAL A CG1 1 82 . A ATOM 622 C CG2 . VAL A 1 82 ? 47.894 26.869 42.032 1.0 18.26 ? 111 VAL A CG2 1 82 . A ATOM 623 N N . THR A 1 83 ? 46.892 29.836 42.385 1.0 13.6 ? 112 THR A N 1 83 . A ATOM 624 C CA . THR A 1 83 ? 46.822 30.873 41.330 1.0 14.17 ? 112 THR A CA 1 83 . A ATOM 625 C C . THR A 1 83 ? 47.900 30.518 40.327 1.0 14.22 ? 112 THR A C 1 83 . A ATOM 626 O O . THR A 1 83 ? 49.052 30.273 40.713 1.0 16.11 ? 112 THR A O 1 83 . A ATOM 627 C CB . THR A 1 83 ? 47.026 32.291 41.878 1.0 14.71 ? 112 THR A CB 1 83 . A ATOM 628 O OG1 . THR A 1 83 ? 45.930 32.621 42.751 1.0 16.84 ? 112 THR A OG1 1 83 . A ATOM 629 C CG2 . THR A 1 83 ? 47.221 33.373 40.737 1.0 16.08 ? 112 THR A CG2 1 83 . A ATOM 630 N N . LEU A 1 84 ? 47.534 30.439 39.051 1.0 14.59 ? 113 LEU A N 1 84 . A ATOM 631 C CA . LEU A 1 84 ? 48.462 30.168 37.966 1.0 15.21 ? 113 LEU A CA 1 84 . A ATOM 632 C C . LEU A 1 84 ? 48.328 31.237 36.899 1.0 15.59 ? 113 LEU A C 1 84 . A ATOM 633 O O . LEU A 1 84 ? 47.220 31.494 36.394 1.0 13.92 ? 113 LEU A O 1 84 . A ATOM 634 C CB . LEU A 1 84 ? 48.205 28.802 37.376 1.0 17.29 ? 113 LEU A CB 1 84 . A ATOM 635 C CG . LEU A 1 84 ? 49.269 28.253 36.406 1.0 18.98 ? 113 LEU A CG 1 84 . A ATOM 636 C CD1 . LEU A 1 84 ? 49.317 26.760 36.522 1.0 19.37 ? 113 LEU A CD1 1 84 . A ATOM 637 C CD2 . LEU A 1 84 ? 49.059 28.681 34.960 1.0 18.52 ? 113 LEU A CD2 1 84 . A ATOM 638 N N . LEU A 1 85 ? 49.460 31.801 36.502 1.0 15.77 ? 114 LEU A N 1 85 . A ATOM 639 C CA . LEU A 1 85 ? 49.443 32.867 35.497 1.0 16.4 ? 114 LEU A CA 1 85 . A ATOM 640 C C . LEU A 1 85 ? 50.578 32.631 34.523 1.0 18.18 ? 114 LEU A C 1 85 . A ATOM 641 O O . LEU A 1 85 ? 51.519 31.885 34.780 1.0 16.65 ? 114 LEU A O 1 85 . A ATOM 642 C CB . LEU A 1 85 ? 49.539 34.202 36.121 1.0 18.53 ? 114 LEU A CB 1 85 . A ATOM 643 C CG . LEU A 1 85 ? 50.741 34.594 36.919 1.0 19.01 ? 114 LEU A CG 1 85 . A ATOM 644 C CD1 . LEU A 1 85 ? 51.926 35.008 36.044 1.0 21.27 ? 114 LEU A CD1 1 85 . A ATOM 645 C CD2 . LEU A 1 85 ? 50.326 35.668 37.931 1.0 22.2 ? 114 LEU A CD2 1 85 . A ATOM 646 N N . THR A 1 86 ? 50.480 33.267 33.371 1.0 16.89 ? 115 THR A N 1 86 . A ATOM 647 C CA . THR A 1 86 ? 51.543 33.176 32.364 1.0 19.33 ? 115 THR A CA 1 86 . A ATOM 648 C C . THR A 1 86 ? 51.989 34.595 32.062 1.0 20.03 ? 115 THR A C 1 86 . A ATOM 649 O O . THR A 1 86 ? 51.202 35.505 32.133 1.0 20.28 ? 115 THR A O 1 86 . A ATOM 650 C CB . THR A 1 86 ? 51.128 32.456 31.046 1.0 18.93 ? 115 THR A CB 1 86 . A ATOM 651 O OG1 . THR A 1 86 ? 49.976 33.103 30.482 1.0 19.59 ? 115 THR A OG1 1 86 . A ATOM 652 C CG2 . THR A 1 86 ? 50.803 30.971 31.278 1.0 19.79 ? 115 THR A CG2 1 86 . A ATOM 653 N N . VAL A 1 87 ? 53.260 34.791 31.782 1.0 22.62 ? 116 VAL A N 1 87 . A ATOM 654 C CA . VAL A 1 87 ? 53.716 36.134 31.417 1.0 27.76 ? 116 VAL A CA 1 87 . A ATOM 655 C C . VAL A 1 87 ? 54.473 36.140 30.090 1.0 31.53 ? 116 VAL A C 1 87 . A ATOM 656 O O . VAL A 1 87 ? 54.128 36.910 29.214 1.0 40.78 ? 116 VAL A O 1 87 . A ATOM 657 C CB . VAL A 1 87 ? 54.462 36.840 32.582 1.0 31.12 ? 116 VAL A CB 1 87 . A ATOM 658 C CG1 . VAL A 1 87 ? 55.546 35.967 33.216 1.0 29.99 ? 116 VAL A CG1 1 87 . A ATOM 659 C CG2 . VAL A 1 87 ? 55.036 38.176 32.129 1.0 32.47 ? 116 VAL A CG2 1 87 . A ATOM 660 N N . GLY A 1 88 ? 55.483 35.293 29.955 1.0 35.67 ? 117 GLY A N 1 88 . A ATOM 661 C CA . GLY A 1 88 ? 56.419 35.374 28.825 1.0 42.64 ? 117 GLY A CA 1 88 . A ATOM 662 C C . GLY A 1 88 ? 57.836 35.497 29.342 1.0 42.58 ? 117 GLY A C 1 88 . A ATOM 663 O O . GLY A 1 88 ? 58.430 34.501 29.762 1.0 53.29 ? 117 GLY A O 1 88 . A ATOM 664 N N . PRO A 1 96 ? 52.259 42.300 30.502 1.0 47.86 ? 125 PRO A N 1 96 . A ATOM 665 C CA . PRO A 1 96 ? 50.948 41.907 31.018 1.0 46.17 ? 125 PRO A CA 1 96 . A ATOM 666 C C . PRO A 1 96 ? 50.937 40.456 31.555 1.0 43.09 ? 125 PRO A C 1 96 . A ATOM 667 O O . PRO A 1 96 ? 51.510 39.563 30.911 1.0 47.04 ? 125 PRO A O 1 96 . A ATOM 668 C CB . PRO A 1 96 ? 50.039 42.048 29.784 1.0 45.67 ? 125 PRO A CB 1 96 . A ATOM 669 C CG . PRO A 1 96 ? 50.967 41.995 28.588 1.0 46.53 ? 125 PRO A CG 1 96 . A ATOM 670 C CD . PRO A 1 96 ? 52.390 41.976 29.073 1.0 45.19 ? 125 PRO A CD 1 96 . A ATOM 671 N N . LYS A 1 97 ? 50.305 40.235 32.716 1.0 37.85 ? 126 LYS A N 1 97 . A ATOM 672 C CA . LYS A 1 97 ? 50.170 38.879 33.294 1.0 32.46 ? 126 LYS A CA 1 97 . A ATOM 673 C C . LYS A 1 97 ? 48.798 38.300 32.986 1.0 27.55 ? 126 LYS A C 1 97 . A ATOM 674 O O . LYS A 1 97 ? 47.772 38.879 33.334 1.0 29.91 ? 126 LYS A O 1 97 . A ATOM 675 C CB . LYS A 1 97 ? 50.408 38.886 34.804 1.0 34.73 ? 126 LYS A CB 1 97 . A ATOM 676 C CG . LYS A 1 97 ? 51.824 39.317 35.189 1.0 36.15 ? 126 LYS A CG 1 97 . A ATOM 677 C CD . LYS A 1 97 ? 52.189 38.942 36.620 1.0 40.92 ? 126 LYS A CD 1 97 . A ATOM 678 C CE . LYS A 1 97 ? 53.672 39.208 36.889 1.0 44.0 ? 126 LYS A CE 1 97 . A ATOM 679 N NZ . LYS A 1 97 ? 54.215 38.435 38.040 1.0 46.94 ? 126 LYS A NZ 1 97 . A ATOM 680 N N . ASN A 1 98 ? 48.796 37.121 32.396 1.0 20.52 ? 127 ASN A N 1 98 . A ATOM 681 C CA . ASN A 1 98 ? 47.604 36.464 31.968 1.0 20.3 ? 127 ASN A CA 1 98 . A ATOM 682 C C . ASN A 1 98 ? 47.197 35.486 33.107 1.0 17.4 ? 127 ASN A C 1 98 . A ATOM 683 O O . ASN A 1 98 ? 47.819 34.457 33.280 1.0 18.09 ? 127 ASN A O 1 98 . A ATOM 684 C CB . ASN A 1 98 ? 47.939 35.709 30.695 1.0 21.43 ? 127 ASN A CB 1 98 . A ATOM 685 C CG . ASN A 1 98 ? 46.858 34.741 30.289 1.0 26.58 ? 127 ASN A CG 1 98 . A ATOM 686 O OD1 . ASN A 1 98 ? 45.758 35.139 29.962 1.0 29.26 ? 127 ASN A OD1 1 98 . A ATOM 687 N ND2 . ASN A 1 98 ? 47.187 33.442 30.284 1.0 29.65 ? 127 ASN A ND2 1 98 . A ATOM 688 N N . ILE A 1 99 ? 46.123 35.778 33.833 1.0 18.57 ? 128 ILE A N 1 99 . A ATOM 689 C CA . ILE A 1 99 ? 45.665 34.922 34.922 1.0 18.09 ? 128 ILE A CA 1 99 . A ATOM 690 C C . ILE A 1 99 ? 44.927 33.790 34.234 1.0 17.71 ? 128 ILE A C 1 99 . A ATOM 691 O O . ILE A 1 99 ? 44.074 34.012 33.378 1.0 19.95 ? 128 ILE A O 1 99 . A ATOM 692 C CB . ILE A 1 99 ? 44.688 35.641 35.889 1.0 20.92 ? 128 ILE A CB 1 99 . A ATOM 693 C CG1 . ILE A 1 99 ? 45.315 36.875 36.497 1.0 22.33 ? 128 ILE A CG1 1 99 . A ATOM 694 C CG2 . ILE A 1 99 ? 44.281 34.710 37.040 1.0 20.46 ? 128 ILE A CG2 1 99 . A ATOM 695 C CD1 . ILE A 1 99 ? 44.329 37.763 37.264 1.0 26.72 ? 128 ILE A CD1 1 99 . A ATOM 696 N N . ILE A 1 100 ? 45.322 32.557 34.520 1.0 14.33 ? 129 ILE A N 1 100 . A ATOM 697 C CA . ILE A 1 100 ? 44.566 31.380 34.119 1.0 14.48 ? 129 ILE A CA 1 100 . A ATOM 698 C C . ILE A 1 100 ? 43.701 30.946 35.281 1.0 14.04 ? 129 ILE A C 1 100 . A ATOM 699 O O . ILE A 1 100 ? 42.472 30.914 35.193 1.0 14.51 ? 129 ILE A O 1 100 . A ATOM 700 C CB . ILE A 1 100 ? 45.473 30.241 33.609 1.0 14.7 ? 129 ILE A CB 1 100 . A ATOM 701 C CG1 . ILE A 1 100 ? 46.341 30.741 32.463 1.0 14.72 ? 129 ILE A CG1 1 100 . A ATOM 702 C CG2 . ILE A 1 100 ? 44.647 29.000 33.297 1.0 15.44 ? 129 ILE A CG2 1 100 . A ATOM 703 C CD1 . ILE A 1 100 ? 47.201 29.717 31.790 1.0 17.08 ? 129 ILE A CD1 1 100 . A ATOM 704 N N . LEU A 1 101 ? 44.324 30.555 36.388 1.0 14.28 ? 130 LEU A N 1 101 . A ATOM 705 C CA . LEU A 1 101 ? 43.574 30.162 37.583 1.0 13.15 ? 130 LEU A CA 1 101 . A ATOM 706 C C . LEU A 1 101 ? 43.779 31.241 38.630 1.0 11.91 ? 130 LEU A C 1 101 . A ATOM 707 O O . LEU A 1 101 ? 44.900 31.703 38.835 1.0 13.48 ? 130 LEU A O 1 101 . A ATOM 708 C CB . LEU A 1 101 ? 44.052 28.803 38.174 1.0 14.02 ? 130 LEU A CB 1 101 . A ATOM 709 C CG . LEU A 1 101 ? 43.848 27.613 37.283 1.0 14.43 ? 130 LEU A CG 1 101 . A ATOM 710 C CD1 . LEU A 1 101 ? 44.682 26.434 37.848 1.0 16.36 ? 130 LEU A CD1 1 101 . A ATOM 711 C CD2 . LEU A 1 101 ? 42.369 27.273 37.156 1.0 15.96 ? 130 LEU A CD2 1 101 . A ATOM 712 N N . ASP A 1 102 ? 42.737 31.637 39.324 1.0 13.92 ? 131 ASP A N 1 102 . A ATOM 713 C CA . ASP A 1 102 ? 42.789 32.679 40.378 1.0 14.34 ? 131 ASP A CA 1 102 . A ATOM 714 C C . ASP A 1 102 ? 42.148 32.117 41.616 1.0 15.19 ? 131 ASP A C 1 102 . A ATOM 715 O O . ASP A 1 102 ? 40.930 31.895 41.672 1.0 15.93 ? 131 ASP A O 1 102 . A ATOM 716 C CB . ASP A 1 102 ? 42.046 33.939 39.951 1.0 17.08 ? 131 ASP A CB 1 102 . A ATOM 717 C CG . ASP A 1 102 ? 42.471 35.195 40.721 1.0 20.52 ? 131 ASP A CG 1 102 . A ATOM 718 O OD1 . ASP A 1 102 ? 43.314 35.204 41.653 1.0 20.3 ? 131 ASP A OD1 1 102 . A ATOM 719 O OD2 . ASP A 1 102 ? 41.958 36.281 40.390 1.0 21.95 ? 131 ASP A OD2 1 102 . A ATOM 720 N N . ASP A 1 103 ? 42.976 31.802 42.635 1.0 14.41 ? 132 ASP A N 1 103 . A ATOM 721 C CA . ASP A 1 103 ? 42.505 31.272 43.890 1.0 14.9 ? 132 ASP A CA 1 103 . A ATOM 722 C C . ASP A 1 103 ? 41.620 30.067 43.776 1.0 14.85 ? 132 ASP A C 1 103 . A ATOM 723 O O . ASP A 1 103 ? 40.655 29.938 44.508 1.0 16.64 ? 132 ASP A O 1 103 . A ATOM 724 C CB . ASP A 1 103 ? 41.852 32.366 44.740 1.0 16.6 ? 132 ASP A CB 1 103 . A ATOM 725 C CG . ASP A 1 103 ? 42.803 33.417 45.184 1.0 18.48 ? 132 ASP A CG 1 103 . A ATOM 726 O OD1 . ASP A 1 103 ? 44.011 33.316 45.025 1.0 18.94 ? 132 ASP A OD1 1 103 . A ATOM 727 O OD2 . ASP A 1 103 ? 42.308 34.396 45.794 1.0 21.67 ? 132 ASP A OD2 1 103 . A ATOM 728 N N . ALA A 1 104 ? 41.926 29.186 42.830 1.0 14.69 ? 133 ALA A N 1 104 . A ATOM 729 C CA . ALA A 1 104 ? 41.193 27.947 42.642 1.0 14.45 ? 133 ALA A CA 1 104 . A ATOM 730 C C . ALA A 1 104 ? 41.428 26.899 43.747 1.0 14.05 ? 133 ALA A C 1 104 . A ATOM 731 O O . ALA A 1 104 ? 42.564 26.557 44.053 1.0 12.34 ? 133 ALA A O 1 104 . A ATOM 732 C CB . ALA A 1 104 ? 41.525 27.387 41.312 1.0 16.52 ? 133 ALA A CB 1 104 . A ATOM 733 N N . ASN A 1 105 ? 40.336 26.371 44.275 1.0 13.66 ? 134 ASN A N 1 105 . A ATOM 734 C CA . ASN A 1 105 ? 40.442 25.449 45.382 1.0 12.95 ? 134 ASN A CA 1 105 . A ATOM 735 C C . ASN A 1 105 ? 41.124 24.182 44.907 1.0 12.92 ? 134 ASN A C 1 105 . A ATOM 736 O O . ASN A 1 105 ? 40.746 23.563 43.915 1.0 13.43 ? 134 ASN A O 1 105 . A ATOM 737 C CB . ASN A 1 105 ? 39.063 25.120 45.907 1.0 13.01 ? 134 ASN A CB 1 105 . A ATOM 738 C CG . ASN A 1 105 ? 39.116 24.305 47.134 1.0 17.0 ? 134 ASN A CG 1 105 . A ATOM 739 O OD1 . ASN A 1 105 ? 39.250 23.082 47.063 1.0 18.25 ? 134 ASN A OD1 1 105 . A ATOM 740 N ND2 . ASN A 1 105 ? 39.280 24.991 48.264 1.0 18.38 ? 134 ASN A ND2 1 105 . A ATOM 741 N N . LEU A 1 106 ? 42.153 23.729 45.653 1.0 11.76 ? 135 LEU A N 1 106 . A ATOM 742 C CA . LEU A 1 106 ? 42.904 22.517 45.220 1.0 14.54 ? 135 LEU A CA 1 106 . A ATOM 743 C C . LEU A 1 106 ? 42.108 21.230 45.187 1.0 13.03 ? 135 LEU A C 1 106 . A ATOM 744 O O . LEU A 1 106 ? 42.343 20.324 44.305 1.0 12.43 ? 135 LEU A O 1 106 . A ATOM 745 C CB . LEU A 1 106 ? 44.126 22.304 46.114 1.0 16.82 ? 135 LEU A CB 1 106 . A ATOM 746 C CG . LEU A 1 106 ? 45.316 23.220 46.034 1.0 20.37 ? 135 LEU A CG 1 106 . A ATOM 747 C CD1 . LEU A 1 106 ? 46.539 22.592 46.745 1.0 21.5 ? 135 LEU A CD1 1 106 . A ATOM 748 C CD2 . LEU A 1 106 ? 45.596 23.606 44.591 1.0 22.43 ? 135 LEU A CD2 1 106 . A ATOM 749 N N . LYS A 1 107 ? 41.130 21.089 46.102 1.0 13.84 ? 136 LYS A N 1 107 . A ATOM 750 C CA . LYS A 1 107 ? 40.268 19.911 46.067 1.0 15.33 ? 136 LYS A CA 1 107 . A ATOM 751 C C . LYS A 1 107 ? 39.431 19.891 44.764 1.0 14.17 ? 136 LYS A C 1 107 . A ATOM 752 O O . LYS A 1 107 ? 39.308 18.869 44.057 1.0 15.02 ? 136 LYS A O 1 107 . A ATOM 753 C CB . LYS A 1 107 ? 39.371 19.822 47.294 1.0 18.18 ? 136 LYS A CB 1 107 . A ATOM 754 C CG . LYS A 1 107 ? 38.465 18.597 47.276 1.0 20.96 ? 136 LYS A CG 1 107 . A ATOM 755 C CD . LYS A 1 107 ? 37.165 18.716 48.090 1.0 26.69 ? 136 LYS A CD 1 107 . A ATOM 756 C CE . LYS A 1 107 ? 36.268 19.890 47.739 1.0 30.22 ? 136 LYS A CE 1 107 . A ATOM 757 N NZ . LYS A 1 107 ? 34.990 19.570 47.046 1.0 33.53 ? 136 LYS A NZ 1 107 . A ATOM 758 N N . ASP A 1 108 ? 38.903 21.054 44.365 1.0 13.1 ? 137 ASP A N 1 108 . A ATOM 759 C CA . ASP A 1 108 ? 38.140 21.139 43.105 1.0 15.23 ? 137 ASP A CA 1 108 . A ATOM 760 C C . ASP A 1 108 ? 39.030 20.919 41.863 1.0 12.86 ? 137 ASP A C 1 108 . A ATOM 761 O O . ASP A 1 108 ? 38.624 20.278 40.880 1.0 12.7 ? 137 ASP A O 1 108 . A ATOM 762 C CB . ASP A 1 108 ? 37.550 22.520 42.901 1.0 16.23 ? 137 ASP A CB 1 108 . A ATOM 763 C CG . ASP A 1 108 ? 36.512 22.960 43.948 1.0 21.27 ? 137 ASP A CG 1 108 . A ATOM 764 O OD1 . ASP A 1 108 ? 35.781 22.163 44.532 1.0 24.7 ? 137 ASP A OD1 1 108 . A ATOM 765 O OD2 . ASP A 1 108 ? 36.417 24.200 44.071 1.0 23.97 ? 137 ASP A OD2 1 108 . A ATOM 766 N N . LEU A 1 109 ? 40.258 21.449 41.943 1.0 12.72 ? 138 LEU A N 1 109 . A ATOM 767 C CA . LEU A 1 109 ? 41.221 21.328 40.865 1.0 15.02 ? 138 LEU A CA 1 109 . A ATOM 768 C C . LEU A 1 109 ? 41.618 19.845 40.744 1.0 13.37 ? 138 LEU A C 1 109 . A ATOM 769 O O . LEU A 1 109 ? 41.810 19.320 39.614 1.0 11.65 ? 138 LEU A O 1 109 . A ATOM 770 C CB . LEU A 1 109 ? 42.420 22.240 41.046 1.0 17.51 ? 138 LEU A CB 1 109 . A ATOM 771 C CG . LEU A 1 109 ? 43.565 22.056 40.048 1.0 19.48 ? 138 LEU A CG 1 109 . A ATOM 772 C CD1 . LEU A 1 109 ? 43.176 22.198 38.574 1.0 21.49 ? 138 LEU A CD1 1 109 . A ATOM 773 C CD2 . LEU A 1 109 ? 44.663 23.025 40.419 1.0 20.69 ? 138 LEU A CD2 1 109 . A ATOM 774 N N . TYR A 1 110 ? 41.749 19.175 41.877 1.0 13.34 ? 139 TYR A N 1 110 . A ATOM 775 C CA . TYR A 1 110 ? 42.039 17.744 41.836 1.0 12.81 ? 139 TYR A CA 1 110 . A ATOM 776 C C . TYR A 1 110 ? 40.950 16.946 41.180 1.0 12.41 ? 139 TYR A C 1 110 . A ATOM 777 O O . TYR A 1 110 ? 41.214 16.185 40.254 1.0 14.73 ? 139 TYR A O 1 110 . A ATOM 778 C CB . TYR A 1 110 ? 42.383 17.184 43.233 1.0 13.95 ? 139 TYR A CB 1 110 . A ATOM 779 C CG . TYR A 1 110 ? 42.406 15.680 43.247 1.0 14.29 ? 139 TYR A CG 1 110 . A ATOM 780 C CD1 . TYR A 1 110 ? 43.516 14.976 42.701 1.0 15.89 ? 139 TYR A CD1 1 110 . A ATOM 781 C CD2 . TYR A 1 110 ? 41.282 14.925 43.696 1.0 16.89 ? 139 TYR A CD2 1 110 . A ATOM 782 C CE1 . TYR A 1 110 ? 43.508 13.555 42.630 1.0 17.56 ? 139 TYR A CE1 1 110 . A ATOM 783 C CE2 . TYR A 1 110 ? 41.279 13.538 43.616 1.0 16.8 ? 139 TYR A CE2 1 110 . A ATOM 784 C CZ . TYR A 1 110 ? 42.373 12.846 43.113 1.0 17.85 ? 139 TYR A CZ 1 110 . A ATOM 785 O OH . TYR A 1 110 ? 42.283 11.451 43.051 1.0 21.34 ? 139 TYR A OH 1 110 . A ATOM 786 N N . LEU A 1 111 ? 39.709 17.089 41.656 1.0 12.58 ? 140 LEU A N 1 111 . A ATOM 787 C CA . LEU A 1 111 ? 38.615 16.313 41.131 1.0 13.57 ? 140 LEU A CA 1 111 . A ATOM 788 C C . LEU A 1 111 ? 38.338 16.595 39.658 1.0 13.64 ? 140 LEU A C 1 111 . A ATOM 789 O O . LEU A 1 111 ? 38.075 15.697 38.910 1.0 14.25 ? 140 LEU A O 1 111 . A ATOM 790 C CB . LEU A 1 111 ? 37.320 16.498 41.919 1.0 13.92 ? 140 LEU A CB 1 111 . A ATOM 791 C CG . LEU A 1 111 ? 37.296 16.097 43.405 1.0 15.67 ? 140 LEU A CG 1 111 . A ATOM 792 C CD1 . LEU A 1 111 ? 36.009 16.514 44.056 1.0 16.02 ? 140 LEU A CD1 1 111 . A ATOM 793 C CD2 . LEU A 1 111 ? 37.459 14.606 43.567 1.0 16.13 ? 140 LEU A CD2 1 111 . A HETATM 794 N N . MSE A 1 112 ? 38.539 17.838 39.225 1.0 13.94 ? 141 MSE A N 1 112 . A HETATM 795 C CA . MSE A 1 112 ? 38.380 18.162 37.827 1.0 16.36 ? 141 MSE A CA 1 112 . A HETATM 796 C C . MSE A 1 112 ? 39.467 17.547 36.991 1.0 14.59 ? 141 MSE A C 1 112 . A HETATM 797 O O . MSE A 1 112 ? 39.187 16.857 35.997 1.0 16.88 ? 141 MSE A O 1 112 . A HETATM 798 C CB . MSE A 1 112 ? 38.351 19.701 37.576 1.0 15.89 ? 141 MSE A CB 1 112 . A HETATM 799 C CG . MSE A 1 112 ? 38.224 20.007 36.078 1.0 16.49 ? 141 MSE A CG 1 112 . A HETATM 800 SE SE . MSE A 1 112 ? 38.126 21.923 35.660 1.0 19.85 ? 141 MSE A SE 1 112 . A HETATM 801 C CE . MSE A 1 112 ? 40.047 22.316 35.719 1.0 21.17 ? 141 MSE A CE 1 112 . A ATOM 802 N N . SER A 1 113 ? 40.734 17.820 37.340 1.0 14.84 ? 142 SER A N 1 113 . A ATOM 803 C CA . SER A 1 113 ? 41.838 17.424 36.484 1.0 15.13 ? 142 SER A CA 1 113 . A ATOM 804 C C . SER A 1 113 ? 42.255 15.964 36.598 1.0 14.63 ? 142 SER A C 1 113 . A ATOM 805 O O . SER A 1 113 ? 42.874 15.392 35.643 1.0 15.71 ? 142 SER A O 1 113 . A ATOM 806 C CB . SER A 1 113 ? 43.030 18.316 36.693 1.0 15.8 ? 142 SER A CB 1 113 . A ATOM 807 O OG . SER A 1 113 ? 43.705 18.098 37.949 1.0 16.13 ? 142 SER A OG 1 113 . A ATOM 808 N N . ALA A 1 114 ? 41.943 15.355 37.726 1.0 15.07 ? 143 ALA A N 1 114 . A ATOM 809 C CA . ALA A 1 114 ? 42.171 13.892 37.925 1.0 15.25 ? 143 ALA A CA 1 114 . A ATOM 810 C C . ALA A 1 114 ? 41.009 12.982 37.568 1.0 17.25 ? 143 ALA A C 1 114 . A ATOM 811 O O . ALA A 1 114 ? 41.210 11.846 37.076 1.0 22.08 ? 143 ALA A O 1 114 . A ATOM 812 C CB . ALA A 1 114 ? 42.590 13.616 39.359 1.0 16.03 ? 143 ALA A CB 1 114 . A ATOM 813 N N . LYS A 1 115 ? 39.801 13.404 37.881 1.0 18.21 ? 144 LYS A N 1 115 . A ATOM 814 C CA . LYS A 1 115 ? 38.600 12.594 37.768 1.0 20.26 ? 144 LYS A CA 1 115 . A ATOM 815 C C . LYS A 1 115 ? 37.688 13.142 36.620 1.0 17.9 ? 144 LYS A C 1 115 . A ATOM 816 O O . LYS A 1 115 ? 36.797 12.425 36.186 1.0 21.07 ? 144 LYS A O 1 115 . A ATOM 817 C CB . LYS A 1 115 ? 37.775 12.569 39.084 1.0 20.73 ? 144 LYS A CB 1 115 . A ATOM 818 C CG . LYS A 1 115 ? 38.433 12.311 40.439 1.0 23.52 ? 144 LYS A CG 1 115 . A ATOM 819 C CD . LYS A 1 115 ? 38.833 10.878 40.613 1.0 26.49 ? 144 LYS A CD 1 115 . A ATOM 820 C CE . LYS A 1 115 ? 39.060 10.536 42.076 1.0 29.73 ? 144 LYS A CE 1 115 . A ATOM 821 N NZ . LYS A 1 115 ? 39.872 9.303 42.239 1.0 33.78 ? 144 LYS A NZ 1 115 . A ATOM 822 N N . ASN A 1 116 ? 37.934 14.326 36.049 1.0 16.83 ? 145 ASN A N 1 116 . A ATOM 823 C CA . ASN A 1 116 ? 36.988 14.932 35.108 1.0 16.29 ? 145 ASN A CA 1 116 . A ATOM 824 C C . ASN A 1 116 ? 35.585 14.966 35.738 1.0 15.75 ? 145 ASN A C 1 116 . A ATOM 825 O O . ASN A 1 116 ? 34.586 14.756 35.071 1.0 16.26 ? 145 ASN A O 1 116 . A ATOM 826 C CB . ASN A 1 116 ? 37.003 14.302 33.679 1.0 16.5 ? 145 ASN A CB 1 116 . A ATOM 827 C CG . ASN A 1 116 ? 36.712 15.316 32.553 1.0 17.7 ? 145 ASN A CG 1 116 . A ATOM 828 O OD1 . ASN A 1 116 ? 36.666 16.511 32.817 1.0 21.23 ? 145 ASN A OD1 1 116 . A ATOM 829 N ND2 . ASN A 1 116 ? 36.695 14.849 31.279 1.0 19.9 ? 145 ASN A ND2 1 116 . A ATOM 830 N N . ASP A 1 117 ? 35.535 15.324 37.023 1.0 15.6 ? 146 ASP A N 1 117 . A ATOM 831 C CA . ASP A 1 117 ? 34.264 15.405 37.767 1.0 17.34 ? 146 ASP A CA 1 117 . A ATOM 832 C C . ASP A 1 117 ? 33.571 16.700 37.306 1.0 16.73 ? 146 ASP A C 1 117 . A ATOM 833 O O . ASP A 1 117 ? 34.161 17.762 37.371 1.0 18.04 ? 146 ASP A O 1 117 . A ATOM 834 C CB . ASP A 1 117 ? 34.505 15.438 39.260 1.0 18.25 ? 146 ASP A CB 1 117 . A ATOM 835 C CG . ASP A 1 117 ? 33.227 15.417 40.053 1.0 22.86 ? 146 ASP A CG 1 117 . A ATOM 836 O OD1 . ASP A 1 117 ? 32.513 16.447 40.153 1.0 21.58 ? 146 ASP A OD1 1 117 . A ATOM 837 O OD2 . ASP A 1 117 ? 32.932 14.381 40.705 1.0 23.07 ? 146 ASP A OD2 1 117 . A ATOM 838 N N . ALA A 1 118 ? 32.343 16.571 36.804 1.0 17.1 ? 147 ALA A N 1 118 . A ATOM 839 C CA . ALA A 1 118 ? 31.634 17.742 36.247 1.0 17.2 ? 147 ALA A CA 1 118 . A ATOM 840 C C . ALA A 1 118 ? 31.219 18.784 37.250 1.0 20.09 ? 147 ALA A C 1 118 . A ATOM 841 O O . ALA A 1 118 ? 31.287 20.000 36.939 1.0 18.13 ? 147 ALA A O 1 118 . A ATOM 842 C CB . ALA A 1 118 ? 30.425 17.290 35.463 1.0 18.09 ? 147 ALA A CB 1 118 . A ATOM 843 N N . ALA A 1 119 ? 30.762 18.374 38.412 1.0 18.93 ? 148 ALA A N 1 119 . A ATOM 844 C CA . ALA A 1 119 ? 30.442 19.354 39.461 1.0 20.52 ? 148 ALA A CA 1 119 . A ATOM 845 C C . ALA A 1 119 ? 31.684 20.126 39.907 1.0 22.0 ? 148 ALA A C 1 119 . A ATOM 846 O O . ALA A 1 119 ? 31.617 21.345 40.116 1.0 22.76 ? 148 ALA A O 1 119 . A ATOM 847 C CB . ALA A 1 119 ? 29.764 18.692 40.641 1.0 23.04 ? 148 ALA A CB 1 119 . A ATOM 848 N N . ALA A 1 120 ? 32.822 19.451 40.013 1.0 18.8 ? 149 ALA A N 1 120 . A ATOM 849 C CA . ALA A 1 120 ? 34.115 20.137 40.313 1.0 19.16 ? 149 ALA A CA 1 120 . A ATOM 850 C C . ALA A 1 120 ? 34.489 21.132 39.220 1.0 19.19 ? 149 ALA A C 1 120 . A ATOM 851 O O . ALA A 1 120 ? 34.854 22.300 39.508 1.0 20.49 ? 149 ALA A O 1 120 . A ATOM 852 C CB . ALA A 1 120 ? 35.264 19.148 40.533 1.0 20.59 ? 149 ALA A CB 1 120 . A ATOM 853 N N . ALA A 1 121 ? 34.354 20.688 37.979 1.0 17.81 ? 150 ALA A N 1 121 . A ATOM 854 C CA . ALA A 1 121 ? 34.638 21.512 36.813 1.0 18.45 ? 150 ALA A CA 1 121 . A ATOM 855 C C . ALA A 1 121 ? 33.707 22.729 36.850 1.0 18.28 ? 150 ALA A C 1 121 . A ATOM 856 O O . ALA A 1 121 ? 34.152 23.840 36.559 1.0 18.01 ? 150 ALA A O 1 121 . A ATOM 857 C CB . ALA A 1 121 ? 34.479 20.737 35.520 1.0 20.56 ? 150 ALA A CB 1 121 . A ATOM 858 N N . GLU A 1 122 ? 32.457 22.555 37.301 1.0 17.63 ? 151 GLU A N 1 122 . A ATOM 859 C CA . GLU A 1 122 ? 31.569 23.730 37.412 1.0 19.3 ? 151 GLU A CA 1 122 . A ATOM 860 C C . GLU A 1 122 ? 32.125 24.765 38.382 1.0 18.54 ? 151 GLU A C 1 122 . A ATOM 861 O O . GLU A 1 122 ? 32.046 26.001 38.104 1.0 19.95 ? 151 GLU A O 1 122 . A ATOM 862 C CB . GLU A 1 122 ? 30.105 23.363 37.713 1.0 22.68 ? 151 GLU A CB 1 122 . A ATOM 863 C CG . GLU A 1 122 ? 29.367 22.709 36.541 1.0 25.35 ? 151 GLU A CG 1 122 . A ATOM 864 C CD . GLU A 1 122 ? 29.277 23.546 35.256 1.0 28.97 ? 151 GLU A CD 1 122 . A ATOM 865 O OE1 . GLU A 1 122 ? 29.506 24.787 35.270 1.0 33.01 ? 151 GLU A OE1 1 122 . A ATOM 866 O OE2 . GLU A 1 122 ? 28.957 22.939 34.199 1.0 36.12 ? 151 GLU A OE2 1 122 . A ATOM 867 N N . LYS A 1 123 ? 32.706 24.343 39.507 1.0 19.44 ? 152 LYS A N 1 123 . A ATOM 868 C CA . LYS A 1 123 ? 33.264 25.280 40.479 1.0 19.49 ? 152 LYS A CA 1 123 . A ATOM 869 C C . LYS A 1 123 ? 34.447 26.021 39.856 1.0 18.13 ? 152 LYS A C 1 123 . A ATOM 870 O O . LYS A 1 123 ? 34.577 27.221 40.044 1.0 19.76 ? 152 LYS A O 1 123 . A ATOM 871 C CB . LYS A 1 123 ? 33.687 24.583 41.762 1.0 22.85 ? 152 LYS A CB 1 123 . A ATOM 872 C CG . LYS A 1 123 ? 32.497 23.980 42.510 1.0 26.56 ? 152 LYS A CG 1 123 . A ATOM 873 C CD . LYS A 1 123 ? 32.679 23.938 44.015 1.0 31.41 ? 152 LYS A CD 1 123 . A ATOM 874 C CE . LYS A 1 123 ? 31.638 23.030 44.650 1.0 34.92 ? 152 LYS A CE 1 123 . A ATOM 875 N NZ . LYS A 1 123 ? 30.262 23.543 44.423 1.0 37.02 ? 152 LYS A NZ 1 123 . A ATOM 876 N N . ILE A 1 124 ? 35.307 25.311 39.129 1.0 16.81 ? 153 ILE A N 1 124 . A ATOM 877 C CA . ILE A 1 124 ? 36.435 26.016 38.512 1.0 16.97 ? 153 ILE A CA 1 124 . A ATOM 878 C C . ILE A 1 124 ? 35.923 26.979 37.403 1.0 16.27 ? 153 ILE A C 1 124 . A ATOM 879 O O . ILE A 1 124 ? 36.477 28.091 37.213 1.0 16.73 ? 153 ILE A O 1 124 . A ATOM 880 C CB . ILE A 1 124 ? 37.507 25.034 38.006 1.0 17.53 ? 153 ILE A CB 1 124 . A ATOM 881 C CG1 . ILE A 1 124 ? 38.135 24.259 39.210 1.0 20.82 ? 153 ILE A CG1 1 124 . A ATOM 882 C CG2 . ILE A 1 124 ? 38.565 25.757 37.157 1.0 18.19 ? 153 ILE A CG2 1 124 . A ATOM 883 C CD1 . ILE A 1 124 ? 38.641 25.108 40.335 1.0 22.64 ? 153 ILE A CD1 1 124 . A ATOM 884 N N . LYS A 1 125 ? 34.884 26.540 36.697 1.0 16.07 ? 154 LYS A N 1 125 . A ATOM 885 C CA A LYS A 1 125 ? 34.336 27.317 35.575 0.43 17.81 ? 154 LYS A CA 1 125 . A ATOM 886 C CA B LYS A 1 125 ? 34.323 27.302 35.564 0.57 17.55 ? 154 LYS A CA 1 125 . A ATOM 887 C C . LYS A 1 125 ? 33.639 28.584 36.030 1.0 17.81 ? 154 LYS A C 1 125 . A ATOM 888 O O . LYS A 1 125 ? 33.318 29.486 35.169 1.0 16.75 ? 154 LYS A O 1 125 . A ATOM 889 C CB A LYS A 1 125 ? 33.410 26.478 34.705 0.43 18.87 ? 154 LYS A CB 1 125 . A ATOM 890 C CB B LYS A 1 125 ? 33.366 26.448 34.721 0.57 18.34 ? 154 LYS A CB 1 125 . A ATOM 891 C CG A LYS A 1 125 ? 34.156 25.604 33.718 0.43 20.54 ? 154 LYS A CG 1 125 . A ATOM 892 C CG B LYS A 1 125 ? 34.036 25.442 33.779 0.57 19.78 ? 154 LYS A CG 1 125 . A ATOM 893 C CD A LYS A 1 125 ? 33.283 24.509 33.135 0.43 23.82 ? 154 LYS A CD 1 125 . A ATOM 894 C CD B LYS A 1 125 ? 33.192 24.184 33.483 0.57 23.16 ? 154 LYS A CD 1 125 . A ATOM 895 C CE A LYS A 1 125 ? 32.001 25.067 32.524 0.43 25.06 ? 154 LYS A CE 1 125 . A ATOM 896 C CE B LYS A 1 125 ? 33.839 23.267 32.451 0.57 23.27 ? 154 LYS A CE 1 125 . A ATOM 897 N NZ A LYS A 1 125 ? 30.951 24.016 32.378 0.43 25.75 ? 154 LYS A NZ 1 125 . A ATOM 898 N NZ B LYS A 1 125 ? 32.968 22.191 31.920 0.57 26.06 ? 154 LYS A NZ 1 125 . A ATOM 899 N N . LYS A 1 126 ? 33.386 28.729 37.320 1.0 18.33 ? 155 LYS A N 1 126 . A ATOM 900 C CA . LYS A 1 126 ? 32.939 30.032 37.851 1.0 18.75 ? 155 LYS A CA 1 126 . A ATOM 901 C C . LYS A 1 126 ? 33.906 31.117 37.403 1.0 17.2 ? 155 LYS A C 1 126 . A ATOM 902 O O . LYS A 1 126 ? 33.503 32.244 37.025 1.0 17.94 ? 155 LYS A O 1 126 . A ATOM 903 C CB . LYS A 1 126 ? 32.916 30.061 39.386 1.0 21.01 ? 155 LYS A CB 1 126 . A ATOM 904 C CG . LYS A 1 126 ? 32.313 31.347 39.963 1.0 22.44 ? 155 LYS A CG 1 126 . A ATOM 905 C CD . LYS A 1 126 ? 32.777 31.879 41.345 1.0 26.88 ? 155 LYS A CD 1 126 . A ATOM 906 C CE . LYS A 1 126 ? 32.099 31.253 42.564 1.0 27.37 ? 155 LYS A CE 1 126 . A ATOM 907 N NZ . LYS A 1 126 ? 30.611 31.174 42.501 1.0 27.2 ? 155 LYS A NZ 1 126 . A ATOM 908 N N . GLN A 1 127 ? 35.226 30.825 37.472 1.0 16.07 ? 156 GLN A N 1 127 . A ATOM 909 C CA . GLN A 1 127 ? 36.266 31.857 37.291 1.0 15.99 ? 156 GLN A CA 1 127 . A ATOM 910 C C . GLN A 1 127 ? 37.036 31.703 35.972 1.0 15.66 ? 156 GLN A C 1 127 . A ATOM 911 O O . GLN A 1 127 ? 37.383 32.704 35.331 1.0 15.64 ? 156 GLN A O 1 127 . A ATOM 912 C CB . GLN A 1 127 ? 37.261 31.895 38.496 1.0 15.42 ? 156 GLN A CB 1 127 . A ATOM 913 C CG . GLN A 1 127 ? 38.564 32.645 38.371 1.0 17.54 ? 156 GLN A CG 1 127 . A ATOM 914 C CD . GLN A 1 127 ? 39.724 31.847 37.726 1.0 16.22 ? 156 GLN A CD 1 127 . A ATOM 915 O OE1 . GLN A 1 127 ? 40.044 30.722 38.131 1.0 18.56 ? 156 GLN A OE1 1 127 . A ATOM 916 N NE2 . GLN A 1 127 ? 40.402 32.484 36.786 1.0 16.53 ? 156 GLN A NE2 1 127 . A ATOM 917 N N . ILE A 1 128 ? 37.322 30.506 35.550 1.0 17.24 ? 157 ILE A N 1 128 . A ATOM 918 C CA . ILE A 1 128 ? 38.325 30.341 34.491 1.0 15.98 ? 157 ILE A CA 1 128 . A ATOM 919 C C . ILE A 1 128 ? 37.700 30.723 33.154 1.0 14.29 ? 157 ILE A C 1 128 . A ATOM 920 O O . ILE A 1 128 ? 36.502 30.487 32.893 1.0 18.08 ? 157 ILE A O 1 128 . A ATOM 921 C CB . ILE A 1 128 ? 38.884 28.895 34.417 1.0 15.43 ? 157 ILE A CB 1 128 . A ATOM 922 C CG1 . ILE A 1 128 ? 40.328 28.769 33.797 1.0 15.13 ? 157 ILE A CG1 1 128 . A ATOM 923 C CG2 . ILE A 1 128 ? 37.897 27.941 33.770 1.0 15.82 ? 157 ILE A CG2 1 128 . A ATOM 924 C CD1 . ILE A 1 128 ? 40.800 27.308 33.733 1.0 16.12 ? 157 ILE A CD1 1 128 . A ATOM 925 N N . ASP A 1 129 ? 38.519 31.283 32.323 1.0 15.03 ? 158 ASP A N 1 129 . A ATOM 926 C CA . ASP A 1 129 ? 38.185 31.413 30.894 1.0 14.52 ? 158 ASP A CA 1 129 . A ATOM 927 C C . ASP A 1 129 ? 38.226 30.025 30.227 1.0 14.3 ? 158 ASP A C 1 129 . A ATOM 928 O O . ASP A 1 129 ? 39.312 29.376 30.326 1.0 12.8 ? 158 ASP A O 1 129 . A ATOM 929 C CB . ASP A 1 129 ? 39.187 32.339 30.214 1.0 15.38 ? 158 ASP A CB 1 129 . A ATOM 930 C CG . ASP A 1 129 ? 38.757 32.753 28.873 1.0 16.15 ? 158 ASP A CG 1 129 . A ATOM 931 O OD1 . ASP A 1 129 ? 38.082 31.974 28.179 1.0 16.86 ? 158 ASP A OD1 1 129 . A ATOM 932 O OD2 . ASP A 1 129 ? 39.191 33.846 28.468 1.0 18.2 ? 158 ASP A OD2 1 129 . A ATOM 933 N N . PRO A 1 130 ? 37.099 29.526 29.660 1.0 15.59 ? 159 PRO A N 1 130 . A ATOM 934 C CA . PRO A 1 130 ? 37.037 28.167 29.069 1.0 17.54 ? 159 PRO A CA 1 130 . A ATOM 935 C C . PRO A 1 130 ? 38.069 27.975 28.008 1.0 15.74 ? 159 PRO A C 1 130 . A ATOM 936 O O . PRO A 1 130 ? 38.344 26.796 27.705 1.0 16.29 ? 159 PRO A O 1 130 . A ATOM 937 C CB . PRO A 1 130 ? 35.643 28.059 28.443 1.0 20.17 ? 159 PRO A CB 1 130 . A ATOM 938 C CG . PRO A 1 130 ? 35.151 29.469 28.370 1.0 21.63 ? 159 PRO A CG 1 130 . A ATOM 939 C CD . PRO A 1 130 ? 35.796 30.203 29.496 1.0 19.41 ? 159 PRO A CD 1 130 . A ATOM 940 N N . LYS A 1 131 ? 38.636 29.038 27.414 1.0 14.93 ? 160 LYS A N 1 131 . A ATOM 941 C CA . LYS A 1 131 ? 39.744 28.906 26.472 1.0 17.83 ? 160 LYS A CA 1 131 . A ATOM 942 C C . LYS A 1 131 ? 40.891 28.005 27.016 1.0 17.39 ? 160 LYS A C 1 131 . A ATOM 943 O O . LYS A 1 131 ? 41.554 27.295 26.247 1.0 18.93 ? 160 LYS A O 1 131 . A ATOM 944 C CB . LYS A 1 131 ? 40.254 30.279 25.956 1.0 17.63 ? 160 LYS A CB 1 131 . A ATOM 945 C CG . LYS A 1 131 ? 41.076 31.121 26.867 1.0 19.05 ? 160 LYS A CG 1 131 . A ATOM 946 C CD . LYS A 1 131 ? 41.738 32.324 26.165 1.0 22.1 ? 160 LYS A CD 1 131 . A ATOM 947 C CE . LYS A 1 131 ? 40.845 33.259 25.410 1.0 27.46 ? 160 LYS A CE 1 131 . A ATOM 948 N NZ . LYS A 1 131 ? 41.798 34.207 24.769 1.0 26.2 ? 160 LYS A NZ 1 131 . A ATOM 949 N N . PHE A 1 132 ? 41.073 27.982 28.332 1.0 14.97 ? 161 PHE A N 1 132 . A ATOM 950 C CA . PHE A 1 132 ? 42.160 27.233 28.962 1.0 14.41 ? 161 PHE A CA 1 132 . A ATOM 951 C C . PHE A 1 132 ? 41.808 25.833 29.390 1.0 16.13 ? 161 PHE A C 1 132 . A ATOM 952 O O . PHE A 1 132 ? 42.680 25.188 29.973 1.0 16.51 ? 161 PHE A O 1 132 . A ATOM 953 C CB . PHE A 1 132 ? 42.732 28.003 30.166 1.0 15.89 ? 161 PHE A CB 1 132 . A ATOM 954 C CG . PHE A 1 132 ? 43.254 29.325 29.793 1.0 14.35 ? 161 PHE A CG 1 132 . A ATOM 955 C CD1 . PHE A 1 132 ? 44.421 29.391 29.027 1.0 15.28 ? 161 PHE A CD1 1 132 . A ATOM 956 C CD2 . PHE A 1 132 ? 42.641 30.484 30.190 1.0 14.72 ? 161 PHE A CD2 1 132 . A ATOM 957 C CE1 . PHE A 1 132 ? 44.935 30.594 28.644 1.0 15.27 ? 161 PHE A CE1 1 132 . A ATOM 958 C CE2 . PHE A 1 132 ? 43.160 31.691 29.824 1.0 15.7 ? 161 PHE A CE2 1 132 . A ATOM 959 C CZ . PHE A 1 132 ? 44.282 31.742 29.000 1.0 14.8 ? 161 PHE A CZ 1 132 . A ATOM 960 N N . LEU A 1 133 ? 40.579 25.423 29.192 1.0 15.53 ? 162 LEU A N 1 133 . A ATOM 961 C CA . LEU A 1 133 ? 40.097 24.130 29.629 1.0 16.56 ? 162 LEU A CA 1 133 . A ATOM 962 C C . LEU A 1 133 ? 40.182 23.186 28.520 1.0 18.11 ? 162 LEU A C 1 133 . A ATOM 963 O O . LEU A 1 133 ? 39.715 23.448 27.416 1.0 19.77 ? 162 LEU A O 1 133 . A ATOM 964 C CB . LEU A 1 133 ? 38.666 24.219 30.136 1.0 20.04 ? 162 LEU A CB 1 133 . A ATOM 965 C CG . LEU A 1 133 ? 38.573 24.977 31.443 1.0 22.03 ? 162 LEU A CG 1 133 . A ATOM 966 C CD1 . LEU A 1 133 ? 37.067 25.141 31.756 1.0 23.89 ? 162 LEU A CD1 1 133 . A ATOM 967 C CD2 . LEU A 1 133 ? 39.338 24.353 32.629 1.0 24.79 ? 162 LEU A CD2 1 133 . A ATOM 968 N N . ASN A 1 134 ? 40.748 22.026 28.847 1.0 17.9 ? 163 ASN A N 1 134 . A ATOM 969 C CA . ASN A 1 134 ? 40.692 20.883 27.958 1.0 20.49 ? 163 ASN A CA 1 134 . A ATOM 970 C C . ASN A 1 134 ? 39.477 20.036 28.282 1.0 20.43 ? 163 ASN A C 1 134 . A ATOM 971 O O . ASN A 1 134 ? 38.973 20.078 29.438 1.0 21.76 ? 163 ASN A O 1 134 . A ATOM 972 C CB . ASN A 1 134 ? 41.952 20.038 28.129 1.0 19.37 ? 163 ASN A CB 1 134 . A ATOM 973 C CG . ASN A 1 134 ? 42.102 18.981 27.050 1.0 22.53 ? 163 ASN A CG 1 134 . A ATOM 974 O OD1 . ASN A 1 134 ? 41.626 17.831 27.197 1.0 18.3 ? 163 ASN A OD1 1 134 . A ATOM 975 N ND2 . ASN A 1 134 ? 42.737 19.356 25.960 1.0 20.69 ? 163 ASN A ND2 1 134 . A ATOM 976 N N . ALA A 1 135 ? 39.040 19.299 27.261 1.0 19.61 ? 164 ALA A N 1 135 . A ATOM 977 C CA . ALA A 1 135 ? 37.981 18.272 27.359 1.0 22.38 ? 164 ALA A CA 1 135 . A ATOM 978 C C . ALA A 1 135 ? 38.109 17.323 28.534 1.0 21.09 ? 164 ALA A C 1 135 . A ATOM 979 O O . ALA A 1 135 ? 37.066 16.928 29.124 1.0 21.76 ? 164 ALA A O 1 135 . A ATOM 980 C CB . ALA A 1 135 ? 37.901 17.464 26.053 1.0 22.03 ? 164 ALA A CB 1 135 . A ATOM 981 N N . SER A 1 136 ? 39.361 16.938 28.805 1.0 21.11 ? 165 SER A N 1 136 . A ATOM 982 C CA . SER A 1 136 ? 39.746 15.897 29.766 1.0 22.95 ? 165 SER A CA 1 136 . A ATOM 983 C C . SER A 1 136 ? 39.560 16.365 31.194 1.0 21.08 ? 165 SER A C 1 136 . A ATOM 984 O O . SER A 1 136 ? 39.623 15.564 32.127 1.0 21.35 ? 165 SER A O 1 136 . A ATOM 985 C CB . SER A 1 136 ? 41.230 15.555 29.583 1.0 24.1 ? 165 SER A CB 1 136 . A ATOM 986 O OG . SER A 1 136 ? 42.057 16.677 29.914 1.0 25.6 ? 165 SER A OG 1 136 . A ATOM 987 N N . GLY A 1 137 ? 39.422 17.668 31.380 1.0 18.09 ? 166 GLY A N 1 137 . A ATOM 988 C CA . GLY A 1 137 ? 39.371 18.260 32.720 1.0 17.1 ? 166 GLY A CA 1 137 . A ATOM 989 C C . GLY A 1 137 ? 40.729 18.846 33.095 1.0 14.55 ? 166 GLY A C 1 137 . A ATOM 990 O O . GLY A 1 137 ? 40.827 19.494 34.096 1.0 14.02 ? 166 GLY A O 1 137 . A ATOM 991 N N . LYS A 1 138 ? 41.763 18.724 32.276 1.0 14.49 ? 167 LYS A N 1 138 . A ATOM 992 C CA . LYS A 1 138 ? 43.072 19.345 32.545 1.0 14.2 ? 167 LYS A CA 1 138 . A ATOM 993 C C . LYS A 1 138 ? 43.109 20.797 32.051 1.0 13.65 ? 167 LYS A C 1 138 . A ATOM 994 O O . LYS A 1 138 ? 42.352 21.134 31.174 1.0 15.39 ? 167 LYS A O 1 138 . A ATOM 995 C CB . LYS A 1 138 ? 44.181 18.557 31.879 1.0 15.67 ? 167 LYS A CB 1 138 . A ATOM 996 C CG . LYS A 1 138 ? 44.254 17.121 32.370 1.0 16.54 ? 167 LYS A CG 1 138 . A ATOM 997 C CD . LYS A 1 138 ? 45.636 16.558 32.107 1.0 19.76 ? 167 LYS A CD 1 138 . A ATOM 998 C CE . LYS A 1 138 ? 45.713 15.060 32.326 1.0 23.55 ? 167 LYS A CE 1 138 . A ATOM 999 N NZ . LYS A 1 138 ? 47.003 14.570 31.759 1.0 29.37 ? 167 LYS A NZ 1 138 . A ATOM 1000 N N . VAL A 1 139 ? 44.017 21.572 32.603 1.0 13.28 ? 168 VAL A N 1 139 . A ATOM 1001 C CA . VAL A 1 139 ? 44.125 22.981 32.276 1.0 12.73 ? 168 VAL A CA 1 139 . A ATOM 1002 C C . VAL A 1 139 ? 45.286 23.161 31.313 1.0 13.24 ? 168 VAL A C 1 139 . A ATOM 1003 O O . VAL A 1 139 ? 46.378 22.712 31.594 1.0 13.93 ? 168 VAL A O 1 139 . A ATOM 1004 C CB . VAL A 1 139 ? 44.317 23.786 33.569 1.0 14.46 ? 168 VAL A CB 1 139 . A ATOM 1005 C CG1 . VAL A 1 139 ? 44.654 25.247 33.299 1.0 13.88 ? 168 VAL A CG1 1 139 . A ATOM 1006 C CG2 . VAL A 1 139 ? 43.024 23.733 34.413 1.0 15.02 ? 168 VAL A CG2 1 139 . A ATOM 1007 N N . ASN A 1 140 ? 45.056 23.889 30.216 1.0 14.33 ? 169 ASN A N 1 140 . A ATOM 1008 C CA . ASN A 1 140 ? 46.140 24.271 29.309 1.0 13.44 ? 169 ASN A CA 1 140 . A ATOM 1009 C C . ASN A 1 140 ? 46.900 25.462 29.869 1.0 13.53 ? 169 ASN A C 1 140 . A ATOM 1010 O O . ASN A 1 140 ? 46.327 26.539 30.082 1.0 18.63 ? 169 ASN A O 1 140 . A ATOM 1011 C CB . ASN A 1 140 ? 45.640 24.432 27.876 1.0 14.38 ? 169 ASN A CB 1 140 . A ATOM 1012 C CG . ASN A 1 140 ? 46.719 24.840 26.905 1.0 13.33 ? 169 ASN A CG 1 140 . A ATOM 1013 O OD1 . ASN A 1 140 ? 47.948 24.672 27.113 1.0 12.85 ? 169 ASN A OD1 1 140 . A ATOM 1014 N ND2 . ASN A 1 140 ? 46.272 25.501 25.804 1.0 15.96 ? 169 ASN A ND2 1 140 . A ATOM 1015 N N . VAL A 1 141 ? 48.210 25.307 30.094 1.0 13.84 ? 170 VAL A N 1 141 . A ATOM 1016 C CA . VAL A 1 141 ? 49.039 26.369 30.646 1.0 15.21 ? 170 VAL A CA 1 141 . A ATOM 1017 C C . VAL A 1 141 ? 50.077 26.934 29.646 1.0 13.76 ? 170 VAL A C 1 141 . A ATOM 1018 O O . VAL A 1 141 ? 51.014 27.662 30.056 1.0 17.26 ? 170 VAL A O 1 141 . A ATOM 1019 C CB . VAL A 1 141 ? 49.717 25.936 31.970 1.0 14.91 ? 170 VAL A CB 1 141 . A ATOM 1020 C CG1 . VAL A 1 141 ? 48.641 25.576 32.975 1.0 16.19 ? 170 VAL A CG1 1 141 . A ATOM 1021 C CG2 . VAL A 1 141 ? 50.643 24.751 31.752 1.0 16.67 ? 170 VAL A CG2 1 141 . A ATOM 1022 N N . ALA A 1 142 ? 49.956 26.526 28.390 1.0 13.75 ? 171 ALA A N 1 142 . A ATOM 1023 C CA . ALA A 1 142 ? 50.933 26.940 27.291 1.0 14.82 ? 171 ALA A CA 1 142 . A ATOM 1024 C C . ALA A 1 142 ? 50.378 28.113 26.510 1.0 16.07 ? 171 ALA A C 1 142 . A ATOM 1025 O O . ALA A 1 142 ? 49.390 27.958 25.785 1.0 16.98 ? 171 ALA A O 1 142 . A ATOM 1026 C CB . ALA A 1 142 ? 51.147 25.797 26.342 1.0 15.18 ? 171 ALA A CB 1 142 . A ATOM 1027 N N . THR A 1 143 ? 50.908 29.308 26.728 1.0 16.36 ? 172 THR A N 1 143 . A ATOM 1028 C CA . THR A 1 143 ? 50.479 30.469 25.976 1.0 18.13 ? 172 THR A CA 1 143 . A ATOM 1029 C C . THR A 1 143 ? 51.638 31.164 25.298 1.0 17.55 ? 172 THR A C 1 143 . A ATOM 1030 O O . THR A 1 143 ? 52.799 31.051 25.693 1.0 18.75 ? 172 THR A O 1 143 . A ATOM 1031 C CB . THR A 1 143 ? 49.766 31.516 26.841 1.0 17.28 ? 172 THR A CB 1 143 . A ATOM 1032 O OG1 . THR A 1 143 ? 50.641 32.054 27.891 1.0 18.89 ? 172 THR A OG1 1 143 . A ATOM 1033 C CG2 . THR A 1 143 ? 48.489 30.953 27.358 1.0 16.36 ? 172 THR A CG2 1 143 . A ATOM 1034 N N . ILE A 1 144 ? 51.273 31.927 24.279 1.0 20.97 ? 173 ILE A N 1 144 . A ATOM 1035 C CA . ILE A 1 144 ? 52.212 32.807 23.582 1.0 23.83 ? 173 ILE A CA 1 144 . A ATOM 1036 C C . ILE A 1 144 ? 51.580 34.196 23.631 1.0 25.44 ? 173 ILE A C 1 144 . A ATOM 1037 O O . ILE A 1 144 ? 50.512 34.438 23.049 1.0 28.36 ? 173 ILE A O 1 144 . A ATOM 1038 C CB . ILE A 1 144 ? 52.436 32.348 22.137 1.0 25.3 ? 173 ILE A CB 1 144 . A ATOM 1039 C CG1 . ILE A 1 144 ? 53.088 30.957 22.095 1.0 28.13 ? 173 ILE A CG1 1 144 . A ATOM 1040 C CG2 . ILE A 1 144 ? 53.284 33.401 21.424 1.0 25.06 ? 173 ILE A CG2 1 144 . A ATOM 1041 C CD1 . ILE A 1 144 ? 52.700 30.106 20.912 1.0 31.06 ? 173 ILE A CD1 1 144 . A ATOM 1042 N N . ASP A 1 145 ? 52.192 35.088 24.403 1.0 27.8 ? 174 ASP A N 1 145 . A ATOM 1043 C CA . ASP A 1 145 ? 51.606 36.398 24.752 1.0 26.65 ? 174 ASP A CA 1 145 . A ATOM 1044 C C . ASP A 1 145 ? 50.204 36.338 25.313 1.0 27.65 ? 174 ASP A C 1 145 . A ATOM 1045 O O . ASP A 1 145 ? 49.348 37.147 24.956 1.0 30.57 ? 174 ASP A O 1 145 . A ATOM 1046 C CB . ASP A 1 145 ? 51.668 37.339 23.548 1.0 31.96 ? 174 ASP A CB 1 145 . A ATOM 1047 C CG . ASP A 1 145 ? 53.005 37.949 23.410 1.0 35.33 ? 174 ASP A CG 1 145 . A ATOM 1048 O OD1 . ASP A 1 145 ? 53.400 38.638 24.373 1.0 38.5 ? 174 ASP A OD1 1 145 . A ATOM 1049 O OD2 . ASP A 1 145 ? 53.657 37.735 22.371 1.0 42.22 ? 174 ASP A OD2 1 145 . A ATOM 1050 N N . GLY A 1 146 ? 49.949 35.334 26.139 1.0 23.42 ? 175 GLY A N 1 146 . A ATOM 1051 C CA . GLY A 1 146 ? 48.647 35.218 26.772 1.0 24.66 ? 175 GLY A CA 1 146 . A ATOM 1052 C C . GLY A 1 146 ? 47.580 34.561 25.916 1.0 22.18 ? 175 GLY A C 1 146 . A ATOM 1053 O O . GLY A 1 146 ? 46.467 34.321 26.416 1.0 24.18 ? 175 GLY A O 1 146 . A ATOM 1054 N N . LYS A 1 147 ? 47.920 34.219 24.663 1.0 19.89 ? 176 LYS A N 1 147 . A ATOM 1055 C CA . LYS A 1 147 ? 47.001 33.470 23.809 1.0 20.5 ? 176 LYS A CA 1 147 . A ATOM 1056 C C . LYS A 1 147 ? 47.478 31.999 23.654 1.0 15.56 ? 176 LYS A C 1 147 . A ATOM 1057 O O . LYS A 1 147 ? 48.636 31.707 23.612 1.0 20.98 ? 176 LYS A O 1 147 . A ATOM 1058 C CB . LYS A 1 147 ? 46.893 34.107 22.429 1.0 22.8 ? 176 LYS A CB 1 147 . A ATOM 1059 C CG . LYS A 1 147 ? 46.172 35.474 22.421 1.0 27.62 ? 176 LYS A CG 1 147 . A ATOM 1060 C CD . LYS A 1 147 ? 46.314 36.269 21.120 1.0 30.33 ? 176 LYS A CD 1 147 . A ATOM 1061 C CE . LYS A 1 147 ? 46.420 35.441 19.831 1.0 33.32 ? 176 LYS A CE 1 147 . A ATOM 1062 N NZ . LYS A 1 147 ? 46.757 36.279 18.631 1.0 36.57 ? 176 LYS A NZ 1 147 . A ATOM 1063 N N . THR A 1 148 ? 46.506 31.130 23.578 1.0 16.11 ? 177 THR A N 1 148 . A ATOM 1064 C CA . THR A 1 148 ? 46.804 29.715 23.417 1.0 16.07 ? 177 THR A CA 1 148 . A ATOM 1065 C C . THR A 1 148 ? 47.281 29.547 21.983 1.0 16.12 ? 177 THR A C 1 148 . A ATOM 1066 O O . THR A 1 148 ? 46.907 30.332 21.075 1.0 18.34 ? 177 THR A O 1 148 . A ATOM 1067 C CB . THR A 1 148 ? 45.610 28.814 23.723 1.0 16.91 ? 177 THR A CB 1 148 . A ATOM 1068 O OG1 . THR A 1 148 ? 44.565 29.039 22.790 1.0 18.12 ? 177 THR A OG1 1 148 . A ATOM 1069 C CG2 . THR A 1 148 ? 45.024 29.156 25.117 1.0 17.27 ? 177 THR A CG2 1 148 . A ATOM 1070 N N . ALA A 1 149 ? 48.145 28.563 21.793 1.0 16.46 ? 178 ALA A N 1 149 . A ATOM 1071 C CA . ALA A 1 149 ? 48.696 28.319 20.453 1.0 17.34 ? 178 ALA A CA 1 149 . A ATOM 1072 C C . ALA A 1 149 ? 47.626 28.231 19.369 1.0 17.3 ? 178 ALA A C 1 149 . A ATOM 1073 O O . ALA A 1 149 ? 47.824 28.823 18.266 1.0 18.5 ? 178 ALA A O 1 149 . A ATOM 1074 C CB . ALA A 1 149 ? 49.608 27.105 20.429 1.0 18.67 ? 178 ALA A CB 1 149 . A ATOM 1075 N N . PRO A 1 150 ? 46.456 27.600 19.633 1.0 17.33 ? 179 PRO A N 1 150 . A ATOM 1076 C CA . PRO A 1 150 ? 45.465 27.487 18.540 1.0 18.27 ? 179 PRO A CA 1 150 . A ATOM 1077 C C . PRO A 1 150 ? 44.745 28.790 18.134 1.0 18.33 ? 179 PRO A C 1 150 . A ATOM 1078 O O . PRO A 1 150 ? 43.997 28.810 17.151 1.0 22.05 ? 179 PRO A O 1 150 . A ATOM 1079 C CB . PRO A 1 150 ? 44.495 26.386 19.055 1.0 19.19 ? 179 PRO A CB 1 150 . A ATOM 1080 C CG . PRO A 1 150 ? 45.418 25.568 19.913 1.0 19.04 ? 179 PRO A CG 1 150 . A ATOM 1081 C CD . PRO A 1 150 ? 46.142 26.616 20.687 1.0 15.99 ? 179 PRO A CD 1 150 . A ATOM 1082 N N . GLU A 1 151 ? 44.969 29.857 18.893 1.0 17.42 ? 180 GLU A N 1 151 . A ATOM 1083 C CA . GLU A 1 151 ? 44.487 31.168 18.518 1.0 21.27 ? 180 GLU A CA 1 151 . A ATOM 1084 C C . GLU A 1 151 ? 45.281 31.730 17.380 1.0 23.29 ? 180 GLU A C 1 151 . A ATOM 1085 O O . GLU A 1 151 ? 44.784 32.648 16.734 1.0 26.35 ? 180 GLU A O 1 151 . A ATOM 1086 C CB . GLU A 1 151 ? 44.526 32.120 19.688 1.0 22.84 ? 180 GLU A CB 1 151 . A ATOM 1087 C CG . GLU A 1 151 ? 43.582 31.726 20.806 1.0 22.97 ? 180 GLU A CG 1 151 . A ATOM 1088 C CD . GLU A 1 151 ? 43.581 32.764 21.906 1.0 23.64 ? 180 GLU A CD 1 151 . A ATOM 1089 O OE1 . GLU A 1 151 ? 43.509 33.975 21.557 1.0 28.01 ? 180 GLU A OE1 1 151 . A ATOM 1090 O OE2 . GLU A 1 151 ? 43.713 32.421 23.106 1.0 28.43 ? 180 GLU A OE2 1 151 . A ATOM 1091 N N . TYR A 1 152 ? 46.506 31.251 17.155 1.0 19.61 ? 181 TYR A N 1 152 . A ATOM 1092 C CA . TYR A 1 152 ? 47.347 31.782 16.079 1.0 21.69 ? 181 TYR A CA 1 152 . A ATOM 1093 C C . TYR A 1 152 ? 47.044 31.031 14.781 1.0 22.15 ? 181 TYR A C 1 152 . A ATOM 1094 O O . TYR A 1 152 ? 46.595 29.857 14.775 1.0 21.53 ? 181 TYR A O 1 152 . A ATOM 1095 C CB . TYR A 1 152 ? 48.839 31.680 16.437 1.0 22.94 ? 181 TYR A CB 1 152 . A ATOM 1096 C CG . TYR A 1 152 ? 49.214 32.599 17.589 1.0 24.52 ? 181 TYR A CG 1 152 . A ATOM 1097 C CD1 . TYR A 1 152 ? 49.479 33.932 17.369 1.0 26.8 ? 181 TYR A CD1 1 152 . A ATOM 1098 C CD2 . TYR A 1 152 ? 49.252 32.144 18.899 1.0 26.24 ? 181 TYR A CD2 1 152 . A ATOM 1099 C CE1 . TYR A 1 152 ? 49.778 34.795 18.403 1.0 28.1 ? 181 TYR A CE1 1 152 . A ATOM 1100 C CE2 . TYR A 1 152 ? 49.575 32.993 19.953 1.0 26.74 ? 181 TYR A CE2 1 152 . A ATOM 1101 C CZ . TYR A 1 152 ? 49.845 34.339 19.695 1.0 28.66 ? 181 TYR A CZ 1 152 . A ATOM 1102 O OH . TYR A 1 152 ? 50.160 35.270 20.704 1.0 29.18 ? 181 TYR A OH 1 152 . A ATOM 1103 N N . ASP A 1 153 ? 47.343 31.713 13.672 1.0 25.07 ? 182 ASP A N 1 153 . A ATOM 1104 C CA . ASP A 1 153 ? 47.078 31.238 12.326 1.0 25.09 ? 182 ASP A CA 1 153 . A ATOM 1105 C C . ASP A 1 153 ? 48.251 30.383 11.834 1.0 25.89 ? 182 ASP A C 1 153 . A ATOM 1106 O O . ASP A 1 153 ? 49.075 30.781 10.987 1.0 25.73 ? 182 ASP A O 1 153 . A ATOM 1107 C CB . ASP A 1 153 ? 46.890 32.457 11.414 1.0 23.54 ? 182 ASP A CB 1 153 . A ATOM 1108 C CG . ASP A 1 153 ? 46.274 32.112 10.064 1.0 26.93 ? 182 ASP A CG 1 153 . A ATOM 1109 O OD1 . ASP A 1 153 ? 45.977 30.933 9.745 1.0 25.28 ? 182 ASP A OD1 1 153 . A ATOM 1110 O OD2 . ASP A 1 153 ? 46.036 33.080 9.290 1.0 24.45 ? 182 ASP A OD2 1 153 . A ATOM 1111 N N . GLY A 1 154 ? 48.355 29.181 12.383 1.0 29.46 ? 183 GLY A N 1 154 . A ATOM 1112 C CA . GLY A 1 154 ? 49.482 28.307 12.078 1.0 30.42 ? 183 GLY A CA 1 154 . A ATOM 1113 C C . GLY A 1 154 ? 50.688 28.633 12.942 1.0 31.65 ? 183 GLY A C 1 154 . A ATOM 1114 O O . GLY A 1 154 ? 50.638 29.533 13.788 1.0 31.43 ? 183 GLY A O 1 154 . A ATOM 1115 N N . VAL A 1 155 ? 51.754 27.869 12.728 1.0 32.46 ? 184 VAL A N 1 155 . A ATOM 1116 C CA . VAL A 1 155 ? 52.976 27.910 13.538 1.0 31.15 ? 184 VAL A CA 1 155 . A ATOM 1117 C C . VAL A 1 155 ? 54.119 28.280 12.597 1.0 31.74 ? 184 VAL A C 1 155 . A ATOM 1118 O O . VAL A 1 155 ? 54.273 27.628 11.560 1.0 31.26 ? 184 VAL A O 1 155 . A ATOM 1119 C CB . VAL A 1 155 ? 53.254 26.527 14.204 1.0 30.85 ? 184 VAL A CB 1 155 . A ATOM 1120 C CG1 . VAL A 1 155 ? 54.619 26.511 14.890 1.0 31.26 ? 184 VAL A CG1 1 155 . A ATOM 1121 C CG2 . VAL A 1 155 ? 52.135 26.204 15.185 1.0 30.3 ? 184 VAL A CG2 1 155 . A ATOM 1122 N N . PRO A 1 156 ? 54.920 29.319 12.937 1.0 34.02 ? 185 PRO A N 1 156 . A ATOM 1123 C CA . PRO A 1 156 ? 56.087 29.629 12.105 1.0 35.25 ? 185 PRO A CA 1 156 . A ATOM 1124 C C . PRO A 1 156 ? 57.033 28.425 12.004 1.0 37.42 ? 185 PRO A C 1 156 . A ATOM 1125 O O . PRO A 1 156 ? 56.847 27.419 12.721 1.0 34.82 ? 185 PRO A O 1 156 . A ATOM 1126 C CB . PRO A 1 156 ? 56.768 30.786 12.850 1.0 35.05 ? 185 PRO A CB 1 156 . A ATOM 1127 C CG . PRO A 1 156 ? 55.737 31.337 13.763 1.0 36.36 ? 185 PRO A CG 1 156 . A ATOM 1128 C CD . PRO A 1 156 ? 54.865 30.183 14.127 1.0 35.42 ? 185 PRO A CD 1 156 . A ATOM 1129 N N . LYS A 1 157 ? 58.033 28.503 11.125 1.0 39.06 ? 186 LYS A N 1 157 . A ATOM 1130 C CA . LYS A 1 157 ? 58.911 27.346 10.861 1.0 43.36 ? 186 LYS A CA 1 157 . A ATOM 1131 C C . LYS A 1 157 ? 59.449 26.757 12.176 1.0 44.59 ? 186 LYS A C 1 157 . A ATOM 1132 O O . LYS A 1 157 ? 59.270 25.568 12.453 1.0 41.56 ? 186 LYS A O 1 157 . A ATOM 1133 C CB . LYS A 1 157 ? 60.065 27.737 9.929 1.0 45.69 ? 186 LYS A CB 1 157 . A ATOM 1134 N N . THR A 1 158 ? 60.062 27.626 12.981 1.0 47.29 ? 187 THR A N 1 158 . A ATOM 1135 C CA . THR A 1 158 ? 60.438 27.328 14.362 1.0 49.83 ? 187 THR A CA 1 158 . A ATOM 1136 C C . THR A 1 158 ? 59.375 27.928 15.305 1.0 50.73 ? 187 THR A C 1 158 . A ATOM 1137 O O . THR A 1 158 ? 59.145 29.149 15.269 1.0 49.83 ? 187 THR A O 1 158 . A ATOM 1138 C CB . THR A 1 158 ? 61.806 27.935 14.712 1.0 49.24 ? 187 THR A CB 1 158 . A ATOM 1139 N N . PRO A 1 159 ? 58.723 27.083 16.145 1.0 51.93 ? 188 PRO A N 1 159 . A ATOM 1140 C CA . PRO A 1 159 ? 57.698 27.587 17.077 1.0 49.83 ? 188 PRO A CA 1 159 . A ATOM 1141 C C . PRO A 1 159 ? 58.318 28.422 18.189 1.0 50.73 ? 188 PRO A C 1 159 . A ATOM 1142 O O . PRO A 1 159 ? 59.429 28.110 18.657 1.0 50.63 ? 188 PRO A O 1 159 . A ATOM 1143 C CB . PRO A 1 159 ? 57.079 26.302 17.660 1.0 52.4 ? 188 PRO A CB 1 159 . A ATOM 1144 C CG . PRO A 1 159 ? 58.148 25.266 17.544 1.0 52.89 ? 188 PRO A CG 1 159 . A ATOM 1145 C CD . PRO A 1 159 ? 58.978 25.639 16.340 1.0 51.32 ? 188 PRO A CD 1 159 . A ATOM 1146 N N . THR A 1 160 ? 57.622 29.477 18.603 1.0 48.21 ? 189 THR A N 1 160 . A ATOM 1147 C CA . THR A 1 160 ? 58.133 30.319 19.682 1.0 46.0 ? 189 THR A CA 1 160 . A ATOM 1148 C C . THR A 1 160 ? 58.096 29.572 21.025 1.0 42.03 ? 189 THR A C 1 160 . A ATOM 1149 O O . THR A 1 160 ? 57.297 28.645 21.227 1.0 37.55 ? 189 THR A O 1 160 . A ATOM 1150 C CB . THR A 1 160 ? 57.404 31.678 19.812 1.0 49.13 ? 189 THR A CB 1 160 . A ATOM 1151 O OG1 . THR A 1 160 ? 58.016 32.450 20.856 1.0 50.54 ? 189 THR A OG1 1 160 . A ATOM 1152 C CG2 . THR A 1 160 ? 55.938 31.511 20.161 1.0 49.99 ? 189 THR A CG2 1 160 . A ATOM 1153 N N . ASP A 1 161 ? 59.003 29.973 21.913 1.0 36.9 ? 190 ASP A N 1 161 . A ATOM 1154 C CA . ASP A 1 161 ? 58.974 29.569 23.301 1.0 36.79 ? 190 ASP A CA 1 161 . A ATOM 1155 C C . ASP A 1 161 ? 57.605 29.947 23.884 1.0 31.42 ? 190 ASP A C 1 161 . A ATOM 1156 O O . ASP A 1 161 ? 57.055 31.018 23.598 1.0 33.95 ? 190 ASP A O 1 161 . A ATOM 1157 C CB . ASP A 1 161 ? 60.095 30.270 24.073 1.0 36.71 ? 190 ASP A CB 1 161 . A ATOM 1158 N N . PHE A 1 162 ? 57.037 29.030 24.648 1.0 28.03 ? 191 PHE A N 1 162 . A ATOM 1159 C CA . PHE A 1 162 ? 55.875 29.330 25.463 1.0 24.32 ? 191 PHE A CA 1 162 . A ATOM 1160 C C . PHE A 1 162 ? 56.255 30.228 26.622 1.0 22.75 ? 191 PHE A C 1 162 . A ATOM 1161 O O . PHE A 1 162 ? 57.369 30.124 27.182 1.0 24.01 ? 191 PHE A O 1 162 . A ATOM 1162 C CB . PHE A 1 162 ? 55.257 28.048 26.014 1.0 23.65 ? 191 PHE A CB 1 162 . A ATOM 1163 C CG . PHE A 1 162 ? 54.539 27.218 24.995 1.0 21.61 ? 191 PHE A CG 1 162 . A ATOM 1164 C CD1 . PHE A 1 162 ? 53.534 27.763 24.227 1.0 21.02 ? 191 PHE A CD1 1 162 . A ATOM 1165 C CD2 . PHE A 1 162 ? 54.863 25.887 24.837 1.0 22.08 ? 191 PHE A CD2 1 162 . A ATOM 1166 C CE1 . PHE A 1 162 ? 52.856 27.010 23.282 1.0 22.04 ? 191 PHE A CE1 1 162 . A ATOM 1167 C CE2 . PHE A 1 162 ? 54.186 25.120 23.912 1.0 23.31 ? 191 PHE A CE2 1 162 . A ATOM 1168 C CZ . PHE A 1 162 ? 53.179 25.689 23.128 1.0 21.55 ? 191 PHE A CZ 1 162 . A ATOM 1169 N N . ASP A 1 163 ? 55.278 31.035 27.019 1.0 22.9 ? 192 ASP A N 1 163 . A ATOM 1170 C CA . ASP A 1 163 ? 55.350 31.994 28.116 1.0 22.31 ? 192 ASP A CA 1 163 . A ATOM 1171 C C . ASP A 1 163 ? 55.741 31.312 29.411 1.0 22.59 ? 192 ASP A C 1 163 . A ATOM 1172 O O . ASP A 1 163 ? 55.384 30.167 29.637 1.0 19.23 ? 192 ASP A O 1 163 . A ATOM 1173 C CB . ASP A 1 163 ? 53.964 32.603 28.355 1.0 20.37 ? 192 ASP A CB 1 163 . A ATOM 1174 C CG . ASP A 1 163 ? 53.497 33.588 27.273 1.0 22.73 ? 192 ASP A CG 1 163 . A ATOM 1175 O OD1 . ASP A 1 163 ? 54.318 34.038 26.455 1.0 25.33 ? 192 ASP A OD1 1 163 . A ATOM 1176 O OD2 . ASP A 1 163 ? 52.278 33.894 27.243 1.0 21.18 ? 192 ASP A OD2 1 163 . A ATOM 1177 N N . GLN A 1 164 ? 56.503 32.029 30.241 1.0 25.73 ? 193 GLN A N 1 164 . A ATOM 1178 C CA . GLN A 1 164 ? 56.810 31.624 31.612 1.0 23.96 ? 193 GLN A CA 1 164 . A ATOM 1179 C C . GLN A 1 164 ? 55.522 31.352 32.374 1.0 20.76 ? 193 GLN A C 1 164 . A ATOM 1180 O O . GLN A 1 164 ? 54.567 32.068 32.204 1.0 19.59 ? 193 GLN A O 1 164 . A ATOM 1181 C CB . GLN A 1 164 ? 57.544 32.759 32.302 1.0 28.59 ? 193 GLN A CB 1 164 . A ATOM 1182 C CG . GLN A 1 164 ? 57.948 32.476 33.730 1.0 34.16 ? 193 GLN A CG 1 164 . A ATOM 1183 C CD . GLN A 1 164 ? 58.552 33.680 34.419 1.0 36.8 ? 193 GLN A CD 1 164 . A ATOM 1184 O OE1 . GLN A 1 164 ? 58.796 34.733 33.810 1.0 40.51 ? 193 GLN A OE1 1 164 . A ATOM 1185 N NE2 . GLN A 1 164 ? 58.804 33.531 35.705 1.0 38.7 ? 193 GLN A NE2 1 164 . A ATOM 1186 N N . VAL A 1 165 ? 55.519 30.308 33.197 1.0 20.85 ? 194 VAL A N 1 165 . A ATOM 1187 C CA . VAL A 1 165 ? 54.408 30.001 34.121 1.0 19.23 ? 194 VAL A CA 1 165 . A ATOM 1188 C C . VAL A 1 165 ? 54.802 30.390 35.575 1.0 18.5 ? 194 VAL A C 1 165 . A ATOM 1189 O O . VAL A 1 165 ? 55.921 30.076 36.047 1.0 22.36 ? 194 VAL A O 1 165 . A ATOM 1190 C CB . VAL A 1 165 ? 54.069 28.504 34.050 1.0 19.93 ? 194 VAL A CB 1 165 . A ATOM 1191 C CG1 . VAL A 1 165 ? 53.040 28.089 35.104 1.0 21.44 ? 194 VAL A CG1 1 165 . A ATOM 1192 C CG2 . VAL A 1 165 ? 53.579 28.109 32.655 1.0 22.61 ? 194 VAL A CG2 1 165 . A ATOM 1193 N N . GLN A 1 166 ? 53.890 31.015 36.314 1.0 17.29 ? 195 GLN A N 1 166 . A ATOM 1194 C CA . GLN A 1 166 ? 54.082 31.377 37.727 1.0 17.67 ? 195 GLN A CA 1 166 . A ATOM 1195 C C . GLN A 1 166 ? 52.904 30.798 38.513 1.0 17.11 ? 195 GLN A C 1 166 . A ATOM 1196 O O . GLN A 1 166 ? 51.759 30.905 38.077 1.0 15.26 ? 195 GLN A O 1 166 . A ATOM 1197 C CB . GLN A 1 166 ? 54.142 32.883 37.937 1.0 19.55 ? 195 GLN A CB 1 166 . A ATOM 1198 C CG . GLN A 1 166 ? 55.199 33.571 37.059 1.0 23.65 ? 195 GLN A CG 1 166 . A ATOM 1199 C CD . GLN A 1 166 ? 55.263 35.088 37.193 1.0 26.37 ? 195 GLN A CD 1 166 . A ATOM 1200 O OE1 . GLN A 1 166 ? 54.460 35.722 37.866 1.0 34.74 ? 195 GLN A OE1 1 166 . A ATOM 1201 N NE2 . GLN A 1 166 ? 56.232 35.671 36.515 1.0 31.6 ? 195 GLN A NE2 1 166 . A HETATM 1202 N N . MSE A 1 167 ? 53.188 30.090 39.598 1.0 16.18 ? 196 MSE A N 1 167 . A HETATM 1203 C CA . MSE A 1 167 ? 52.161 29.469 40.421 1.0 17.2 ? 196 MSE A CA 1 167 . A HETATM 1204 C C . MSE A 1 167 ? 52.313 29.959 41.843 1.0 18.04 ? 196 MSE A C 1 167 . A HETATM 1205 O O . MSE A 1 167 ? 53.437 30.191 42.311 1.0 20.56 ? 196 MSE A O 1 167 . A HETATM 1206 C CB . MSE A 1 167 ? 52.303 27.956 40.337 1.0 19.24 ? 196 MSE A CB 1 167 . A HETATM 1207 C CG . MSE A 1 167 ? 51.881 27.407 38.998 1.0 22.99 ? 196 MSE A CG 1 167 . A HETATM 1208 SE SE . MSE A 1 167 ? 52.170 25.446 38.981 1.0 30.1 ? 196 MSE A SE 1 167 . A HETATM 1209 C CE . MSE A 1 167 ? 50.606 25.266 39.963 1.0 13.93 ? 196 MSE A CE 1 167 . A ATOM 1210 N N . GLU A 1 168 ? 51.192 30.138 42.533 1.0 14.94 ? 197 GLU A N 1 168 . A ATOM 1211 C CA . GLU A 1 168 ? 51.215 30.486 43.935 1.0 17.33 ? 197 GLU A CA 1 168 . A ATOM 1212 C C . GLU A 1 168 ? 50.182 29.596 44.586 1.0 17.45 ? 197 GLU A C 1 168 . A ATOM 1213 O O . GLU A 1 168 ? 49.019 29.526 44.116 1.0 18.1 ? 197 GLU A O 1 168 . A ATOM 1214 C CB . GLU A 1 168 ? 50.870 31.926 44.140 1.0 19.66 ? 197 GLU A CB 1 168 . A ATOM 1215 C CG . GLU A 1 168 ? 50.740 32.376 45.587 1.0 21.52 ? 197 GLU A CG 1 168 . A ATOM 1216 C CD . GLU A 1 168 ? 50.547 33.877 45.640 1.0 26.58 ? 197 GLU A CD 1 168 . A ATOM 1217 O OE1 . GLU A 1 168 ? 51.471 34.625 45.217 1.0 28.55 ? 197 GLU A OE1 1 168 . A ATOM 1218 O OE2 . GLU A 1 168 ? 49.453 34.302 46.072 1.0 31.0 ? 197 GLU A OE2 1 168 . A ATOM 1219 N N . ILE A 1 169 ? 50.596 28.878 45.620 1.0 15.33 ? 198 ILE A N 1 169 . A ATOM 1220 C CA . ILE A 1 169 ? 49.687 28.088 46.432 1.0 15.78 ? 198 ILE A CA 1 169 . A ATOM 1221 C C . ILE A 1 169 ? 49.560 28.838 47.723 1.0 17.11 ? 198 ILE A C 1 169 . A ATOM 1222 O O . ILE A 1 169 ? 50.609 29.258 48.297 1.0 17.01 ? 198 ILE A O 1 169 . A ATOM 1223 C CB . ILE A 1 169 ? 50.261 26.700 46.743 1.0 16.83 ? 198 ILE A CB 1 169 . A ATOM 1224 C CG1 . ILE A 1 169 ? 50.378 25.893 45.454 1.0 19.65 ? 198 ILE A CG1 1 169 . A ATOM 1225 C CG2 . ILE A 1 169 ? 49.396 25.957 47.767 1.0 18.29 ? 198 ILE A CG2 1 169 . A ATOM 1226 C CD1 . ILE A 1 169 ? 51.369 24.764 45.481 1.0 20.98 ? 198 ILE A CD1 1 169 . A ATOM 1227 N N . GLN A 1 170 ? 48.338 29.021 48.162 1.0 16.42 ? 199 GLN A N 1 170 . A ATOM 1228 C CA . GLN A 1 170 ? 48.114 29.589 49.487 1.0 16.23 ? 199 GLN A CA 1 170 . A ATOM 1229 C C . GLN A 1 170 ? 47.236 28.728 50.368 1.0 14.46 ? 199 GLN A C 1 170 . A ATOM 1230 O O . GLN A 1 170 ? 46.325 28.065 49.887 1.0 14.0 ? 199 GLN A O 1 170 . A ATOM 1231 C CB . GLN A 1 170 ? 47.556 30.960 49.394 1.0 19.03 ? 199 GLN A CB 1 170 . A ATOM 1232 C CG . GLN A 1 170 ? 46.203 31.067 48.758 1.0 20.07 ? 199 GLN A CG 1 170 . A ATOM 1233 C CD . GLN A 1 170 ? 45.741 32.528 48.653 1.0 23.21 ? 199 GLN A CD 1 170 . A ATOM 1234 O OE1 . GLN A 1 170 ? 45.738 33.147 47.560 1.0 26.07 ? 199 GLN A OE1 1 170 . A ATOM 1235 N NE2 . GLN A 1 170 ? 45.374 33.086 49.795 1.0 24.7 ? 199 GLN A NE2 1 170 . A ATOM 1236 N N . PHE A 1 171 ? 47.556 28.788 51.658 1.0 15.7 ? 200 PHE A N 1 171 . A ATOM 1237 C CA . PHE A 1 171 ? 46.751 28.197 52.709 1.0 15.58 ? 200 PHE A CA 1 171 . A ATOM 1238 C C . PHE A 1 171 ? 45.738 29.270 53.058 1.0 15.17 ? 200 PHE A C 1 171 . A ATOM 1239 O O . PHE A 1 171 ? 46.060 30.306 53.603 1.0 15.86 ? 200 PHE A O 1 171 . A ATOM 1240 C CB . PHE A 1 171 ? 47.702 27.778 53.875 1.0 15.58 ? 200 PHE A CB 1 171 . A ATOM 1241 C CG . PHE A 1 171 ? 47.076 26.927 54.992 1.0 15.94 ? 200 PHE A CG 1 171 . A ATOM 1242 C CD1 . PHE A 1 171 ? 45.753 26.824 55.223 1.0 13.97 ? 200 PHE A CD1 1 171 . A ATOM 1243 C CD2 . PHE A 1 171 ? 47.916 26.178 55.801 1.0 15.23 ? 200 PHE A CD2 1 171 . A ATOM 1244 C CE1 . PHE A 1 171 ? 45.267 26.023 56.236 1.0 14.55 ? 200 PHE A CE1 1 171 . A ATOM 1245 C CE2 . PHE A 1 171 ? 47.430 25.374 56.808 1.0 14.44 ? 200 PHE A CE2 1 171 . A ATOM 1246 C CZ . PHE A 1 171 ? 46.081 25.333 57.040 1.0 13.08 ? 200 PHE A CZ 1 171 . A ATOM 1247 N N . LYS A 1 172 ? 44.485 29.052 52.702 1.0 14.65 ? 201 LYS A N 1 172 . A ATOM 1248 C CA . LYS A 1 172 ? 43.445 30.104 52.850 1.0 16.38 ? 201 LYS A CA 1 172 . A ATOM 1249 C C . LYS A 1 172 ? 43.222 30.460 54.330 1.0 17.59 ? 201 LYS A C 1 172 . A ATOM 1250 O O . LYS A 1 172 ? 43.152 29.580 55.171 1.0 16.17 ? 201 LYS A O 1 172 . A ATOM 1251 C CB . LYS A 1 172 ? 42.156 29.688 52.128 1.0 21.67 ? 201 LYS A CB 1 172 . A ATOM 1252 C CG . LYS A 1 172 ? 41.286 28.701 52.833 1.0 23.98 ? 201 LYS A CG 1 172 . A ATOM 1253 C CD . LYS A 1 172 ? 40.115 28.240 51.984 1.0 26.08 ? 201 LYS A CD 1 172 . A ATOM 1254 C CE . LYS A 1 172 ? 39.243 27.255 52.783 1.0 28.49 ? 201 LYS A CE 1 172 . A ATOM 1255 N NZ . LYS A 1 172 ? 39.148 27.468 54.262 1.0 26.84 ? 201 LYS A NZ 1 172 . A ATOM 1256 N N . ASP A 1 173 ? 43.230 31.754 54.658 1.0 16.52 ? 202 ASP A N 1 173 . A ATOM 1257 C CA . ASP A 1 173 ? 43.147 32.184 56.053 1.0 19.13 ? 202 ASP A CA 1 173 . A ATOM 1258 C C . ASP A 1 173 ? 41.713 32.609 56.407 1.0 20.49 ? 202 ASP A C 1 173 . A ATOM 1259 O O . ASP A 1 173 ? 41.257 33.772 56.108 1.0 20.02 ? 202 ASP A O 1 173 . A ATOM 1260 C CB . ASP A 1 173 ? 44.232 33.209 56.366 1.0 21.51 ? 202 ASP A CB 1 173 . A ATOM 1261 C CG . ASP A 1 173 ? 44.395 33.444 57.855 1.0 22.05 ? 202 ASP A CG 1 173 . A ATOM 1262 O OD1 . ASP A 1 173 ? 43.624 32.865 58.636 1.0 23.65 ? 202 ASP A OD1 1 173 . A ATOM 1263 O OD2 . ASP A 1 173 ? 45.304 34.189 58.226 1.0 28.03 ? 202 ASP A OD2 1 173 . A ATOM 1264 N N . ASP A 1 174 ? 40.953 31.680 56.993 1.0 19.62 ? 203 ASP A N 1 174 . A ATOM 1265 C CA . ASP A 1 174 ? 39.544 31.926 57.350 1.0 23.15 ? 203 ASP A CA 1 174 . A ATOM 1266 C C . ASP A 1 174 ? 39.345 33.057 58.394 1.0 21.82 ? 203 ASP A C 1 174 . A ATOM 1267 O O . ASP A 1 174 ? 38.593 34.026 58.194 1.0 23.87 ? 203 ASP A O 1 174 . A ATOM 1268 C CB . ASP A 1 174 ? 38.844 30.654 57.851 1.0 26.35 ? 203 ASP A CB 1 174 . A ATOM 1269 C CG . ASP A 1 174 ? 38.608 29.630 56.765 1.0 27.98 ? 203 ASP A CG 1 174 . A ATOM 1270 O OD1 . ASP A 1 174 ? 39.048 29.806 55.608 1.0 35.02 ? 203 ASP A OD1 1 174 . A ATOM 1271 O OD2 . ASP A 1 174 ? 37.966 28.606 57.091 1.0 29.82 ? 203 ASP A OD2 1 174 . A ATOM 1272 N N . LYS A 1 175 ? 40.016 32.923 59.517 1.0 22.26 ? 204 LYS A N 1 175 . A ATOM 1273 C CA . LYS A 1 175 ? 39.829 33.794 60.693 1.0 25.41 ? 204 LYS A CA 1 175 . A ATOM 1274 C C . LYS A 1 175 ? 38.523 33.564 61.471 1.0 29.18 ? 204 LYS A C 1 175 . A ATOM 1275 O O . LYS A 1 175 ? 38.205 34.302 62.388 1.0 34.12 ? 204 LYS A O 1 175 . A ATOM 1276 C CB . LYS A 1 175 ? 40.054 35.287 60.313 1.0 24.96 ? 204 LYS A CB 1 175 . A ATOM 1277 C CG . LYS A 1 175 ? 41.484 35.562 59.866 1.0 25.16 ? 204 LYS A CG 1 175 . A ATOM 1278 C CD . LYS A 1 175 ? 42.448 35.667 61.011 1.0 30.04 ? 204 LYS A CD 1 175 . A ATOM 1279 C CE . LYS A 1 175 ? 43.829 36.074 60.502 1.0 30.82 ? 204 LYS A CE 1 175 . A ATOM 1280 N NZ . LYS A 1 175 ? 44.915 35.759 61.458 1.0 30.57 ? 204 LYS A NZ 1 175 . A ATOM 1281 N N . THR A 1 176 ? 37.783 32.527 61.121 1.0 26.19 ? 205 THR A N 1 176 . A ATOM 1282 C CA . THR A 1 176 ? 36.595 32.104 61.817 1.0 26.37 ? 205 THR A CA 1 176 . A ATOM 1283 C C . THR A 1 176 ? 36.891 31.532 63.204 1.0 26.52 ? 205 THR A C 1 176 . A ATOM 1284 O O . THR A 1 176 ? 37.777 30.679 63.340 1.0 26.16 ? 205 THR A O 1 176 . A ATOM 1285 C CB . THR A 1 176 ? 35.961 30.953 61.021 1.0 28.17 ? 205 THR A CB 1 176 . A ATOM 1286 O OG1 . THR A 1 176 ? 35.868 31.359 59.662 1.0 33.2 ? 205 THR A OG1 1 176 . A ATOM 1287 C CG2 . THR A 1 176 ? 34.619 30.541 61.583 1.0 29.72 ? 205 THR A CG2 1 176 . A ATOM 1288 N N . LYS A 1 177 ? 36.150 31.995 64.198 1.0 24.7 ? 206 LYS A N 1 177 . A ATOM 1289 C CA . LYS A 1 177 ? 36.167 31.371 65.512 1.0 28.62 ? 206 LYS A CA 1 177 . A ATOM 1290 C C . LYS A 1 177 ? 34.884 30.584 65.739 1.0 29.29 ? 206 LYS A C 1 177 . A ATOM 1291 O O . LYS A 1 177 ? 33.906 30.736 65.011 1.0 33.76 ? 206 LYS A O 1 177 . A ATOM 1292 C CB . LYS A 1 177 ? 36.386 32.424 66.593 1.0 27.79 ? 206 LYS A CB 1 177 . A ATOM 1293 C CG . LYS A 1 177 ? 37.816 32.928 66.677 1.0 31.41 ? 206 LYS A CG 1 177 . A ATOM 1294 C CD . LYS A 1 177 ? 37.938 34.089 67.651 1.0 32.05 ? 206 LYS A CD 1 177 . A ATOM 1295 C CE . LYS A 1 177 ? 39.399 34.503 67.831 1.0 34.73 ? 206 LYS A CE 1 177 . A ATOM 1296 N NZ . LYS A 1 177 ? 40.210 33.522 68.633 1.0 35.9 ? 206 LYS A NZ 1 177 . A ATOM 1297 N N . ASP A 1 178 ? 34.924 29.690 66.730 1.0 30.79 ? 207 ASP A N 1 178 . A ATOM 1298 C CA . ASP A 1 178 ? 33.772 28.858 67.105 1.0 30.61 ? 207 ASP A CA 1 178 . A ATOM 1299 C C . ASP A 1 178 ? 33.174 29.336 68.433 1.0 30.11 ? 207 ASP A C 1 178 . A ATOM 1300 O O . ASP A 1 178 ? 33.632 30.310 69.034 1.0 28.6 ? 207 ASP A O 1 178 . A ATOM 1301 C CB . ASP A 1 178 ? 34.153 27.350 67.122 1.0 28.96 ? 207 ASP A CB 1 178 . A ATOM 1302 C CG . ASP A 1 178 ? 35.124 26.981 68.239 1.0 30.25 ? 207 ASP A CG 1 178 . A ATOM 1303 O OD1 . ASP A 1 178 ? 35.249 27.728 69.261 1.0 28.42 ? 207 ASP A OD1 1 178 . A ATOM 1304 O OD2 . ASP A 1 178 ? 35.786 25.909 68.096 1.0 31.64 ? 207 ASP A OD2 1 178 . A ATOM 1305 N N . GLU A 1 179 ? 32.159 28.617 68.884 1.0 34.83 ? 208 GLU A N 1 179 . A ATOM 1306 C CA . GLU A 1 179 ? 31.410 28.976 70.083 1.0 36.83 ? 208 GLU A CA 1 179 . A ATOM 1307 C C . GLU A 1 179 ? 32.303 29.053 71.328 1.0 35.79 ? 208 GLU A C 1 179 . A ATOM 1308 O O . GLU A 1 179 ? 31.984 29.802 72.264 1.0 35.51 ? 208 GLU A O 1 179 . A ATOM 1309 C CB . GLU A 1 179 ? 30.249 28.010 70.302 1.0 39.93 ? 208 GLU A CB 1 179 . A ATOM 1310 C CG . GLU A 1 179 ? 29.152 28.093 69.237 1.0 43.78 ? 208 GLU A CG 1 179 . A ATOM 1311 C CD . GLU A 1 179 ? 29.462 27.345 67.947 1.0 45.82 ? 208 GLU A CD 1 179 . A ATOM 1312 O OE1 . GLU A 1 179 ? 28.909 27.743 66.897 1.0 44.56 ? 208 GLU A OE1 1 179 . A ATOM 1313 O OE2 . GLU A 1 179 ? 30.267 26.378 67.966 1.0 47.28 ? 208 GLU A OE2 1 179 . A ATOM 1314 N N . LYS A 1 180 ? 33.426 28.324 71.331 1.0 29.69 ? 209 LYS A N 1 180 . A ATOM 1315 C CA . LYS A 1 180 ? 34.402 28.376 72.446 1.0 29.88 ? 209 LYS A CA 1 180 . A ATOM 1316 C C . LYS A 1 180 ? 35.521 29.422 72.263 1.0 28.43 ? 209 LYS A C 1 180 . A ATOM 1317 O O . LYS A 1 180 ? 36.458 29.515 73.076 1.0 27.06 ? 209 LYS A O 1 180 . A ATOM 1318 C CB . LYS A 1 180 ? 34.982 26.984 72.706 1.0 29.77 ? 209 LYS A CB 1 180 . A ATOM 1319 N N . GLY A 1 181 ? 35.410 30.240 71.224 1.0 26.82 ? 210 GLY A N 1 181 . A ATOM 1320 C CA . GLY A 1 181 ? 36.365 31.319 70.975 1.0 27.06 ? 210 GLY A CA 1 181 . A ATOM 1321 C C . GLY A 1 181 ? 37.667 30.868 70.340 1.0 27.44 ? 210 GLY A C 1 181 . A ATOM 1322 O O . GLY A 1 181 ? 38.649 31.616 70.302 1.0 27.7 ? 210 GLY A O 1 181 . A ATOM 1323 N N . LEU A 1 182 ? 37.643 29.662 69.800 1.0 28.55 ? 211 LEU A N 1 182 . A ATOM 1324 C CA . LEU A 1 182 ? 38.818 29.051 69.217 1.0 28.61 ? 211 LEU A CA 1 182 . A ATOM 1325 C C . LEU A 1 182 ? 38.781 29.141 67.710 1.0 28.69 ? 211 LEU A C 1 182 . A ATOM 1326 O O . LEU A 1 182 ? 37.726 28.991 67.069 1.0 26.41 ? 211 LEU A O 1 182 . A ATOM 1327 C CB . LEU A 1 182 ? 38.884 27.596 69.625 1.0 27.76 ? 211 LEU A CB 1 182 . A ATOM 1328 C CG . LEU A 1 182 ? 38.703 27.295 71.102 1.0 29.29 ? 211 LEU A CG 1 182 . A ATOM 1329 C CD1 . LEU A 1 182 ? 38.783 25.790 71.262 1.0 30.11 ? 211 LEU A CD1 1 182 . A ATOM 1330 C CD2 . LEU A 1 182 ? 39.757 28.015 71.923 1.0 29.12 ? 211 LEU A CD2 1 182 . A HETATM 1331 N N . MSE A 1 183 ? 39.956 29.330 67.127 1.0 25.86 ? 212 MSE A N 1 183 . A HETATM 1332 C CA . MSE A 1 183 ? 40.059 29.380 65.666 1.0 24.41 ? 212 MSE A CA 1 183 . A HETATM 1333 C C . MSE A 1 183 ? 39.739 28.030 65.044 1.0 27.58 ? 212 MSE A C 1 183 . A HETATM 1334 O O . MSE A 1 183 ? 40.388 27.025 65.327 1.0 24.85 ? 212 MSE A O 1 183 . A HETATM 1335 C CB . MSE A 1 183 ? 41.478 29.764 65.268 1.0 25.09 ? 212 MSE A CB 1 183 . A HETATM 1336 C CG . MSE A 1 183 ? 41.759 31.237 65.427 1.0 23.16 ? 212 MSE A CG 1 183 . A HETATM 1337 SE SE . MSE A 1 183 ? 40.754 32.364 64.117 1.0 23.63 ? 212 MSE A SE 1 183 . A HETATM 1338 C CE . MSE A 1 183 ? 41.683 34.059 64.516 1.0 28.78 ? 212 MSE A CE 1 183 . A ATOM 1339 N N . VAL A 1 184 ? 38.720 27.964 64.210 1.0 23.72 ? 213 VAL A N 1 184 . A ATOM 1340 C CA . VAL A 1 184 ? 38.292 26.697 63.648 1.0 26.05 ? 213 VAL A CA 1 184 . A ATOM 1341 C C . VAL A 1 184 ? 39.315 25.918 62.775 1.0 24.69 ? 213 VAL A C 1 184 . A ATOM 1342 O O . VAL A 1 184 ? 39.357 24.673 62.808 1.0 27.79 ? 213 VAL A O 1 184 . A ATOM 1343 C CB . VAL A 1 184 ? 37.029 26.898 62.795 1.0 25.14 ? 213 VAL A CB 1 184 . A ATOM 1344 C CG1 . VAL A 1 184 ? 36.685 25.643 62.033 1.0 25.26 ? 213 VAL A CG1 1 184 . A ATOM 1345 C CG2 . VAL A 1 184 ? 35.836 27.312 63.664 1.0 29.6 ? 213 VAL A CG2 1 184 . A ATOM 1346 N N . GLN A 1 185 ? 40.069 26.620 61.921 1.0 20.1 ? 214 GLN A N 1 185 . A ATOM 1347 C CA . GLN A 1 185 ? 41.120 26.011 61.116 1.0 17.04 ? 214 GLN A CA 1 185 . A ATOM 1348 C C . GLN A 1 185 ? 42.269 25.398 61.952 1.0 14.81 ? 214 GLN A C 1 185 . A ATOM 1349 O O . GLN A 1 185 ? 43.152 24.734 61.399 1.0 16.96 ? 214 GLN A O 1 185 . A ATOM 1350 C CB . GLN A 1 185 ? 41.697 27.031 60.131 1.0 16.13 ? 214 GLN A CB 1 185 . A ATOM 1351 C CG . GLN A 1 185 ? 41.029 27.077 58.802 1.0 17.09 ? 214 GLN A CG 1 185 . A ATOM 1352 C CD . GLN A 1 185 ? 41.709 28.055 57.880 1.0 14.98 ? 214 GLN A CD 1 185 . A ATOM 1353 O OE1 . GLN A 1 185 ? 42.035 29.159 58.251 1.0 19.94 ? 214 GLN A OE1 1 185 . A ATOM 1354 N NE2 . GLN A 1 185 ? 41.930 27.630 56.644 1.0 16.33 ? 214 GLN A NE2 1 185 . A ATOM 1355 N N . ASN A 1 186 ? 42.256 25.612 63.265 1.0 13.55 ? 215 ASN A N 1 186 . A ATOM 1356 C CA . ASN A 1 186 ? 43.194 24.899 64.138 1.0 14.6 ? 215 ASN A CA 1 186 . A ATOM 1357 C C . ASN A 1 186 ? 43.012 23.361 64.093 1.0 15.59 ? 215 ASN A C 1 186 . A ATOM 1358 O O . ASN A 1 186 ? 43.968 22.646 64.386 1.0 14.87 ? 215 ASN A O 1 186 . A ATOM 1359 C CB . ASN A 1 186 ? 43.246 25.497 65.552 1.0 16.73 ? 215 ASN A CB 1 186 . A ATOM 1360 C CG . ASN A 1 186 ? 44.175 26.764 65.650 1.0 17.77 ? 215 ASN A CG 1 186 . A ATOM 1361 O OD1 . ASN A 1 186 ? 45.027 27.047 64.805 1.0 18.39 ? 215 ASN A OD1 1 186 . A ATOM 1362 N ND2 . ASN A 1 186 ? 44.057 27.467 66.745 1.0 18.84 ? 215 ASN A ND2 1 186 . A ATOM 1363 N N . LYS A 1 187 ? 41.883 22.843 63.587 1.0 13.9 ? 216 LYS A N 1 187 . A ATOM 1364 C CA . LYS A 1 187 ? 41.749 21.383 63.335 1.0 14.74 ? 216 LYS A CA 1 187 . A ATOM 1365 C C . LYS A 1 187 ? 42.862 20.866 62.426 1.0 13.49 ? 216 LYS A C 1 187 . A ATOM 1366 O O . LYS A 1 187 ? 43.165 19.693 62.447 1.0 13.45 ? 216 LYS A O 1 187 . A ATOM 1367 C CB . LYS A 1 187 ? 40.368 20.995 62.823 1.0 16.75 ? 216 LYS A CB 1 187 . A ATOM 1368 C CG . LYS A 1 187 ? 40.027 21.478 61.425 1.0 19.92 ? 216 LYS A CG 1 187 . A ATOM 1369 C CD . LYS A 1 187 ? 38.579 21.190 61.012 1.0 24.9 ? 216 LYS A CD 1 187 . A ATOM 1370 C CE . LYS A 1 187 ? 38.292 19.721 60.811 1.0 27.53 ? 216 LYS A CE 1 187 . A ATOM 1371 N NZ . LYS A 1 187 ? 36.821 19.417 60.702 1.0 29.29 ? 216 LYS A NZ 1 187 . A ATOM 1372 N N . TYR A 1 188 ? 43.473 21.755 61.633 1.0 12.63 ? 217 TYR A N 1 188 . A ATOM 1373 C CA . TYR A 1 188 ? 44.455 21.286 60.616 1.0 12.56 ? 217 TYR A CA 1 188 . A ATOM 1374 C C . TYR A 1 188 ? 45.858 21.429 61.135 1.0 14.13 ? 217 TYR A C 1 188 . A ATOM 1375 O O . TYR A 1 188 ? 46.779 21.224 60.387 1.0 13.85 ? 217 TYR A O 1 188 . A ATOM 1376 C CB . TYR A 1 188 ? 44.283 22.032 59.283 1.0 13.91 ? 217 TYR A CB 1 188 . A ATOM 1377 C CG . TYR A 1 188 ? 42.876 21.899 58.743 1.0 12.61 ? 217 TYR A CG 1 188 . A ATOM 1378 C CD1 . TYR A 1 188 ? 42.436 20.675 58.233 1.0 11.87 ? 217 TYR A CD1 1 188 . A ATOM 1379 C CD2 . TYR A 1 188 ? 41.967 22.994 58.737 1.0 12.24 ? 217 TYR A CD2 1 188 . A ATOM 1380 C CE1 . TYR A 1 188 ? 41.147 20.509 57.745 1.0 14.07 ? 217 TYR A CE1 1 188 . A ATOM 1381 C CE2 . TYR A 1 188 ? 40.658 22.802 58.253 1.0 12.6 ? 217 TYR A CE2 1 188 . A ATOM 1382 C CZ . TYR A 1 188 ? 40.269 21.565 57.765 1.0 13.74 ? 217 TYR A CZ 1 188 . A ATOM 1383 O OH . TYR A 1 188 ? 39.015 21.282 57.266 1.0 16.55 ? 217 TYR A OH 1 188 . A ATOM 1384 N N . GLN A 1 189 ? 46.014 21.866 62.382 1.0 15.19 ? 218 GLN A N 1 189 . A ATOM 1385 C CA . GLN A 1 189 ? 47.315 22.137 62.930 1.0 16.99 ? 218 GLN A CA 1 189 . A ATOM 1386 C C . GLN A 1 189 ? 48.163 20.877 62.894 1.0 16.87 ? 218 GLN A C 1 189 . A ATOM 1387 O O . GLN A 1 189 ? 47.793 19.852 63.430 1.0 17.09 ? 218 GLN A O 1 189 . A ATOM 1388 C CB . GLN A 1 189 ? 47.198 22.697 64.351 1.0 17.97 ? 218 GLN A CB 1 189 . A ATOM 1389 C CG . GLN A 1 189 ? 48.551 23.007 64.956 1.0 22.75 ? 218 GLN A CG 1 189 . A ATOM 1390 C CD . GLN A 1 189 ? 49.296 24.027 64.166 1.0 23.93 ? 218 GLN A CD 1 189 . A ATOM 1391 O OE1 . GLN A 1 189 ? 48.775 25.116 63.924 1.0 31.47 ? 218 GLN A OE1 1 189 . A ATOM 1392 N NE2 . GLN A 1 189 ? 50.509 23.698 63.746 1.0 26.31 ? 218 GLN A NE2 1 189 . A ATOM 1393 N N . GLY A 1 190 ? 49.309 20.964 62.252 1.0 17.97 ? 219 GLY A N 1 190 . A ATOM 1394 C CA . GLY A 1 190 ? 50.193 19.860 62.167 1.0 17.13 ? 219 GLY A CA 1 190 . A ATOM 1395 C C . GLY A 1 190 ? 50.006 19.017 60.950 1.0 15.86 ? 219 GLY A C 1 190 . A ATOM 1396 O O . GLY A 1 190 ? 50.946 18.338 60.564 1.0 16.67 ? 219 GLY A O 1 190 . A ATOM 1397 N N . ASN A 1 191 ? 48.840 19.069 60.308 1.0 12.76 ? 220 ASN A N 1 191 . A ATOM 1398 C CA . ASN A 1 191 ? 48.602 18.276 59.107 1.0 12.11 ? 220 ASN A CA 1 191 . A ATOM 1399 C C . ASN A 1 191 ? 49.638 18.520 58.002 1.0 11.66 ? 220 ASN A C 1 191 . A ATOM 1400 O O . ASN A 1 191 ? 50.158 19.626 57.833 1.0 12.76 ? 220 ASN A O 1 191 . A ATOM 1401 C CB . ASN A 1 191 ? 47.223 18.584 58.523 1.0 12.47 ? 220 ASN A CB 1 191 . A ATOM 1402 C CG . ASN A 1 191 ? 46.013 18.065 59.289 1.0 13.05 ? 220 ASN A CG 1 191 . A ATOM 1403 O OD1 . ASN A 1 191 ? 44.872 18.176 58.715 1.0 12.82 ? 220 ASN A OD1 1 191 . A ATOM 1404 N ND2 . ASN A 1 191 ? 46.180 17.400 60.494 1.0 14.95 ? 220 ASN A ND2 1 191 . A ATOM 1405 N N . SER A 1 192 ? 49.884 17.473 57.226 1.0 11.44 ? 221 SER A N 1 192 . A ATOM 1406 C CA . SER A 1 192 ? 50.706 17.592 56.056 1.0 13.83 ? 221 SER A CA 1 192 . A ATOM 1407 C C . SER A 1 192 ? 50.171 16.749 54.925 1.0 14.05 ? 221 SER A C 1 192 . A ATOM 1408 O O . SER A 1 192 ? 49.442 15.785 55.116 1.0 15.46 ? 221 SER A O 1 192 . A ATOM 1409 C CB . SER A 1 192 ? 52.173 17.318 56.392 1.0 16.75 ? 221 SER A CB 1 192 . A ATOM 1410 O OG . SER A 1 192 ? 52.400 15.949 56.681 1.0 16.46 ? 221 SER A OG 1 192 . A ATOM 1411 N N . ILE A 1 193 ? 50.634 17.059 53.719 1.0 15.86 ? 222 ILE A N 1 193 . A ATOM 1412 C CA . ILE A 1 193 ? 50.133 16.386 52.525 1.0 15.46 ? 222 ILE A CA 1 193 . A ATOM 1413 C C . ILE A 1 193 ? 51.094 16.723 51.409 1.0 14.83 ? 222 ILE A C 1 193 . A ATOM 1414 O O . ILE A 1 193 ? 51.754 17.744 51.481 1.0 13.97 ? 222 ILE A O 1 193 . A ATOM 1415 C CB . ILE A 1 193 ? 48.677 16.845 52.194 1.0 17.09 ? 222 ILE A CB 1 193 . A ATOM 1416 C CG1 . ILE A 1 193 ? 47.962 15.861 51.248 1.0 19.08 ? 222 ILE A CG1 1 193 . A ATOM 1417 C CG2 . ILE A 1 193 ? 48.589 18.264 51.626 1.0 17.13 ? 222 ILE A CG2 1 193 . A ATOM 1418 C CD1 . ILE A 1 193 ? 46.460 16.085 51.179 1.0 18.98 ? 222 ILE A CD1 1 193 . A ATOM 1419 N N . LYS A 1 194 ? 51.110 15.866 50.392 1.0 14.28 ? 223 LYS A N 1 194 . A ATOM 1420 C CA A LYS A 1 194 ? 52.024 15.998 49.274 0.53 16.05 ? 223 LYS A CA 1 194 . A ATOM 1421 C CA B LYS A 1 194 ? 52.021 16.009 49.264 0.47 15.84 ? 223 LYS A CA 1 194 . A ATOM 1422 C C . LYS A 1 194 ? 51.213 16.253 48.000 1.0 15.03 ? 223 LYS A C 1 194 . A ATOM 1423 O O . LYS A 1 194 ? 50.180 15.588 47.785 1.0 13.55 ? 223 LYS A O 1 194 . A ATOM 1424 C CB A LYS A 1 194 ? 52.873 14.727 49.133 0.53 17.11 ? 223 LYS A CB 1 194 . A ATOM 1425 C CB B LYS A 1 194 ? 52.873 14.756 49.052 0.47 16.57 ? 223 LYS A CB 1 194 . A ATOM 1426 C CG A LYS A 1 194 ? 53.698 14.449 50.387 0.53 17.94 ? 223 LYS A CG 1 194 . A ATOM 1427 C CG B LYS A 1 194 ? 54.016 14.980 48.064 0.47 17.38 ? 223 LYS A CG 1 194 . A ATOM 1428 C CD A LYS A 1 194 ? 54.559 13.201 50.287 0.53 19.89 ? 223 LYS A CD 1 194 . A ATOM 1429 C CD B LYS A 1 194 ? 54.790 13.693 47.815 0.47 17.96 ? 223 LYS A CD 1 194 . A ATOM 1430 C CE A LYS A 1 194 ? 55.124 12.792 51.654 0.53 21.08 ? 223 LYS A CE 1 194 . A ATOM 1431 C CE B LYS A 1 194 ? 56.028 13.855 46.932 0.47 19.99 ? 223 LYS A CE 1 194 . A ATOM 1432 N NZ A LYS A 1 194 ? 55.815 11.488 51.564 0.53 23.6 ? 223 LYS A NZ 1 194 . A ATOM 1433 N NZ B LYS A 1 194 ? 56.917 12.687 47.184 0.47 19.9 ? 223 LYS A NZ 1 194 . A ATOM 1434 N N . LEU A 1 195 ? 51.699 17.178 47.171 1.0 15.65 ? 224 LEU A N 1 195 . A ATOM 1435 C CA . LEU A 1 195 ? 51.058 17.433 45.863 1.0 16.65 ? 224 LEU A CA 1 195 . A ATOM 1436 C C . LEU A 1 195 ? 52.019 17.143 44.748 1.0 17.19 ? 224 LEU A C 1 195 . A ATOM 1437 O O . LEU A 1 195 ? 53.227 17.402 44.881 1.0 19.43 ? 224 LEU A O 1 195 . A ATOM 1438 C CB . LEU A 1 195 ? 50.698 18.882 45.676 1.0 17.06 ? 224 LEU A CB 1 195 . A ATOM 1439 C CG . LEU A 1 195 ? 49.924 19.637 46.743 1.0 16.06 ? 224 LEU A CG 1 195 . A ATOM 1440 C CD1 . LEU A 1 195 ? 49.758 21.118 46.408 1.0 17.86 ? 224 LEU A CD1 1 195 . A ATOM 1441 C CD2 . LEU A 1 195 ? 48.596 18.991 47.044 1.0 17.38 ? 224 LEU A CD2 1 195 . A ATOM 1442 N N . GLN A 1 196 ? 51.469 16.719 43.614 1.0 17.49 ? 225 GLN A N 1 196 . A ATOM 1443 C CA . GLN A 1 196 ? 52.239 16.571 42.354 1.0 17.3 ? 225 GLN A CA 1 196 . A ATOM 1444 C C . GLN A 1 196 ? 51.471 17.261 41.225 1.0 18.16 ? 225 GLN A C 1 196 . A ATOM 1445 O O . GLN A 1 196 ? 50.284 16.976 41.012 1.0 20.07 ? 225 GLN A O 1 196 . A ATOM 1446 C CB . GLN A 1 196 ? 52.415 15.106 42.004 1.0 17.59 ? 225 GLN A CB 1 196 . A ATOM 1447 C CG . GLN A 1 196 ? 53.259 14.887 40.790 1.0 20.94 ? 225 GLN A CG 1 196 . A ATOM 1448 C CD . GLN A 1 196 ? 53.042 13.527 40.215 1.0 24.1 ? 225 GLN A CD 1 196 . A ATOM 1449 O OE1 . GLN A 1 196 ? 51.903 13.120 39.977 1.0 30.64 ? 225 GLN A OE1 1 196 . A ATOM 1450 N NE2 . GLN A 1 196 ? 54.131 12.782 40.047 1.0 25.64 ? 225 GLN A NE2 1 196 . A ATOM 1451 N N . PHE A 1 197 ? 52.112 18.229 40.572 1.0 17.73 ? 226 PHE A N 1 197 . A ATOM 1452 C CA . PHE A 1 197 ? 51.554 18.881 39.371 1.0 17.92 ? 226 PHE A CA 1 197 . A ATOM 1453 C C . PHE A 1 197 ? 52.225 18.284 38.141 1.0 18.37 ? 226 PHE A C 1 197 . A ATOM 1454 O O . PHE A 1 197 ? 53.459 18.426 38.025 1.0 20.96 ? 226 PHE A O 1 197 . A ATOM 1455 C CB . PHE A 1 197 ? 51.804 20.367 39.351 1.0 18.79 ? 226 PHE A CB 1 197 . A ATOM 1456 C CG . PHE A 1 197 ? 51.080 21.107 40.419 1.0 20.26 ? 226 PHE A CG 1 197 . A ATOM 1457 C CD1 . PHE A 1 197 ? 49.769 21.535 40.223 1.0 16.61 ? 226 PHE A CD1 1 197 . A ATOM 1458 C CD2 . PHE A 1 197 ? 51.698 21.326 41.649 1.0 20.99 ? 226 PHE A CD2 1 197 . A ATOM 1459 C CE1 . PHE A 1 197 ? 49.075 22.180 41.242 1.0 18.66 ? 226 PHE A CE1 1 197 . A ATOM 1460 C CE2 . PHE A 1 197 ? 51.026 21.997 42.665 1.0 21.66 ? 226 PHE A CE2 1 197 . A ATOM 1461 C CZ . PHE A 1 197 ? 49.712 22.415 42.451 1.0 19.61 ? 226 PHE A CZ 1 197 . A ATOM 1462 N N . SER A 1 198 ? 51.433 17.665 37.259 1.0 15.33 ? 227 SER A N 1 198 . A ATOM 1463 C CA . SER A 1 198 ? 51.923 17.020 36.059 1.0 16.09 ? 227 SER A CA 1 198 . A ATOM 1464 C C . SER A 1 198 ? 51.681 17.918 34.844 1.0 17.38 ? 227 SER A C 1 198 . A ATOM 1465 O O . SER A 1 198 ? 50.698 18.631 34.851 1.0 16.02 ? 227 SER A O 1 198 . A ATOM 1466 C CB . SER A 1 198 ? 51.244 15.708 35.877 1.0 18.13 ? 227 SER A CB 1 198 . A ATOM 1467 O OG . SER A 1 198 ? 49.812 15.767 35.790 1.0 22.04 ? 227 SER A OG 1 198 . A ATOM 1468 N N . PHE A 1 199 ? 52.554 17.859 33.853 1.0 17.89 ? 228 PHE A N 1 199 . A ATOM 1469 C CA . PHE A 1 199 ? 52.443 18.690 32.661 1.0 18.11 ? 228 PHE A CA 1 199 . A ATOM 1470 C C . PHE A 1 199 ? 52.605 17.791 31.468 1.0 17.0 ? 228 PHE A C 1 199 . A ATOM 1471 O O . PHE A 1 199 ? 53.627 17.132 31.337 1.0 20.55 ? 228 PHE A O 1 199 . A ATOM 1472 C CB . PHE A 1 199 ? 53.480 19.785 32.648 1.0 17.34 ? 228 PHE A CB 1 199 . A ATOM 1473 C CG . PHE A 1 199 ? 53.379 20.712 33.819 1.0 19.0 ? 228 PHE A CG 1 199 . A ATOM 1474 C CD1 . PHE A 1 199 ? 54.062 20.412 34.991 1.0 19.41 ? 228 PHE A CD1 1 199 . A ATOM 1475 C CD2 . PHE A 1 199 ? 52.619 21.857 33.766 1.0 18.71 ? 228 PHE A CD2 1 199 . A ATOM 1476 C CE1 . PHE A 1 199 ? 53.975 21.266 36.078 1.0 21.2 ? 228 PHE A CE1 1 199 . A ATOM 1477 C CE2 . PHE A 1 199 ? 52.508 22.716 34.845 1.0 19.46 ? 228 PHE A CE2 1 199 . A ATOM 1478 C CZ . PHE A 1 199 ? 53.197 22.401 36.026 1.0 20.58 ? 228 PHE A CZ 1 199 . A ATOM 1479 N N . GLU A 1 200 ? 51.563 17.692 30.647 1.0 16.47 ? 229 GLU A N 1 200 . A ATOM 1480 C CA . GLU A 1 200 ? 51.504 16.764 29.487 1.0 19.48 ? 229 GLU A CA 1 200 . A ATOM 1481 C C . GLU A 1 200 ? 51.465 17.576 28.190 1.0 19.75 ? 229 GLU A C 1 200 . A ATOM 1482 O O . GLU A 1 200 ? 50.466 18.259 27.916 1.0 19.06 ? 229 GLU A O 1 200 . A ATOM 1483 C CB . GLU A 1 200 ? 50.199 15.932 29.576 1.0 23.01 ? 229 GLU A CB 1 200 . A ATOM 1484 C CG . GLU A 1 200 ? 49.938 14.970 28.408 1.0 28.21 ? 229 GLU A CG 1 200 . A ATOM 1485 C CD . GLU A 1 200 ? 48.455 14.647 28.112 1.0 32.12 ? 229 GLU A CD 1 200 . A ATOM 1486 O OE1 . GLU A 1 200 ? 47.538 14.889 28.958 1.0 34.65 ? 229 GLU A OE1 1 200 . A ATOM 1487 O OE2 . GLU A 1 200 ? 48.222 14.117 26.988 1.0 29.03 ? 229 GLU A OE2 1 200 . A ATOM 1488 N N . ALA A 1 201 ? 52.534 17.532 27.379 1.0 18.8 ? 230 ALA A N 1 201 . A ATOM 1489 C CA . ALA A 1 201 ? 52.462 18.245 26.095 1.0 17.5 ? 230 ALA A CA 1 201 . A ATOM 1490 C C . ALA A 1 201 ? 51.648 17.438 25.155 1.0 16.73 ? 230 ALA A C 1 201 . A ATOM 1491 O O . ALA A 1 201 ? 51.690 16.212 25.176 1.0 19.5 ? 230 ALA A O 1 201 . A ATOM 1492 C CB . ALA A 1 201 ? 53.822 18.511 25.538 1.0 18.23 ? 230 ALA A CB 1 201 . A ATOM 1493 N N . THR A 1 202 ? 50.858 18.124 24.330 1.0 15.61 ? 231 THR A N 1 202 . A ATOM 1494 C CA . THR A 1 202 ? 50.034 17.480 23.329 1.0 16.36 ? 231 THR A CA 1 202 . A ATOM 1495 C C . THR A 1 202 ? 50.399 17.900 21.900 1.0 16.41 ? 231 THR A C 1 202 . A ATOM 1496 O O . THR A 1 202 ? 50.866 19.024 21.649 1.0 18.42 ? 231 THR A O 1 202 . A ATOM 1497 C CB . THR A 1 202 ? 48.558 17.776 23.552 1.0 17.82 ? 231 THR A CB 1 202 . A ATOM 1498 O OG1 . THR A 1 202 ? 48.306 19.169 23.223 1.0 18.38 ? 231 THR A OG1 1 202 . A ATOM 1499 C CG2 . THR A 1 202 ? 48.168 17.433 24.992 1.0 18.25 ? 231 THR A CG2 1 202 . A ATOM 1500 N N . GLN A 1 203 ? 50.121 16.978 20.976 1.0 15.19 ? 232 GLN A N 1 203 . A ATOM 1501 C CA . GLN A 1 203 ? 50.206 17.278 19.556 1.0 17.01 ? 232 GLN A CA 1 203 . A ATOM 1502 C C . GLN A 1 203 ? 49.013 18.102 19.126 1.0 16.91 ? 232 GLN A C 1 203 . A ATOM 1503 O O . GLN A 1 203 ? 48.029 18.307 19.890 1.0 16.11 ? 232 GLN A O 1 203 . A ATOM 1504 C CB . GLN A 1 203 ? 50.309 15.975 18.772 1.0 18.33 ? 232 GLN A CB 1 203 . A ATOM 1505 C CG . GLN A 1 203 ? 51.560 15.138 19.110 1.0 20.72 ? 232 GLN A CG 1 203 . A ATOM 1506 C CD . GLN A 1 203 ? 51.665 13.865 18.270 1.0 24.15 ? 232 GLN A CD 1 203 . A ATOM 1507 O OE1 . GLN A 1 203 ? 51.263 12.768 18.678 1.0 33.05 ? 232 GLN A OE1 1 203 . A ATOM 1508 N NE2 . GLN A 1 203 ? 52.142 14.029 17.063 1.0 24.41 ? 232 GLN A NE2 1 203 . A ATOM 1509 N N . TRP A 1 204 ? 49.108 18.589 17.896 1.0 15.82 ? 233 TRP A N 1 204 . A ATOM 1510 C CA . TRP A 1 204 ? 48.029 19.357 17.303 1.0 15.47 ? 233 TRP A CA 1 204 . A ATOM 1511 C C . TRP A 1 204 ? 46.746 18.522 17.146 1.0 16.45 ? 233 TRP A C 1 204 . A ATOM 1512 O O . TRP A 1 204 ? 45.671 19.100 17.047 1.0 18.04 ? 233 TRP A O 1 204 . A ATOM 1513 C CB . TRP A 1 204 ? 48.494 20.073 16.004 1.0 16.53 ? 233 TRP A CB 1 204 . A ATOM 1514 C CG . TRP A 1 204 ? 49.254 21.318 16.308 1.0 16.94 ? 233 TRP A CG 1 204 . A ATOM 1515 C CD1 . TRP A 1 204 ? 50.600 21.414 16.564 1.0 17.16 ? 233 TRP A CD1 1 204 . A ATOM 1516 C CD2 . TRP A 1 204 ? 48.719 22.638 16.506 1.0 15.87 ? 233 TRP A CD2 1 204 . A ATOM 1517 N NE1 . TRP A 1 204 ? 50.924 22.712 16.866 1.0 17.35 ? 233 TRP A NE1 1 204 . A ATOM 1518 C CE2 . TRP A 1 204 ? 49.791 23.474 16.862 1.0 16.93 ? 233 TRP A CE2 1 204 . A ATOM 1519 C CE3 . TRP A 1 204 ? 47.422 23.178 16.462 1.0 15.0 ? 233 TRP A CE3 1 204 . A ATOM 1520 C CZ2 . TRP A 1 204 ? 49.617 24.842 17.128 1.0 18.07 ? 233 TRP A CZ2 1 204 . A ATOM 1521 C CZ3 . TRP A 1 204 ? 47.238 24.575 16.743 1.0 17.79 ? 233 TRP A CZ3 1 204 . A ATOM 1522 C CH2 . TRP A 1 204 ? 48.329 25.366 17.051 1.0 17.61 ? 233 TRP A CH2 1 204 . A ATOM 1523 N N . ASN A 1 205 ? 46.831 17.176 17.128 1.0 17.85 ? 234 ASN A N 1 205 . A ATOM 1524 C CA . ASN A 1 205 ? 45.647 16.338 17.096 1.0 16.42 ? 234 ASN A CA 1 205 . A ATOM 1525 C C . ASN A 1 205 ? 45.090 16.137 18.513 1.0 20.54 ? 234 ASN A C 1 205 . A ATOM 1526 O O . ASN A 1 205 ? 44.109 15.449 18.683 1.0 23.99 ? 234 ASN A O 1 205 . A ATOM 1527 C CB . ASN A 1 205 ? 45.894 15.013 16.334 1.0 16.68 ? 234 ASN A CB 1 205 . A ATOM 1528 C CG . ASN A 1 205 ? 46.953 14.157 16.981 1.0 17.38 ? 234 ASN A CG 1 205 . A ATOM 1529 O OD1 . ASN A 1 205 ? 47.353 14.383 18.101 1.0 19.62 ? 234 ASN A OD1 1 205 . A ATOM 1530 N ND2 . ASN A 1 205 ? 47.446 13.202 16.233 1.0 20.73 ? 234 ASN A ND2 1 205 . A ATOM 1531 N N . GLY A 1 206 ? 45.734 16.732 19.528 1.0 18.63 ? 235 GLY A N 1 206 . A ATOM 1532 C CA . GLY A 1 206 ? 45.322 16.574 20.931 1.0 19.42 ? 235 GLY A CA 1 206 . A ATOM 1533 C C . GLY A 1 206 ? 45.911 15.392 21.694 1.0 20.88 ? 235 GLY A C 1 206 . A ATOM 1534 O O . GLY A 1 206 ? 45.784 15.317 22.937 1.0 24.34 ? 235 GLY A O 1 206 . A ATOM 1535 N N . LEU A 1 207 ? 46.583 14.484 21.000 1.0 20.68 ? 236 LEU A N 1 207 . A ATOM 1536 C CA . LEU A 1 207 ? 47.220 13.340 21.652 1.0 23.29 ? 236 LEU A CA 1 207 . A ATOM 1537 C C . LEU A 1 207 ? 48.481 13.749 22.407 1.0 23.52 ? 236 LEU A C 1 207 . A ATOM 1538 O O . LEU A 1 207 ? 49.178 14.656 22.008 1.0 20.36 ? 236 LEU A O 1 207 . A ATOM 1539 C CB . LEU A 1 207 ? 47.618 12.277 20.636 1.0 25.01 ? 236 LEU A CB 1 207 . A ATOM 1540 C CG . LEU A 1 207 ? 46.448 11.598 19.926 1.0 29.79 ? 236 LEU A CG 1 207 . A ATOM 1541 C CD1 . LEU A 1 207 ? 47.009 10.518 19.018 1.0 32.67 ? 236 LEU A CD1 1 207 . A ATOM 1542 C CD2 . LEU A 1 207 ? 45.416 11.015 20.890 1.0 32.3 ? 236 LEU A CD2 1 207 . A ATOM 1543 N N . THR A 1 208 ? 48.802 13.019 23.475 1.0 26.75 ? 237 THR A N 1 208 . A ATOM 1544 C CA . THR A 1 208 ? 50.094 13.210 24.142 1.0 29.46 ? 237 THR A CA 1 208 . A ATOM 1545 C C . THR A 1 208 ? 51.216 12.946 23.198 1.0 30.99 ? 237 THR A C 1 208 . A ATOM 1546 O O . THR A 1 208 ? 51.125 12.020 22.378 1.0 34.2 ? 237 THR A O 1 208 . A ATOM 1547 C CB . THR A 1 208 ? 50.256 12.277 25.357 1.0 32.42 ? 237 THR A CB 1 208 . A ATOM 1548 O OG1 . THR A 1 208 ? 49.038 12.320 26.102 1.0 33.42 ? 237 THR A OG1 1 208 . A ATOM 1549 C CG2 . THR A 1 208 ? 51.421 12.742 26.230 1.0 33.15 ? 237 THR A CG2 1 208 . A ATOM 1550 N N . ILE A 1 209 ? 52.260 13.768 23.259 1.0 35.97 ? 238 ILE A N 1 209 . A ATOM 1551 C CA . ILE A 1 209 ? 53.397 13.580 22.352 1.0 40.75 ? 238 ILE A CA 1 209 . A ATOM 1552 C C . ILE A 1 209 ? 54.040 12.200 22.593 1.0 47.08 ? 238 ILE A C 1 209 . A ATOM 1553 O O . ILE A 1 209 ? 54.181 11.763 23.749 1.0 50.68 ? 238 ILE A O 1 209 . A ATOM 1554 C CB . ILE A 1 209 ? 54.454 14.714 22.416 1.0 41.97 ? 238 ILE A CB 1 209 . A ATOM 1555 C CG1 . ILE A 1 209 ? 55.028 14.892 23.827 1.0 43.14 ? 238 ILE A CG1 1 209 . A ATOM 1556 C CG2 . ILE A 1 209 ? 53.868 16.022 21.899 1.0 41.25 ? 238 ILE A CG2 1 209 . A ATOM 1557 C CD1 . ILE A 1 209 ? 56.403 15.506 23.820 1.0 41.7 ? 238 ILE A CD1 1 209 . A ATOM 1558 N N . LYS A 1 210 ? 54.390 11.517 21.503 1.0 48.46 ? 239 LYS A N 1 210 . A ATOM 1559 C CA . LYS A 1 210 ? 54.849 10.122 21.555 1.0 49.3 ? 239 LYS A CA 1 210 . A ATOM 1560 C C . LYS A 1 210 ? 56.309 10.008 22.006 1.0 50.24 ? 239 LYS A C 1 210 . A ATOM 1561 O O . LYS A 1 210 ? 56.936 10.998 22.398 1.0 52.27 ? 239 LYS A O 1 210 . A ATOM 1562 C CB . LYS A 1 210 ? 54.675 9.459 20.185 1.0 49.25 ? 239 LYS A CB 1 210 . A HETATM 1563 C "C1'" . SAL C 2 . ? 57.188 24.661 45.212 1.0 38.22 ? 301 SAL C "C1'" 1 301 . A HETATM 1564 O "O1'" . SAL C 2 . ? 58.108 23.908 44.820 1.0 39.72 ? 301 SAL C "O1'" 1 301 . A HETATM 1565 O "O2'" . SAL C 2 . ? 57.259 25.280 46.299 1.0 43.24 ? 301 SAL C "O2'" 1 301 . A HETATM 1566 C C1 . SAL C 2 . ? 55.975 24.839 44.348 1.0 32.78 ? 301 SAL C C1 1 301 . A HETATM 1567 C C2 . SAL C 2 . ? 55.683 23.869 43.264 1.0 32.82 ? 301 SAL C C2 1 301 . A HETATM 1568 C C3 . SAL C 2 . ? 54.540 24.083 42.493 1.0 30.73 ? 301 SAL C C3 1 301 . A HETATM 1569 C C4 . SAL C 2 . ? 53.720 25.204 42.718 1.0 27.75 ? 301 SAL C C4 1 301 . A HETATM 1570 C C5 . SAL C 2 . ? 54.014 26.128 43.718 1.0 31.25 ? 301 SAL C C5 1 301 . A HETATM 1571 C C6 . SAL C 2 . ? 55.131 25.933 44.537 1.0 31.08 ? 301 SAL C C6 1 301 . A HETATM 1572 O O2 . SAL C 2 . ? 56.483 22.768 43.033 1.0 35.87 ? 301 SAL C O2 1 301 . A HETATM 1573 C C1 . EDO D 3 . ? 49.690 10.315 60.858 1.0 23.07 ? 302 EDO D C1 1 302 . A HETATM 1574 O O1 . EDO D 3 . ? 50.040 11.378 61.705 1.0 23.86 ? 302 EDO D O1 1 302 . A HETATM 1575 C C2 . EDO D 3 . ? 48.259 9.965 61.034 1.0 25.7 ? 302 EDO D C2 1 302 . A HETATM 1576 O O2 . EDO D 3 . ? 47.527 10.282 59.848 1.0 28.34 ? 302 EDO D O2 1 302 . A HETATM 1577 C C1 . EDO E 3 . ? 53.792 28.963 17.868 1.0 46.26 ? 303 EDO E C1 1 303 . A HETATM 1578 O O1 . EDO E 3 . ? 52.613 28.175 18.086 1.0 45.77 ? 303 EDO E O1 1 303 . A HETATM 1579 C C2 . EDO E 3 . ? 53.401 30.325 17.311 1.0 47.59 ? 303 EDO E C2 1 303 . A HETATM 1580 O O2 . EDO E 3 . ? 54.523 31.203 17.444 1.0 49.94 ? 303 EDO E O2 1 303 . A HETATM 1581 C C1 . EDO F 3 . ? 63.338 16.990 21.197 1.0 55.27 ? 304 EDO F C1 1 304 . A HETATM 1582 O O1 . EDO F 3 . ? 62.178 16.151 21.311 1.0 55.72 ? 304 EDO F O1 1 304 . A HETATM 1583 C C2 . EDO F 3 . ? 64.479 16.444 22.054 1.0 56.08 ? 304 EDO F C2 1 304 . A HETATM 1584 O O2 . EDO F 3 . ? 65.033 17.471 22.883 1.0 55.07 ? 304 EDO F O2 1 304 . A HETATM 1585 O O . HOH H 4 . ? 59.159 15.038 36.236 1.0 35.21 ? 401 HOH H O 1 401 . A HETATM 1586 O O . HOH H 4 . ? 47.538 37.234 48.682 1.0 26.85 ? 402 HOH H O 1 402 . A HETATM 1587 O O . HOH H 4 . ? 35.526 26.119 44.752 1.0 28.24 ? 403 HOH H O 1 403 . A HETATM 1588 O O . HOH H 4 . ? 52.783 38.323 27.975 1.0 38.18 ? 404 HOH H O 1 404 . A HETATM 1589 O O . HOH H 4 . ? 38.788 7.299 41.667 1.0 25.59 ? 405 HOH H O 1 405 . A HETATM 1590 O O . HOH H 4 . ? 39.787 13.768 46.866 1.0 20.35 ? 406 HOH H O 1 406 . A HETATM 1591 O O . HOH H 4 . ? 43.077 25.519 25.609 1.0 23.37 ? 407 HOH H O 1 407 . A HETATM 1592 O O . HOH H 4 . ? 53.994 26.258 61.049 1.0 40.82 ? 408 HOH H O 1 408 . A HETATM 1593 O O . HOH H 4 . ? 28.410 31.020 41.465 1.0 31.27 ? 409 HOH H O 1 409 . A HETATM 1594 O O . HOH H 4 . ? 37.063 34.229 56.299 1.0 26.57 ? 410 HOH H O 1 410 . A HETATM 1595 O O . HOH H 4 . ? 43.103 22.809 25.870 1.0 26.77 ? 411 HOH H O 1 411 . A HETATM 1596 O O . HOH H 4 . ? 27.057 22.324 32.766 1.0 37.69 ? 412 HOH H O 1 412 . A HETATM 1597 O O . HOH H 4 . ? 48.012 22.977 59.136 1.0 21.85 ? 413 HOH H O 1 413 . A HETATM 1598 O O . HOH H 4 . ? 42.350 34.530 31.669 1.0 31.49 ? 414 HOH H O 1 414 . A HETATM 1599 O O . HOH H 4 . ? 64.038 25.374 40.500 1.0 41.32 ? 415 HOH H O 1 415 . A HETATM 1600 O O . HOH H 4 . ? 53.412 15.967 16.091 1.0 33.48 ? 416 HOH H O 1 416 . A HETATM 1601 O O . HOH H 4 . ? 52.540 20.186 58.970 1.0 37.25 ? 417 HOH H O 1 417 . A HETATM 1602 O O . HOH H 4 . ? 38.278 12.948 53.223 1.0 22.29 ? 418 HOH H O 1 418 . A HETATM 1603 O O . HOH H 4 . ? 50.228 11.250 39.792 1.0 39.7 ? 419 HOH H O 1 419 . A HETATM 1604 O O . HOH H 4 . ? 36.106 13.866 51.897 1.0 29.67 ? 420 HOH H O 1 420 . A HETATM 1605 O O . HOH H 4 . ? 32.340 29.415 63.518 1.0 39.47 ? 421 HOH H O 1 421 . A HETATM 1606 O O . HOH H 4 . ? 39.427 33.878 71.194 1.0 54.82 ? 422 HOH H O 1 422 . A HETATM 1607 O O . HOH H 4 . ? 50.702 32.821 57.788 1.0 29.77 ? 423 HOH H O 1 423 . A HETATM 1608 O O . HOH H 4 . ? 42.562 33.098 49.964 1.0 24.68 ? 424 HOH H O 1 424 . A HETATM 1609 O O . HOH H 4 . ? 41.563 14.483 33.434 1.0 23.7 ? 425 HOH H O 1 425 . A HETATM 1610 O O . HOH H 4 . ? 45.222 35.130 16.181 1.0 33.66 ? 426 HOH H O 1 426 . A HETATM 1611 O O . HOH H 4 . ? 46.978 35.073 60.066 1.0 34.93 ? 427 HOH H O 1 427 . A HETATM 1612 O O . HOH H 4 . ? 45.345 26.099 61.216 1.0 29.98 ? 428 HOH H O 1 428 . A HETATM 1613 O O . HOH H 4 . ? 42.049 28.805 23.391 1.0 42.11 ? 429 HOH H O 1 429 . A HETATM 1614 O O . HOH H 4 . ? 46.001 32.901 52.309 1.0 23.54 ? 430 HOH H O 1 430 . A HETATM 1615 O O . HOH H 4 . ? 56.060 33.566 24.562 1.0 34.89 ? 431 HOH H O 1 431 . A HETATM 1616 O O . HOH H 4 . ? 34.316 29.104 32.488 1.0 22.89 ? 432 HOH H O 1 432 . A HETATM 1617 O O . HOH H 4 . ? 48.085 32.408 60.587 1.0 27.51 ? 433 HOH H O 1 433 . A HETATM 1618 O O . HOH H 4 . ? 40.679 9.636 44.719 1.0 23.41 ? 434 HOH H O 1 434 . A HETATM 1619 O O . HOH H 4 . ? 52.819 25.765 10.398 1.0 36.52 ? 435 HOH H O 1 435 . A HETATM 1620 O O . HOH H 4 . ? 37.687 17.338 59.033 1.0 34.12 ? 436 HOH H O 1 436 . A HETATM 1621 O O . HOH H 4 . ? 55.582 18.113 29.441 1.0 37.25 ? 437 HOH H O 1 437 . A HETATM 1622 O O . HOH H 4 . ? 48.347 26.457 23.875 1.0 15.04 ? 438 HOH H O 1 438 . A HETATM 1623 O O . HOH H 4 . ? 42.964 18.699 21.032 1.0 38.06 ? 439 HOH H O 1 439 . A HETATM 1624 O O . HOH H 4 . ? 52.717 14.227 54.564 1.0 22.52 ? 440 HOH H O 1 440 . A HETATM 1625 O O . HOH H 4 . ? 38.619 28.577 38.832 1.0 26.17 ? 441 HOH H O 1 441 . A HETATM 1626 O O . HOH H 4 . ? 50.686 22.829 60.914 1.0 34.61 ? 442 HOH H O 1 442 . A HETATM 1627 O O . HOH H 4 . ? 30.643 20.565 34.403 1.0 31.66 ? 443 HOH H O 1 443 . A HETATM 1628 O O . HOH H 4 . ? 41.334 35.219 29.340 1.0 24.43 ? 444 HOH H O 1 444 . A HETATM 1629 O O . HOH H 4 . ? 48.785 9.023 57.406 1.0 32.94 ? 445 HOH H O 1 445 . A HETATM 1630 O O . HOH H 4 . ? 57.924 21.505 15.176 1.0 32.5 ? 446 HOH H O 1 446 . A HETATM 1631 O O . HOH H 4 . ? 33.382 12.429 34.421 1.0 30.71 ? 447 HOH H O 1 447 . A HETATM 1632 O O . HOH H 4 . ? 52.899 29.174 28.849 1.0 18.65 ? 448 HOH H O 1 448 . A HETATM 1633 O O . HOH H 4 . ? 43.463 30.699 8.776 1.0 25.22 ? 449 HOH H O 1 449 . A HETATM 1634 O O . HOH H 4 . ? 44.773 13.488 35.354 1.0 20.54 ? 450 HOH H O 1 450 . A HETATM 1635 O O . HOH H 4 . ? 44.359 15.512 29.098 1.0 37.63 ? 451 HOH H O 1 451 . A HETATM 1636 O O . HOH H 4 . ? 38.810 35.923 64.471 1.0 32.15 ? 452 HOH H O 1 452 . A HETATM 1637 O O . HOH H 4 . ? 38.384 23.435 65.028 1.0 26.75 ? 453 HOH H O 1 453 . A HETATM 1638 O O . HOH H 4 . ? 70.493 15.585 39.090 1.0 32.33 ? 454 HOH H O 1 454 . A HETATM 1639 O O . HOH H 4 . ? 41.259 13.083 65.338 1.0 23.94 ? 455 HOH H O 1 455 . A HETATM 1640 O O . HOH H 4 . ? 43.777 20.091 65.826 1.0 18.11 ? 456 HOH H O 1 456 . A HETATM 1641 O O . HOH H 4 . ? 64.072 21.110 25.586 1.0 37.2 ? 457 HOH H O 1 457 . A HETATM 1642 O O . HOH H 4 . ? 42.610 22.626 19.198 1.0 27.23 ? 458 HOH H O 1 458 . A HETATM 1643 O O . HOH H 4 . ? 38.589 35.997 26.847 1.0 18.16 ? 459 HOH H O 1 459 . A HETATM 1644 O O . HOH H 4 . ? 44.489 37.829 32.957 1.0 24.73 ? 460 HOH H O 1 460 . A HETATM 1645 O O . HOH H 4 . ? 30.295 27.673 36.757 1.0 27.52 ? 461 HOH H O 1 461 . A HETATM 1646 O O . HOH H 4 . ? 44.629 13.025 65.178 1.0 25.11 ? 462 HOH H O 1 462 . A HETATM 1647 O O . HOH H 4 . ? 35.624 18.906 31.880 1.0 35.55 ? 463 HOH H O 1 463 . A HETATM 1648 O O . HOH H 4 . ? 48.295 11.969 64.336 1.0 25.54 ? 464 HOH H O 1 464 . A HETATM 1649 O O . HOH H 4 . ? 43.441 26.501 22.916 1.0 21.95 ? 465 HOH H O 1 465 . A HETATM 1650 O O . HOH H 4 . ? 57.702 13.860 50.441 1.0 38.0 ? 466 HOH H O 1 466 . A HETATM 1651 O O . HOH H 4 . ? 51.601 18.207 16.450 1.0 20.0 ? 467 HOH H O 1 467 . A HETATM 1652 O O . HOH H 4 . ? 32.811 15.753 33.171 1.0 30.31 ? 468 HOH H O 1 468 . A HETATM 1653 O O . HOH H 4 . ? 37.485 25.185 51.762 1.0 31.42 ? 469 HOH H O 1 469 . A HETATM 1654 O O . HOH H 4 . ? 56.510 40.043 37.920 1.0 41.17 ? 470 HOH H O 1 470 . A HETATM 1655 O O . HOH H 4 . ? 40.081 25.049 67.295 1.0 36.96 ? 471 HOH H O 1 471 . A HETATM 1656 O O . HOH H 4 . ? 64.357 28.427 32.737 1.0 37.56 ? 472 HOH H O 1 472 . A HETATM 1657 O O . HOH H 4 . ? 49.369 11.179 16.525 1.0 26.74 ? 473 HOH H O 1 473 . A HETATM 1658 O O . HOH H 4 . ? 50.460 22.417 57.805 1.0 41.93 ? 474 HOH H O 1 474 . A HETATM 1659 O O . HOH H 4 . ? 39.203 29.587 40.558 1.0 25.28 ? 475 HOH H O 1 475 . A HETATM 1660 O O . HOH H 4 . ? 44.175 17.308 24.100 1.0 24.94 ? 476 HOH H O 1 476 . A HETATM 1661 O O . HOH H 4 . ? 46.820 9.363 54.220 1.0 27.48 ? 477 HOH H O 1 477 . A HETATM 1662 O O . HOH H 4 . ? 48.999 16.448 33.185 1.0 18.57 ? 478 HOH H O 1 478 . A HETATM 1663 O O . HOH H 4 . ? 45.683 14.776 25.699 1.0 39.54 ? 479 HOH H O 1 479 . A HETATM 1664 O O . HOH H 4 . ? 34.412 11.738 37.530 1.0 36.7 ? 480 HOH H O 1 480 . A HETATM 1665 O O . HOH H 4 . ? 55.822 22.809 53.430 1.0 40.19 ? 481 HOH H O 1 481 . A HETATM 1666 O O . HOH H 4 . ? 47.994 35.464 52.879 1.0 27.69 ? 482 HOH H O 1 482 . A HETATM 1667 O O . HOH H 4 . ? 44.311 10.343 58.391 1.0 21.03 ? 483 HOH H O 1 483 . A HETATM 1668 O O . HOH H 4 . ? 59.577 17.416 41.597 1.0 25.85 ? 484 HOH H O 1 484 . A HETATM 1669 O O . HOH H 4 . ? 38.412 33.170 42.035 1.0 19.49 ? 485 HOH H O 1 485 . A HETATM 1670 O O . HOH H 4 . ? 46.321 13.958 38.283 1.0 22.45 ? 486 HOH H O 1 486 . A HETATM 1671 O O . HOH H 4 . ? 39.319 29.279 61.236 1.0 20.46 ? 487 HOH H O 1 487 . A HETATM 1672 O O . HOH H 4 . ? 48.109 8.717 49.962 1.0 20.56 ? 488 HOH H O 1 488 . A HETATM 1673 O O . HOH H 4 . ? 42.041 20.666 22.635 1.0 35.49 ? 489 HOH H O 1 489 . A HETATM 1674 O O . HOH H 4 . ? 43.745 35.333 26.528 1.0 40.66 ? 490 HOH H O 1 490 . A HETATM 1675 O O . HOH H 4 . ? 44.181 10.409 41.186 1.0 28.04 ? 491 HOH H O 1 491 . A HETATM 1676 O O . HOH H 4 . ? 36.835 23.129 57.347 1.0 25.64 ? 492 HOH H O 1 492 . A HETATM 1677 O O . HOH H 4 . ? 39.785 20.077 24.611 1.0 36.88 ? 493 HOH H O 1 493 . A HETATM 1678 O O . HOH H 4 . ? 43.640 10.361 36.731 1.0 35.23 ? 494 HOH H O 1 494 . A HETATM 1679 O O . HOH H 4 . ? 34.318 22.894 46.889 1.0 36.52 ? 495 HOH H O 1 495 . A HETATM 1680 O O . HOH H 4 . ? 29.270 22.185 41.542 1.0 35.48 ? 496 HOH H O 1 496 . A HETATM 1681 O O . HOH H 4 . ? 46.406 35.707 50.366 1.0 29.31 ? 497 HOH H O 1 497 . A HETATM 1682 O O . HOH H 4 . ? 51.611 21.394 65.066 1.0 25.85 ? 498 HOH H O 1 498 . A HETATM 1683 O O . HOH H 4 . ? 64.832 22.777 36.580 1.0 35.03 ? 499 HOH H O 1 499 . A HETATM 1684 O O . HOH H 4 . ? 38.648 27.795 48.197 1.0 25.01 ? 500 HOH H O 1 500 . A HETATM 1685 O O . HOH H 4 . ? 46.680 31.386 45.239 1.0 19.53 ? 501 HOH H O 1 501 . A HETATM 1686 O O . HOH H 4 . ? 49.798 15.168 38.825 1.0 27.69 ? 502 HOH H O 1 502 . A HETATM 1687 O O . HOH H 4 . ? 53.945 32.961 53.070 1.0 34.05 ? 503 HOH H O 1 503 . A HETATM 1688 O O . HOH H 4 . ? 60.652 30.145 41.141 1.0 27.28 ? 504 HOH H O 1 504 . A HETATM 1689 O O . HOH H 4 . ? 41.142 32.335 33.052 1.0 15.51 ? 505 HOH H O 1 505 . A HETATM 1690 O O . HOH H 4 . ? 34.562 34.410 64.048 1.0 28.85 ? 506 HOH H O 1 506 . A HETATM 1691 O O . HOH H 4 . ? 48.730 34.251 13.779 1.0 36.06 ? 507 HOH H O 1 507 . A HETATM 1692 O O . HOH H 4 . ? 38.489 25.631 57.597 1.0 29.48 ? 508 HOH H O 1 508 . A HETATM 1693 O O . HOH H 4 . ? 37.645 26.891 43.298 1.0 23.92 ? 509 HOH H O 1 509 . A HETATM 1694 O O . HOH H 4 . ? 36.370 24.700 27.263 1.0 29.73 ? 510 HOH H O 1 510 . A HETATM 1695 O O . HOH H 4 . ? 43.883 28.251 62.406 1.0 24.77 ? 511 HOH H O 1 511 . A HETATM 1696 O O . HOH H 4 . ? 44.934 37.945 30.159 1.0 32.86 ? 512 HOH H O 1 512 . A HETATM 1697 O O . HOH H 4 . ? 50.851 35.617 29.137 1.0 27.28 ? 513 HOH H O 1 513 . A HETATM 1698 O O . HOH H 4 . ? 49.815 19.040 65.428 1.0 22.19 ? 514 HOH H O 1 514 . A HETATM 1699 O O . HOH H 4 . ? 54.376 15.258 27.835 1.0 34.62 ? 515 HOH H O 1 515 . A HETATM 1700 O O . HOH H 4 . ? 39.068 11.894 63.658 1.0 35.3 ? 516 HOH H O 1 516 . A HETATM 1701 O O . HOH H 4 . ? 64.945 20.544 31.984 1.0 34.72 ? 517 HOH H O 1 517 . A HETATM 1702 O O . HOH H 4 . ? 48.063 25.305 61.039 1.0 20.53 ? 518 HOH H O 1 518 . A HETATM 1703 O O . HOH H 4 . ? 53.986 17.193 53.377 1.0 36.01 ? 519 HOH H O 1 519 . A HETATM 1704 O O . HOH H 4 . ? 47.303 35.953 63.234 1.0 43.3 ? 520 HOH H O 1 520 . A HETATM 1705 O O . HOH H 4 . ? 50.814 32.394 12.961 1.0 55.23 ? 521 HOH H O 1 521 . A HETATM 1706 O O . HOH H 4 . ? 67.737 24.743 31.229 1.0 38.55 ? 522 HOH H O 1 522 . A HETATM 1707 O O . HOH H 4 . ? 41.771 16.254 17.008 1.0 44.63 ? 523 HOH H O 1 523 . A HETATM 1708 O O . HOH H 4 . ? 55.209 15.842 57.700 1.0 34.13 ? 524 HOH H O 1 524 . A HETATM 1709 O O . HOH H 4 . ? 38.719 17.471 63.595 1.0 31.96 ? 525 HOH H O 1 525 . A HETATM 1710 O O . HOH H 4 . ? 59.290 32.573 27.629 1.0 33.33 ? 526 HOH H O 1 526 . A HETATM 1711 O O . HOH H 4 . ? 57.745 22.695 51.234 1.0 37.84 ? 527 HOH H O 1 527 . A HETATM 1712 O O . HOH H 4 . ? 60.144 27.023 21.394 1.0 49.31 ? 528 HOH H O 1 528 . A HETATM 1713 O O . HOH H 4 . ? 53.760 23.654 17.405 1.0 34.65 ? 529 HOH H O 1 529 . A HETATM 1714 O O . HOH H 4 . ? 29.868 29.508 44.945 1.0 34.4 ? 530 HOH H O 1 530 . A HETATM 1715 O O . HOH H 4 . ? 34.041 19.711 44.008 1.0 42.21 ? 531 HOH H O 1 531 . A HETATM 1716 O O . HOH H 4 . ? 58.011 30.232 47.980 1.0 35.92 ? 532 HOH H O 1 532 . A HETATM 1717 O O . HOH H 4 . ? 30.568 32.447 36.169 1.0 23.57 ? 533 HOH H O 1 533 . A HETATM 1718 O O . HOH H 4 . ? 46.953 10.617 23.933 1.0 27.01 ? 534 HOH H O 1 534 . A HETATM 1719 O O . HOH H 4 . ? 33.475 27.892 42.849 1.0 30.19 ? 535 HOH H O 1 535 . A HETATM 1720 O O . HOH H 4 . ? 40.832 11.845 34.003 1.0 49.32 ? 536 HOH H O 1 536 . A HETATM 1721 O O . HOH H 4 . ? 58.255 21.222 48.937 1.0 35.92 ? 537 HOH H O 1 537 . A HETATM 1722 O O . HOH H 4 . ? 43.935 21.390 15.858 1.0 31.18 ? 538 HOH H O 1 538 . A HETATM 1723 O O . HOH H 4 . ? 58.152 26.154 25.054 1.0 45.25 ? 539 HOH H O 1 539 . A HETATM 1724 O O . HOH H 4 . ? 59.979 30.809 44.087 1.0 35.22 ? 540 HOH H O 1 540 . A HETATM 1725 O O . HOH H 4 . ? 66.122 18.918 38.355 1.0 28.91 ? 541 HOH H O 1 541 . A HETATM 1726 O O . HOH H 4 . ? 37.014 28.725 41.365 1.0 29.1 ? 542 HOH H O 1 542 . A HETATM 1727 O O . HOH H 4 . ? 35.409 35.698 61.955 1.0 30.06 ? 543 HOH H O 1 543 . A HETATM 1728 O O . HOH H 4 . ? 60.467 18.775 44.698 1.0 32.65 ? 544 HOH H O 1 544 . A HETATM 1729 O O . HOH H 4 . ? 41.800 19.222 17.830 1.0 46.41 ? 545 HOH H O 1 545 . A HETATM 1730 O O . HOH H 4 . ? 37.155 21.009 31.942 1.0 31.29 ? 546 HOH H O 1 546 . A HETATM 1731 O O . HOH H 4 . ? 56.785 38.476 28.235 1.0 45.11 ? 547 HOH H O 1 547 . A HETATM 1732 O O . HOH H 4 . ? 45.846 11.463 39.197 1.0 30.68 ? 548 HOH H O 1 548 . A HETATM 1733 O O . HOH H 4 . ? 34.041 33.537 69.512 1.0 36.79 ? 549 HOH H O 1 549 . A HETATM 1734 O O . HOH H 4 . ? 29.130 29.488 40.089 1.0 26.05 ? 550 HOH H O 1 550 . A HETATM 1735 O O . HOH H 4 . ? 42.122 9.289 39.081 1.0 31.23 ? 551 HOH H O 1 551 . A HETATM 1736 O O . HOH H 4 . ? 43.107 23.497 21.826 1.0 31.95 ? 552 HOH H O 1 552 . A HETATM 1737 O O . HOH H 4 . ? 36.400 22.776 49.034 1.0 25.66 ? 553 HOH H O 1 553 . A HETATM 1738 O O . HOH H 4 . ? 58.366 17.993 59.700 1.0 45.35 ? 554 HOH H O 1 554 . A HETATM 1739 O O . HOH H 4 . ? 30.013 28.751 34.167 1.0 33.95 ? 555 HOH H O 1 555 . A HETATM 1740 O O . HOH H 4 . ? 62.214 11.293 25.237 1.0 38.63 ? 556 HOH H O 1 556 . A HETATM 1741 O O . HOH H 4 . ? 32.717 18.674 32.651 1.0 30.67 ? 557 HOH H O 1 557 . A HETATM 1742 O O . HOH H 4 . ? 48.430 7.396 42.798 1.0 48.16 ? 558 HOH H O 1 558 . A HETATM 1743 O O . HOH H 4 . ? 30.443 27.430 41.985 1.0 37.07 ? 559 HOH H O 1 559 . A HETATM 1744 O O . HOH H 4 . ? 46.269 35.837 54.820 1.0 37.61 ? 560 HOH H O 1 560 . A HETATM 1745 O O . HOH H 4 . ? 27.969 28.697 44.112 1.0 34.0 ? 561 HOH H O 1 561 . A HETATM 1746 O O . HOH H 4 . ? 32.360 30.727 31.464 1.0 29.59 ? 562 HOH H O 1 562 . A HETATM 1747 O O . HOH H 4 . ? 53.685 11.559 14.285 1.0 43.56 ? 563 HOH H O 1 563 . A HETATM 1748 O O . HOH H 4 . ? 44.895 8.871 56.395 1.0 22.92 ? 564 HOH H O 1 564 . A HETATM 1749 O O . HOH H 4 . ? 35.377 26.927 48.286 1.0 41.06 ? 565 HOH H O 1 565 . A HETATM 1750 O O . HOH H 4 . ? 47.742 10.789 12.581 1.0 33.58 ? 566 HOH H O 1 566 . A HETATM 1751 O O . HOH H 4 . ? 43.330 23.860 16.902 1.0 27.93 ? 567 HOH H O 1 567 . A HETATM 1752 O O . HOH H 4 . ? 43.907 11.642 33.145 1.0 51.14 ? 568 HOH H O 1 568 . A # _entry.id 5OF1 # _cell.entry_id 5OF1 _cell.length_a 83.999 _cell.length_b 52.3 _cell.length_c 83.076 _cell.angle_alpha 90.00 _cell.angle_beta 90.00 _cell.angle_gamma 90.00 _cell.Z_PDB 1 _cell.pdbx_unique_axis ? # _pdbe_orig_cell.angle_alpha 89.92 _pdbe_orig_cell.angle_alpha_esd ? _pdbe_orig_cell.angle_beta 91.86 _pdbe_orig_cell.angle_beta_esd ? _pdbe_orig_cell.angle_gamma 90.01 _pdbe_orig_cell.angle_gamma_esd ? _pdbe_orig_cell.entry_id 5OF1 _pdbe_orig_cell.details ? _pdbe_orig_cell.formula_units_Z ? _pdbe_orig_cell.length_a 40.728 _pdbe_orig_cell.length_a_esd ? _pdbe_orig_cell.length_b 43.149 _pdbe_orig_cell.length_b_esd ? _pdbe_orig_cell.length_c 51.744 _pdbe_orig_cell.length_c_esd ? _pdbe_orig_cell.volume ? _pdbe_orig_cell.volume_esd ? _pdbe_orig_cell.Z_PDB 2 _pdbe_orig_cell.reciprocal_angle_alpha ? _pdbe_orig_cell.reciprocal_angle_beta ? _pdbe_orig_cell.reciprocal_angle_gamma ? _pdbe_orig_cell.reciprocal_angle_alpha_esd ? _pdbe_orig_cell.reciprocal_angle_beta_esd ? _pdbe_orig_cell.reciprocal_angle_gamma_esd ? _pdbe_orig_cell.reciprocal_length_a ? _pdbe_orig_cell.reciprocal_length_b ? _pdbe_orig_cell.reciprocal_length_c ? _pdbe_orig_cell.reciprocal_length_a_esd ? _pdbe_orig_cell.reciprocal_length_b_esd ? _pdbe_orig_cell.reciprocal_length_c_esd ? _pdbe_orig_cell.pdbx_unique_axis ? # _symmetry.entry_id 5OF1 _symmetry.space_group_name_H-M "P 1" _symmetry.pdbx_full_space_group_name_H-M ? _symmetry.cell_setting ? _symmetry.Int_Tables_number ? # _pdbe_orig_symmetry.entry_id 5OF1 _pdbe_orig_symmetry.cell_setting ? _pdbe_orig_symmetry.Int_Tables_number 1 _pdbe_orig_symmetry.space_group_name_Hall ? _pdbe_orig_symmetry.space_group_name_H-M "P 1" _pdbe_orig_symmetry.pdbx_full_space_group_name_H-M ? # _entity_name_com.entity_id 1 _entity_name_com.name "Major biofilm matrix protein TasA" # _entity_src_gen.entity_id 1 _entity_src_gen.pdbx_src_id 1 _entity_src_gen.pdbx_alt_source_flag sample _entity_src_gen.pdbx_seq_type "Biological sequence" _entity_src_gen.pdbx_beg_seq_num 1 _entity_src_gen.pdbx_end_seq_num 210 _entity_src_gen.gene_src_common_name ? _entity_src_gen.gene_src_genus ? _entity_src_gen.pdbx_gene_src_gene "tasA, cotN, yqhF, BSU24620" _entity_src_gen.gene_src_species ? _entity_src_gen.gene_src_strain 168 _entity_src_gen.gene_src_tissue ? _entity_src_gen.gene_src_tissue_fraction ? _entity_src_gen.gene_src_details ? _entity_src_gen.pdbx_gene_src_fragment ? _entity_src_gen.pdbx_gene_src_scientific_name "Bacillus subtilis (strain 168)" _entity_src_gen.pdbx_gene_src_ncbi_taxonomy_id 224308 _entity_src_gen.pdbx_gene_src_variant ? _entity_src_gen.pdbx_gene_src_cell_line ? _entity_src_gen.pdbx_gene_src_atcc ? _entity_src_gen.pdbx_gene_src_organ ? _entity_src_gen.pdbx_gene_src_organelle ? _entity_src_gen.pdbx_gene_src_cell ? _entity_src_gen.pdbx_gene_src_cellular_location ? _entity_src_gen.host_org_common_name ? _entity_src_gen.pdbx_host_org_scientific_name "Escherichia coli" _entity_src_gen.pdbx_host_org_ncbi_taxonomy_id 562 _entity_src_gen.host_org_genus ? _entity_src_gen.pdbx_host_org_gene ? _entity_src_gen.pdbx_host_org_organ ? _entity_src_gen.host_org_species ? _entity_src_gen.pdbx_host_org_tissue ? _entity_src_gen.pdbx_host_org_tissue_fraction ? _entity_src_gen.pdbx_host_org_strain "T7 Express" _entity_src_gen.pdbx_host_org_variant ? _entity_src_gen.pdbx_host_org_cell_line ? _entity_src_gen.pdbx_host_org_atcc ? _entity_src_gen.pdbx_host_org_culture_collection ? _entity_src_gen.pdbx_host_org_cell ? _entity_src_gen.pdbx_host_org_organelle ? _entity_src_gen.pdbx_host_org_cellular_location ? _entity_src_gen.pdbx_host_org_vector_type ? _entity_src_gen.pdbx_host_org_vector ? _entity_src_gen.host_org_details ? _entity_src_gen.expression_system_id ? _entity_src_gen.plasmid_name pCA528 _entity_src_gen.plasmid_details ? _entity_src_gen.pdbx_description ? # _exptl.absorpt_coefficient_mu ? _exptl.absorpt_correction_T_max ? _exptl.absorpt_correction_T_min ? _exptl.absorpt_correction_type ? _exptl.absorpt_process_details ? _exptl.entry_id 5OF1 _exptl.crystals_number 1 _exptl.details ? _exptl.method "X-ray diffraction" _exptl.method_details ? # _reflns.B_iso_Wilson_estimate 24.363 _reflns.entry_id 5OF1 _reflns.data_reduction_details ? _reflns.data_reduction_method ? _reflns.d_resolution_high 1.56 _reflns.d_resolution_low 40.71 _reflns.details ? _reflns.limit_h_max ? _reflns.limit_h_min ? _reflns.limit_k_max ? _reflns.limit_k_min ? _reflns.limit_l_max ? _reflns.limit_l_min ? _reflns.number_all ? _reflns.number_obs 47368 _reflns.observed_criterion ? _reflns.observed_criterion_F_max ? _reflns.observed_criterion_F_min ? _reflns.observed_criterion_I_max ? _reflns.observed_criterion_I_min ? _reflns.observed_criterion_sigma_F ? _reflns.observed_criterion_sigma_I ? _reflns.percent_possible_obs 96.33 _reflns.R_free_details ? _reflns.Rmerge_F_all ? _reflns.Rmerge_F_obs ? _reflns.Friedel_coverage ? _reflns.number_gt ? _reflns.threshold_expression ? _reflns.pdbx_redundancy 4.1 _reflns.pdbx_Rmerge_I_obs 0.0777 _reflns.pdbx_Rmerge_I_all ? _reflns.pdbx_Rsym_value ? _reflns.pdbx_netI_over_av_sigmaI ? _reflns.pdbx_netI_over_sigmaI 13.33 _reflns.pdbx_res_netI_over_av_sigmaI_2 ? _reflns.pdbx_res_netI_over_sigmaI_2 ? _reflns.pdbx_chi_squared ? _reflns.pdbx_scaling_rejects ? _reflns.pdbx_d_res_high_opt ? _reflns.pdbx_d_res_low_opt ? _reflns.pdbx_d_res_opt_method ? _reflns.phase_calculation_details ? _reflns.pdbx_Rrim_I_all ? _reflns.pdbx_Rpim_I_all ? _reflns.pdbx_d_opt ? _reflns.pdbx_number_measured_all ? _reflns.pdbx_diffrn_id 1 _reflns.pdbx_ordinal 1 _reflns.pdbx_CC_half 0.996 _reflns.pdbx_R_split ? # _refine.aniso_B[1][1] 17.74 _refine.aniso_B[1][2] 3.42 _refine.aniso_B[1][3] -1.01 _refine.aniso_B[2][2] -0.77 _refine.aniso_B[2][3] 1.91 _refine.aniso_B[3][3] -16.97 _refine.B_iso_max ? _refine.B_iso_mean 24.363 _refine.B_iso_min ? _refine.correlation_coeff_Fo_to_Fc 0.973 _refine.correlation_coeff_Fo_to_Fc_free 0.969 _refine.details "HYDROGENS HAVE BEEN ADDED IN THE RIDING POSITIONS" _refine.diff_density_max ? _refine.diff_density_max_esd ? _refine.diff_density_min ? _refine.diff_density_min_esd ? _refine.diff_density_rms ? _refine.diff_density_rms_esd ? _refine.entry_id 5OF1 _refine.pdbx_refine_id "X-ray diffraction" _refine.ls_abs_structure_details ? _refine.ls_abs_structure_Flack ? _refine.ls_abs_structure_Flack_esd ? _refine.ls_abs_structure_Rogers ? _refine.ls_abs_structure_Rogers_esd ? _refine.ls_d_res_high 1.56 _refine.ls_d_res_low 40.71 _refine.ls_extinction_coef ? _refine.ls_extinction_coef_esd ? _refine.ls_extinction_expression ? _refine.ls_extinction_method ? _refine.ls_goodness_of_fit_all ? _refine.ls_goodness_of_fit_all_esd ? _refine.ls_goodness_of_fit_obs ? _refine.ls_goodness_of_fit_obs_esd ? _refine.ls_hydrogen_treatment ? _refine.ls_matrix_type ? _refine.ls_number_constraints ? _refine.ls_number_parameters ? _refine.ls_number_reflns_all ? _refine.ls_number_reflns_obs 47368 _refine.ls_number_reflns_R_free 1080 _refine.ls_number_reflns_R_work ? _refine.ls_number_restraints ? _refine.ls_percent_reflns_obs 96.02 _refine.ls_percent_reflns_R_free 2.2 _refine.ls_R_factor_all ? _refine.ls_R_factor_obs 0.15273 _refine.ls_R_factor_R_free 0.17523 _refine.ls_R_factor_R_free_error ? _refine.ls_R_factor_R_free_error_details ? _refine.ls_R_factor_R_work 0.15222 _refine.ls_R_Fsqd_factor_obs ? _refine.ls_R_I_factor_obs ? _refine.ls_redundancy_reflns_all ? _refine.ls_redundancy_reflns_obs ? _refine.ls_restrained_S_all ? _refine.ls_restrained_S_obs ? _refine.ls_shift_over_esd_max ? _refine.ls_shift_over_esd_mean ? _refine.ls_structure_factor_coef ? _refine.ls_weighting_details ? _refine.ls_weighting_scheme ? _refine.ls_wR_factor_all ? _refine.ls_wR_factor_obs ? _refine.ls_wR_factor_R_free ? _refine.ls_wR_factor_R_work ? _refine.occupancy_max ? _refine.occupancy_min ? _refine.solvent_model_details ? _refine.solvent_model_param_bsol ? _refine.solvent_model_param_ksol ? _refine.ls_R_factor_gt ? _refine.ls_goodness_of_fit_gt ? _refine.ls_goodness_of_fit_ref ? _refine.ls_shift_over_su_max ? _refine.ls_shift_over_su_max_lt ? _refine.ls_shift_over_su_mean ? _refine.ls_shift_over_su_mean_lt ? _refine.pdbx_ls_sigma_I ? _refine.pdbx_ls_sigma_F ? _refine.pdbx_ls_sigma_Fsqd ? _refine.pdbx_data_cutoff_high_absF ? _refine.pdbx_data_cutoff_high_rms_absF ? _refine.pdbx_data_cutoff_low_absF ? _refine.pdbx_isotropic_thermal_model ? _refine.pdbx_ls_cross_valid_method THROUGHOUT _refine.pdbx_method_to_determine_struct SAD _refine.pdbx_starting_model ? _refine.pdbx_stereochemistry_target_values ? _refine.pdbx_R_Free_selection_details RANDOM _refine.pdbx_stereochem_target_val_spec_case ? _refine.pdbx_overall_ESU_R 0.016 _refine.pdbx_overall_ESU_R_Free 0.016 _refine.pdbx_solvent_vdw_probe_radii 1.20 _refine.pdbx_solvent_ion_probe_radii 0.80 _refine.pdbx_solvent_shrinkage_radii 0.80 _refine.pdbx_real_space_R ? _refine.pdbx_density_correlation ? _refine.pdbx_pd_number_of_powder_patterns ? _refine.pdbx_pd_number_of_points ? _refine.pdbx_pd_meas_number_of_points ? _refine.pdbx_pd_proc_ls_prof_R_factor ? _refine.pdbx_pd_proc_ls_prof_wR_factor ? _refine.pdbx_pd_Marquardt_correlation_coeff ? _refine.pdbx_pd_Fsqrd_R_factor ? _refine.pdbx_pd_ls_matrix_band_width ? _refine.pdbx_overall_phase_error ? _refine.pdbx_overall_SU_R_free_Cruickshank_DPI ? _refine.pdbx_overall_SU_R_free_Blow_DPI ? _refine.pdbx_overall_SU_R_Blow_DPI ? _refine.pdbx_TLS_residual_ADP_flag ? _refine.pdbx_diffrn_id 1 _refine.overall_SU_B 0.964 _refine.overall_SU_ML 0.037 _refine.overall_SU_R_Cruickshank_DPI ? _refine.overall_SU_R_free ? _refine.overall_FOM_free_R_set ? _refine.overall_FOM_work_R_set ? _refine.pdbx_average_fsc_overall ? _refine.pdbx_average_fsc_work ? _refine.pdbx_average_fsc_free ? # _refine_hist.pdbx_refine_id "X-ray diffraction" _refine_hist.cycle_id 1 _refine_hist.pdbx_number_atoms_protein 3007 _refine_hist.pdbx_number_atoms_nucleic_acid 0 _refine_hist.pdbx_number_atoms_ligand 32 _refine_hist.number_atoms_solvent 331 _refine_hist.number_atoms_total 3370 _refine_hist.d_res_high 1.56 _refine_hist.d_res_low 40.71 # loop_ _pdbx_struct_assembly.id _pdbx_struct_assembly.details _pdbx_struct_assembly.method_details _pdbx_struct_assembly.oligomeric_details _pdbx_struct_assembly.oligomeric_count 1 author_defined_assembly ? monomeric 1 2 author_defined_assembly ? monomeric 1 # loop_ _pdbx_struct_assembly_gen.assembly_id _pdbx_struct_assembly_gen.oper_expression _pdbx_struct_assembly_gen.asym_id_list 1 1 A,C,D,E,F,H 2 1 B,G,I # _pdbx_struct_oper_list.id 1 _pdbx_struct_oper_list.type "identity operation" _pdbx_struct_oper_list.name 1_555 _pdbx_struct_oper_list.symmetry_operation x,y,z _pdbx_struct_oper_list.matrix[1][1] 1.0000000000 _pdbx_struct_oper_list.matrix[1][2] 0.0000000000 _pdbx_struct_oper_list.matrix[1][3] 0.0000000000 _pdbx_struct_oper_list.vector[1] 0.0000000000 _pdbx_struct_oper_list.matrix[2][1] 0.0000000000 _pdbx_struct_oper_list.matrix[2][2] 1.0000000000 _pdbx_struct_oper_list.matrix[2][3] 0.0000000000 _pdbx_struct_oper_list.vector[2] 0.0000000000 _pdbx_struct_oper_list.matrix[3][1] 0.0000000000 _pdbx_struct_oper_list.matrix[3][2] 0.0000000000 _pdbx_struct_oper_list.matrix[3][3] 1.0000000000 _pdbx_struct_oper_list.vector[3] 0.0000000000 # loop_ _struct_asym.id _struct_asym.pdbx_blank_PDB_chainid_flag _struct_asym.pdbx_modified _struct_asym.entity_id _struct_asym.details A N N 1 ? B N N 1 ? C N N 2 ? D N N 3 ? E N N 3 ? F N N 3 ? G N N 2 ? H N N 4 ? I N N 4 ? # _struct.entry_id 5OF1 _struct.title "The structural versatility of TasA in B. subtilis biofilm formation" _struct.pdbx_descriptor "Spore coat-associated protein N" _struct.pdbx_model_details ? _struct.pdbx_formula_weight ? _struct.pdbx_formula_weight_method ? _struct.pdbx_model_type_details ? _struct.pdbx_CASP_flag N # _atom_sites.entry_id 5OF1 _atom_sites.Cartn_transform_axes ? _atom_sites.fract_transf_matrix[1][1] 1.000000 _atom_sites.fract_transf_matrix[1][2] 0.000000 _atom_sites.fract_transf_matrix[1][3] 0.000000 _atom_sites.fract_transf_matrix[2][1] 0.000000 _atom_sites.fract_transf_matrix[2][2] 1.000000 _atom_sites.fract_transf_matrix[2][3] 0.000000 _atom_sites.fract_transf_matrix[3][1] 0.000000 _atom_sites.fract_transf_matrix[3][2] 0.000000 _atom_sites.fract_transf_matrix[3][3] 1.000000 _atom_sites.fract_transf_vector[1] 0.00000 _atom_sites.fract_transf_vector[2] 0.00000 _atom_sites.fract_transf_vector[3] 0.00000 # loop_ _pdbe_orig_poly_seq_scheme.asym_id _pdbe_orig_poly_seq_scheme.entity_id _pdbe_orig_poly_seq_scheme.seq_id _pdbe_orig_poly_seq_scheme.mon_id _pdbe_orig_poly_seq_scheme.ndb_seq_num _pdbe_orig_poly_seq_scheme.pdb_seq_num _pdbe_orig_poly_seq_scheme.auth_seq_num _pdbe_orig_poly_seq_scheme.pdb_mon_id _pdbe_orig_poly_seq_scheme.auth_mon_id _pdbe_orig_poly_seq_scheme.pdb_strand_id _pdbe_orig_poly_seq_scheme.pdb_ins_code _pdbe_orig_poly_seq_scheme.hetero A 1 1 ASN 1 30 30 ASN ASN A . n A 1 2 ASP 2 31 31 ASP ASP A . n A 1 3 ILE 3 32 32 ILE ILE A . n A 1 4 LYS 4 33 33 LYS LYS A . n A 1 5 SER 5 34 34 SER SER A . n A 1 6 LYS 6 35 35 LYS LYS A . n A 1 7 ASP 7 36 36 ASP ASP A . n A 1 8 ALA 8 37 37 ALA ALA A . n A 1 9 THR 9 38 38 THR THR A . n A 1 10 PHE 10 39 39 PHE PHE A . n A 1 11 ALA 11 40 40 ALA ALA A . n A 1 12 SER 12 41 41 SER SER A . n A 1 13 GLY 13 42 42 GLY GLY A . n A 1 14 THR 14 43 43 THR THR A . n A 1 15 LEU 15 44 44 LEU LEU A . n A 1 16 ASP 16 45 45 ASP ASP A . n A 1 17 LEU 17 46 46 LEU LEU A . n A 1 18 SER 18 47 47 SER SER A . n A 1 19 ALA 19 48 48 ALA ALA A . n A 1 20 LYS 20 49 49 LYS LYS A . n A 1 21 GLU 21 50 50 GLU GLU A . n A 1 22 ASN 22 51 51 ASN ASN A . n A 1 23 SER 23 52 52 SER SER A . n A 1 24 ALA 24 53 53 ALA ALA A . n A 1 25 SER 25 54 54 SER SER A . n A 1 26 VAL 26 55 55 VAL VAL A . n A 1 27 ASN 27 56 56 ASN ASN A . n A 1 28 LEU 28 57 57 LEU LEU A . n A 1 29 SER 29 58 58 SER SER A . n A 1 30 ASN 30 59 59 ASN ASN A . n A 1 31 LEU 31 60 60 LEU LEU A . n A 1 32 LYS 32 61 61 LYS LYS A . n A 1 33 PRO 33 62 62 PRO PRO A . n A 1 34 GLY 34 63 63 GLY GLY A . n A 1 35 ASP 35 64 64 ASP ASP A . n A 1 36 LYS 36 65 65 LYS LYS A . n A 1 37 LEU 37 66 66 LEU LEU A . n A 1 38 THR 38 67 67 THR THR A . n A 1 39 LYS 39 68 68 LYS LYS A . n A 1 40 ASP 40 69 69 ASP ASP A . n A 1 41 PHE 41 70 70 PHE PHE A . n A 1 42 GLN 42 71 71 GLN GLN A . n A 1 43 PHE 43 72 72 PHE PHE A . n A 1 44 GLU 44 73 73 GLU GLU A . n A 1 45 ASN 45 74 74 ASN ASN A . n A 1 46 ASN 46 75 75 ASN ASN A . n A 1 47 GLY 47 76 76 GLY GLY A . n A 1 48 SER 48 77 77 SER SER A . n A 1 49 LEU 49 78 78 LEU LEU A . n A 1 50 ALA 50 79 79 ALA ALA A . n A 1 51 ILE 51 80 80 ILE ILE A . n A 1 52 LYS 52 81 81 LYS LYS A . n A 1 53 GLU 53 82 82 GLU GLU A . n A 1 54 VAL 54 83 83 VAL VAL A . n A 1 55 LEU 55 84 84 LEU LEU A . n A 1 56 MSE 56 85 85 MSE MSE A . n A 1 57 ALA 57 86 86 ALA ALA A . n A 1 58 LEU 58 87 87 LEU LEU A . n A 1 59 ASN 59 88 88 ASN ASN A . n A 1 60 TYR 60 89 89 TYR TYR A . n A 1 61 GLY 61 90 90 GLY GLY A . n A 1 62 ASP 62 91 91 ASP ASP A . n A 1 63 PHE 63 92 92 PHE PHE A . n A 1 64 LYS 64 93 93 LYS LYS A . n A 1 65 ALA 65 94 94 ALA ALA A . n A 1 66 ASN 66 95 95 ASN ASN A . n A 1 67 GLY 67 96 96 GLY GLY A . n A 1 68 GLY 68 97 97 GLY GLY A . n A 1 69 SER 69 98 98 SER SER A . n A 1 70 ASN 70 99 99 ASN ASN A . n A 1 71 THR 71 100 100 THR THR A . n A 1 72 SER 72 101 101 SER SER A . n A 1 73 PRO 73 102 102 PRO PRO A . n A 1 74 GLU 74 103 103 GLU GLU A . n A 1 75 ASP 75 104 104 ASP ASP A . n A 1 76 PHE 76 105 105 PHE PHE A . n A 1 77 LEU 77 106 106 LEU LEU A . n A 1 78 SER 78 107 107 SER SER A . n A 1 79 GLN 79 108 108 GLN GLN A . n A 1 80 PHE 80 109 109 PHE PHE A . n A 1 81 GLU 81 110 110 GLU GLU A . n A 1 82 VAL 82 111 111 VAL VAL A . n A 1 83 THR 83 112 112 THR THR A . n A 1 84 LEU 84 113 113 LEU LEU A . n A 1 85 LEU 85 114 114 LEU LEU A . n A 1 86 THR 86 115 115 THR THR A . n A 1 87 VAL 87 116 116 VAL VAL A . n A 1 88 GLY 88 117 117 GLY GLY A . n A 1 89 LYS 89 118 ? ? ? A . n A 1 90 GLU 90 119 ? ? ? A . n A 1 91 GLY 91 120 ? ? ? A . n A 1 92 GLY 92 121 ? ? ? A . n A 1 93 ASN 93 122 ? ? ? A . n A 1 94 GLY 94 123 ? ? ? A . n A 1 95 TYR 95 124 ? ? ? A . n A 1 96 PRO 96 125 125 PRO PRO A . n A 1 97 LYS 97 126 126 LYS LYS A . n A 1 98 ASN 98 127 127 ASN ASN A . n A 1 99 ILE 99 128 128 ILE ILE A . n A 1 100 ILE 100 129 129 ILE ILE A . n A 1 101 LEU 101 130 130 LEU LEU A . n A 1 102 ASP 102 131 131 ASP ASP A . n A 1 103 ASP 103 132 132 ASP ASP A . n A 1 104 ALA 104 133 133 ALA ALA A . n A 1 105 ASN 105 134 134 ASN ASN A . n A 1 106 LEU 106 135 135 LEU LEU A . n A 1 107 LYS 107 136 136 LYS LYS A . n A 1 108 ASP 108 137 137 ASP ASP A . n A 1 109 LEU 109 138 138 LEU LEU A . n A 1 110 TYR 110 139 139 TYR TYR A . n A 1 111 LEU 111 140 140 LEU LEU A . n A 1 112 MSE 112 141 141 MSE MSE A . n A 1 113 SER 113 142 142 SER SER A . n A 1 114 ALA 114 143 143 ALA ALA A . n A 1 115 LYS 115 144 144 LYS LYS A . n A 1 116 ASN 116 145 145 ASN ASN A . n A 1 117 ASP 117 146 146 ASP ASP A . n A 1 118 ALA 118 147 147 ALA ALA A . n A 1 119 ALA 119 148 148 ALA ALA A . n A 1 120 ALA 120 149 149 ALA ALA A . n A 1 121 ALA 121 150 150 ALA ALA A . n A 1 122 GLU 122 151 151 GLU GLU A . n A 1 123 LYS 123 152 152 LYS LYS A . n A 1 124 ILE 124 153 153 ILE ILE A . n A 1 125 LYS 125 154 154 LYS LYS A . n A 1 126 LYS 126 155 155 LYS LYS A . n A 1 127 GLN 127 156 156 GLN GLN A . n A 1 128 ILE 128 157 157 ILE ILE A . n A 1 129 ASP 129 158 158 ASP ASP A . n A 1 130 PRO 130 159 159 PRO PRO A . n A 1 131 LYS 131 160 160 LYS LYS A . n A 1 132 PHE 132 161 161 PHE PHE A . n A 1 133 LEU 133 162 162 LEU LEU A . n A 1 134 ASN 134 163 163 ASN ASN A . n A 1 135 ALA 135 164 164 ALA ALA A . n A 1 136 SER 136 165 165 SER SER A . n A 1 137 GLY 137 166 166 GLY GLY A . n A 1 138 LYS 138 167 167 LYS LYS A . n A 1 139 VAL 139 168 168 VAL VAL A . n A 1 140 ASN 140 169 169 ASN ASN A . n A 1 141 VAL 141 170 170 VAL VAL A . n A 1 142 ALA 142 171 171 ALA ALA A . n A 1 143 THR 143 172 172 THR THR A . n A 1 144 ILE 144 173 173 ILE ILE A . n A 1 145 ASP 145 174 174 ASP ASP A . n A 1 146 GLY 146 175 175 GLY GLY A . n A 1 147 LYS 147 176 176 LYS LYS A . n A 1 148 THR 148 177 177 THR THR A . n A 1 149 ALA 149 178 178 ALA ALA A . n A 1 150 PRO 150 179 179 PRO PRO A . n A 1 151 GLU 151 180 180 GLU GLU A . n A 1 152 TYR 152 181 181 TYR TYR A . n A 1 153 ASP 153 182 182 ASP ASP A . n A 1 154 GLY 154 183 183 GLY GLY A . n A 1 155 VAL 155 184 184 VAL VAL A . n A 1 156 PRO 156 185 185 PRO PRO A . n A 1 157 LYS 157 186 186 LYS LYS A . n A 1 158 THR 158 187 187 THR THR A . n A 1 159 PRO 159 188 188 PRO PRO A . n A 1 160 THR 160 189 189 THR THR A . n A 1 161 ASP 161 190 190 ASP ASP A . n A 1 162 PHE 162 191 191 PHE PHE A . n A 1 163 ASP 163 192 192 ASP ASP A . n A 1 164 GLN 164 193 193 GLN GLN A . n A 1 165 VAL 165 194 194 VAL VAL A . n A 1 166 GLN 166 195 195 GLN GLN A . n A 1 167 MSE 167 196 196 MSE MSE A . n A 1 168 GLU 168 197 197 GLU GLU A . n A 1 169 ILE 169 198 198 ILE ILE A . n A 1 170 GLN 170 199 199 GLN GLN A . n A 1 171 PHE 171 200 200 PHE PHE A . n A 1 172 LYS 172 201 201 LYS LYS A . n A 1 173 ASP 173 202 202 ASP ASP A . n A 1 174 ASP 174 203 203 ASP ASP A . n A 1 175 LYS 175 204 204 LYS LYS A . n A 1 176 THR 176 205 205 THR THR A . n A 1 177 LYS 177 206 206 LYS LYS A . n A 1 178 ASP 178 207 207 ASP ASP A . n A 1 179 GLU 179 208 208 GLU GLU A . n A 1 180 LYS 180 209 209 LYS LYS A . n A 1 181 GLY 181 210 210 GLY GLY A . n A 1 182 LEU 182 211 211 LEU LEU A . n A 1 183 MSE 183 212 212 MSE MSE A . n A 1 184 VAL 184 213 213 VAL VAL A . n A 1 185 GLN 185 214 214 GLN GLN A . n A 1 186 ASN 186 215 215 ASN ASN A . n A 1 187 LYS 187 216 216 LYS LYS A . n A 1 188 TYR 188 217 217 TYR TYR A . n A 1 189 GLN 189 218 218 GLN GLN A . n A 1 190 GLY 190 219 219 GLY GLY A . n A 1 191 ASN 191 220 220 ASN ASN A . n A 1 192 SER 192 221 221 SER SER A . n A 1 193 ILE 193 222 222 ILE ILE A . n A 1 194 LYS 194 223 223 LYS LYS A . n A 1 195 LEU 195 224 224 LEU LEU A . n A 1 196 GLN 196 225 225 GLN GLN A . n A 1 197 PHE 197 226 226 PHE PHE A . n A 1 198 SER 198 227 227 SER SER A . n A 1 199 PHE 199 228 228 PHE PHE A . n A 1 200 GLU 200 229 229 GLU GLU A . n A 1 201 ALA 201 230 230 ALA ALA A . n A 1 202 THR 202 231 231 THR THR A . n A 1 203 GLN 203 232 232 GLN GLN A . n A 1 204 TRP 204 233 233 TRP TRP A . n A 1 205 ASN 205 234 234 ASN ASN A . n A 1 206 GLY 206 235 235 GLY GLY A . n A 1 207 LEU 207 236 236 LEU LEU A . n A 1 208 THR 208 237 237 THR THR A . n A 1 209 ILE 209 238 238 ILE ILE A . n A 1 210 LYS 210 239 239 LYS LYS A . n B 1 1 ASN 1 30 30 ASN ASN B . n B 1 2 ASP 2 31 31 ASP ASP B . n B 1 3 ILE 3 32 32 ILE ILE B . n B 1 4 LYS 4 33 33 LYS LYS B . n B 1 5 SER 5 34 34 SER SER B . n B 1 6 LYS 6 35 ? ? ? B . n B 1 7 ASP 7 36 ? ? ? B . n B 1 8 ALA 8 37 ? ? ? B . n B 1 9 THR 9 38 ? ? ? B . n B 1 10 PHE 10 39 39 PHE PHE B . n B 1 11 ALA 11 40 40 ALA ALA B . n B 1 12 SER 12 41 41 SER SER B . n B 1 13 GLY 13 42 42 GLY GLY B . n B 1 14 THR 14 43 43 THR THR B . n B 1 15 LEU 15 44 44 LEU LEU B . n B 1 16 ASP 16 45 45 ASP ASP B . n B 1 17 LEU 17 46 46 LEU LEU B . n B 1 18 SER 18 47 47 SER SER B . n B 1 19 ALA 19 48 ? ? ? B . n B 1 20 LYS 20 49 ? ? ? B . n B 1 21 GLU 21 50 ? ? ? B . n B 1 22 ASN 22 51 51 ASN ASN B . n B 1 23 SER 23 52 52 SER SER B . n B 1 24 ALA 24 53 53 ALA ALA B . n B 1 25 SER 25 54 54 SER SER B . n B 1 26 VAL 26 55 55 VAL VAL B . n B 1 27 ASN 27 56 56 ASN ASN B . n B 1 28 LEU 28 57 57 LEU LEU B . n B 1 29 SER 29 58 58 SER SER B . n B 1 30 ASN 30 59 59 ASN ASN B . n B 1 31 LEU 31 60 60 LEU LEU B . n B 1 32 LYS 32 61 61 LYS LYS B . n B 1 33 PRO 33 62 62 PRO PRO B . n B 1 34 GLY 34 63 63 GLY GLY B . n B 1 35 ASP 35 64 64 ASP ASP B . n B 1 36 LYS 36 65 65 LYS LYS B . n B 1 37 LEU 37 66 66 LEU LEU B . n B 1 38 THR 38 67 67 THR THR B . n B 1 39 LYS 39 68 68 LYS LYS B . n B 1 40 ASP 40 69 69 ASP ASP B . n B 1 41 PHE 41 70 70 PHE PHE B . n B 1 42 GLN 42 71 71 GLN GLN B . n B 1 43 PHE 43 72 72 PHE PHE B . n B 1 44 GLU 44 73 73 GLU GLU B . n B 1 45 ASN 45 74 74 ASN ASN B . n B 1 46 ASN 46 75 ? ? ? B . n B 1 47 GLY 47 76 ? ? ? B . n B 1 48 SER 48 77 ? ? ? B . n B 1 49 LEU 49 78 78 LEU LEU B . n B 1 50 ALA 50 79 79 ALA ALA B . n B 1 51 ILE 51 80 80 ILE ILE B . n B 1 52 LYS 52 81 81 LYS LYS B . n B 1 53 GLU 53 82 82 GLU GLU B . n B 1 54 VAL 54 83 83 VAL VAL B . n B 1 55 LEU 55 84 84 LEU LEU B . n B 1 56 MSE 56 85 85 MSE MSE B . n B 1 57 ALA 57 86 86 ALA ALA B . n B 1 58 LEU 58 87 87 LEU LEU B . n B 1 59 ASN 59 88 88 ASN ASN B . n B 1 60 TYR 60 89 89 TYR TYR B . n B 1 61 GLY 61 90 90 GLY GLY B . n B 1 62 ASP 62 91 91 ASP ASP B . n B 1 63 PHE 63 92 92 PHE PHE B . n B 1 64 LYS 64 93 93 LYS LYS B . n B 1 65 ALA 65 94 94 ALA ALA B . n B 1 66 ASN 66 95 95 ASN ASN B . n B 1 67 GLY 67 96 96 GLY GLY B . n B 1 68 GLY 68 97 97 GLY GLY B . n B 1 69 SER 69 98 98 SER SER B . n B 1 70 ASN 70 99 99 ASN ASN B . n B 1 71 THR 71 100 100 THR THR B . n B 1 72 SER 72 101 101 SER SER B . n B 1 73 PRO 73 102 102 PRO PRO B . n B 1 74 GLU 74 103 103 GLU GLU B . n B 1 75 ASP 75 104 104 ASP ASP B . n B 1 76 PHE 76 105 105 PHE PHE B . n B 1 77 LEU 77 106 106 LEU LEU B . n B 1 78 SER 78 107 107 SER SER B . n B 1 79 GLN 79 108 108 GLN GLN B . n B 1 80 PHE 80 109 109 PHE PHE B . n B 1 81 GLU 81 110 110 GLU GLU B . n B 1 82 VAL 82 111 111 VAL VAL B . n B 1 83 THR 83 112 112 THR THR B . n B 1 84 LEU 84 113 113 LEU LEU B . n B 1 85 LEU 85 114 114 LEU LEU B . n B 1 86 THR 86 115 115 THR THR B . n B 1 87 VAL 87 116 116 VAL VAL B . n B 1 88 GLY 88 117 117 GLY GLY B . n B 1 89 LYS 89 118 ? ? ? B . n B 1 90 GLU 90 119 ? ? ? B . n B 1 91 GLY 91 120 ? ? ? B . n B 1 92 GLY 92 121 ? ? ? B . n B 1 93 ASN 93 122 ? ? ? B . n B 1 94 GLY 94 123 ? ? ? B . n B 1 95 TYR 95 124 ? ? ? B . n B 1 96 PRO 96 125 125 PRO PRO B . n B 1 97 LYS 97 126 126 LYS LYS B . n B 1 98 ASN 98 127 127 ASN ASN B . n B 1 99 ILE 99 128 128 ILE ILE B . n B 1 100 ILE 100 129 129 ILE ILE B . n B 1 101 LEU 101 130 130 LEU LEU B . n B 1 102 ASP 102 131 131 ASP ASP B . n B 1 103 ASP 103 132 132 ASP ASP B . n B 1 104 ALA 104 133 133 ALA ALA B . n B 1 105 ASN 105 134 134 ASN ASN B . n B 1 106 LEU 106 135 135 LEU LEU B . n B 1 107 LYS 107 136 136 LYS LYS B . n B 1 108 ASP 108 137 137 ASP ASP B . n B 1 109 LEU 109 138 138 LEU LEU B . n B 1 110 TYR 110 139 139 TYR TYR B . n B 1 111 LEU 111 140 140 LEU LEU B . n B 1 112 MSE 112 141 141 MSE MSE B . n B 1 113 SER 113 142 142 SER SER B . n B 1 114 ALA 114 143 143 ALA ALA B . n B 1 115 LYS 115 144 144 LYS LYS B . n B 1 116 ASN 116 145 145 ASN ASN B . n B 1 117 ASP 117 146 146 ASP ASP B . n B 1 118 ALA 118 147 147 ALA ALA B . n B 1 119 ALA 119 148 148 ALA ALA B . n B 1 120 ALA 120 149 149 ALA ALA B . n B 1 121 ALA 121 150 150 ALA ALA B . n B 1 122 GLU 122 151 151 GLU GLU B . n B 1 123 LYS 123 152 152 LYS LYS B . n B 1 124 ILE 124 153 153 ILE ILE B . n B 1 125 LYS 125 154 154 LYS LYS B . n B 1 126 LYS 126 155 155 LYS LYS B . n B 1 127 GLN 127 156 156 GLN GLN B . n B 1 128 ILE 128 157 157 ILE ILE B . n B 1 129 ASP 129 158 158 ASP ASP B . n B 1 130 PRO 130 159 159 PRO PRO B . n B 1 131 LYS 131 160 160 LYS LYS B . n B 1 132 PHE 132 161 161 PHE PHE B . n B 1 133 LEU 133 162 162 LEU LEU B . n B 1 134 ASN 134 163 163 ASN ASN B . n B 1 135 ALA 135 164 164 ALA ALA B . n B 1 136 SER 136 165 165 SER SER B . n B 1 137 GLY 137 166 166 GLY GLY B . n B 1 138 LYS 138 167 167 LYS LYS B . n B 1 139 VAL 139 168 168 VAL VAL B . n B 1 140 ASN 140 169 169 ASN ASN B . n B 1 141 VAL 141 170 170 VAL VAL B . n B 1 142 ALA 142 171 171 ALA ALA B . n B 1 143 THR 143 172 172 THR THR B . n B 1 144 ILE 144 173 173 ILE ILE B . n B 1 145 ASP 145 174 174 ASP ASP B . n B 1 146 GLY 146 175 175 GLY GLY B . n B 1 147 LYS 147 176 176 LYS LYS B . n B 1 148 THR 148 177 177 THR THR B . n B 1 149 ALA 149 178 178 ALA ALA B . n B 1 150 PRO 150 179 179 PRO PRO B . n B 1 151 GLU 151 180 180 GLU GLU B . n B 1 152 TYR 152 181 181 TYR TYR B . n B 1 153 ASP 153 182 182 ASP ASP B . n B 1 154 GLY 154 183 183 GLY GLY B . n B 1 155 VAL 155 184 184 VAL VAL B . n B 1 156 PRO 156 185 185 PRO PRO B . n B 1 157 LYS 157 186 186 LYS LYS B . n B 1 158 THR 158 187 187 THR THR B . n B 1 159 PRO 159 188 188 PRO PRO B . n B 1 160 THR 160 189 189 THR THR B . n B 1 161 ASP 161 190 190 ASP ASP B . n B 1 162 PHE 162 191 191 PHE PHE B . n B 1 163 ASP 163 192 192 ASP ASP B . n B 1 164 GLN 164 193 193 GLN GLN B . n B 1 165 VAL 165 194 194 VAL VAL B . n B 1 166 GLN 166 195 195 GLN GLN B . n B 1 167 MSE 167 196 196 MSE MSE B . n B 1 168 GLU 168 197 197 GLU GLU B . n B 1 169 ILE 169 198 198 ILE ILE B . n B 1 170 GLN 170 199 199 GLN GLN B . n B 1 171 PHE 171 200 200 PHE PHE B . n B 1 172 LYS 172 201 201 LYS LYS B . n B 1 173 ASP 173 202 202 ASP ASP B . n B 1 174 ASP 174 203 203 ASP ASP B . n B 1 175 LYS 175 204 204 LYS LYS B . n B 1 176 THR 176 205 205 THR THR B . n B 1 177 LYS 177 206 206 LYS LYS B . n B 1 178 ASP 178 207 207 ASP ASP B . n B 1 179 GLU 179 208 208 GLU GLU B . n B 1 180 LYS 180 209 209 LYS LYS B . n B 1 181 GLY 181 210 210 GLY GLY B . n B 1 182 LEU 182 211 211 LEU LEU B . n B 1 183 MSE 183 212 212 MSE MSE B . n B 1 184 VAL 184 213 213 VAL VAL B . n B 1 185 GLN 185 214 214 GLN GLN B . n B 1 186 ASN 186 215 215 ASN ASN B . n B 1 187 LYS 187 216 216 LYS LYS B . n B 1 188 TYR 188 217 217 TYR TYR B . n B 1 189 GLN 189 218 218 GLN GLN B . n B 1 190 GLY 190 219 219 GLY GLY B . n B 1 191 ASN 191 220 220 ASN ASN B . n B 1 192 SER 192 221 221 SER SER B . n B 1 193 ILE 193 222 222 ILE ILE B . n B 1 194 LYS 194 223 223 LYS LYS B . n B 1 195 LEU 195 224 224 LEU LEU B . n B 1 196 GLN 196 225 225 GLN GLN B . n B 1 197 PHE 197 226 226 PHE PHE B . n B 1 198 SER 198 227 227 SER SER B . n B 1 199 PHE 199 228 228 PHE PHE B . n B 1 200 GLU 200 229 229 GLU GLU B . n B 1 201 ALA 201 230 230 ALA ALA B . n B 1 202 THR 202 231 231 THR THR B . n B 1 203 GLN 203 232 232 GLN GLN B . n B 1 204 TRP 204 233 233 TRP TRP B . n B 1 205 ASN 205 234 234 ASN ASN B . n B 1 206 GLY 206 235 235 GLY GLY B . n B 1 207 LEU 207 236 236 LEU LEU B . n B 1 208 THR 208 237 237 THR THR B . n B 1 209 ILE 209 238 238 ILE ILE B . n B 1 210 LYS 210 239 ? ? ? B . n # loop_ _pdbe_orig_nonpoly_scheme.asym_id _pdbe_orig_nonpoly_scheme.entity_id _pdbe_orig_nonpoly_scheme.mon_id _pdbe_orig_nonpoly_scheme.ndb_seq_num _pdbe_orig_nonpoly_scheme.pdb_seq_num _pdbe_orig_nonpoly_scheme.auth_seq_num _pdbe_orig_nonpoly_scheme.pdb_mon_id _pdbe_orig_nonpoly_scheme.auth_mon_id _pdbe_orig_nonpoly_scheme.pdb_strand_id _pdbe_orig_nonpoly_scheme.pdb_ins_code C 2 SAL 1 301 104 SAL SAL A . D 3 EDO 1 302 1 EDO EDO A . E 3 EDO 1 303 1 EDO EDO A . F 3 EDO 1 304 1 EDO EDO A . G 2 SAL 1 301 104 SAL SAL B . H 4 HOH 1 401 479 HOH HOH A . H 4 HOH 2 402 181 HOH HOH A . H 4 HOH 3 403 383 HOH HOH A . H 4 HOH 4 404 459 HOH HOH A . H 4 HOH 5 405 319 HOH HOH A . H 4 HOH 6 406 65 HOH HOH A . H 4 HOH 7 407 85 HOH HOH A . H 4 HOH 8 408 492 HOH HOH A . H 4 HOH 9 409 443 HOH HOH A . H 4 HOH 10 410 150 HOH HOH A . H 4 HOH 11 411 99 HOH HOH A . H 4 HOH 12 412 426 HOH HOH A . H 4 HOH 13 413 194 HOH HOH A . H 4 HOH 14 414 140 HOH HOH A . H 4 HOH 15 415 415 HOH HOH A . H 4 HOH 16 416 144 HOH HOH A . H 4 HOH 17 417 362 HOH HOH A . H 4 HOH 18 418 74 HOH HOH A . H 4 HOH 19 419 230 HOH HOH A . H 4 HOH 20 420 131 HOH HOH A . H 4 HOH 21 421 388 HOH HOH A . H 4 HOH 22 422 461 HOH HOH A . H 4 HOH 23 423 112 HOH HOH A . H 4 HOH 24 424 149 HOH HOH A . H 4 HOH 25 425 83 HOH HOH A . H 4 HOH 26 426 324 HOH HOH A . H 4 HOH 27 427 302 HOH HOH A . H 4 HOH 28 428 158 HOH HOH A . H 4 HOH 29 429 213 HOH HOH A . H 4 HOH 30 430 129 HOH HOH A . H 4 HOH 31 431 458 HOH HOH A . H 4 HOH 32 432 20 HOH HOH A . H 4 HOH 33 433 68 HOH HOH A . H 4 HOH 34 434 98 HOH HOH A . H 4 HOH 35 435 136 HOH HOH A . H 4 HOH 36 436 175 HOH HOH A . H 4 HOH 37 437 500 HOH HOH A . H 4 HOH 38 438 1 HOH HOH A . H 4 HOH 39 439 369 HOH HOH A . H 4 HOH 40 440 13 HOH HOH A . H 4 HOH 41 441 195 HOH HOH A . H 4 HOH 42 442 160 HOH HOH A . H 4 HOH 43 443 163 HOH HOH A . H 4 HOH 44 444 35 HOH HOH A . H 4 HOH 45 445 239 HOH HOH A . H 4 HOH 46 446 377 HOH HOH A . H 4 HOH 47 447 52 HOH HOH A . H 4 HOH 48 448 15 HOH HOH A . H 4 HOH 49 449 95 HOH HOH A . H 4 HOH 50 450 208 HOH HOH A . H 4 HOH 51 451 336 HOH HOH A . H 4 HOH 52 452 401 HOH HOH A . H 4 HOH 53 453 188 HOH HOH A . H 4 HOH 54 454 151 HOH HOH A . H 4 HOH 55 455 121 HOH HOH A . H 4 HOH 56 456 374 HOH HOH A . H 4 HOH 57 457 494 HOH HOH A . H 4 HOH 58 458 48 HOH HOH A . H 4 HOH 59 459 7 HOH HOH A . H 4 HOH 60 460 258 HOH HOH A . H 4 HOH 61 461 54 HOH HOH A . H 4 HOH 62 462 75 HOH HOH A . H 4 HOH 63 463 290 HOH HOH A . H 4 HOH 64 464 86 HOH HOH A . H 4 HOH 65 465 174 HOH HOH A . H 4 HOH 66 466 380 HOH HOH A . H 4 HOH 67 467 17 HOH HOH A . H 4 HOH 68 468 165 HOH HOH A . H 4 HOH 69 469 315 HOH HOH A . H 4 HOH 70 470 465 HOH HOH A . H 4 HOH 71 471 348 HOH HOH A . H 4 HOH 72 472 425 HOH HOH A . H 4 HOH 73 473 484 HOH HOH A . H 4 HOH 74 474 122 HOH HOH A . H 4 HOH 75 475 382 HOH HOH A . H 4 HOH 76 476 84 HOH HOH A . H 4 HOH 77 477 132 HOH HOH A . H 4 HOH 78 478 46 HOH HOH A . H 4 HOH 79 479 351 HOH HOH A . H 4 HOH 80 480 191 HOH HOH A . H 4 HOH 81 481 463 HOH HOH A . H 4 HOH 82 482 308 HOH HOH A . H 4 HOH 83 483 25 HOH HOH A . H 4 HOH 84 484 159 HOH HOH A . H 4 HOH 85 485 24 HOH HOH A . H 4 HOH 86 486 76 HOH HOH A . H 4 HOH 87 487 78 HOH HOH A . H 4 HOH 88 488 90 HOH HOH A . H 4 HOH 89 489 294 HOH HOH A . H 4 HOH 90 490 307 HOH HOH A . H 4 HOH 91 491 58 HOH HOH A . H 4 HOH 92 492 130 HOH HOH A . H 4 HOH 93 493 141 HOH HOH A . H 4 HOH 94 494 368 HOH HOH A . H 4 HOH 95 495 384 HOH HOH A . H 4 HOH 96 496 177 HOH HOH A . H 4 HOH 97 497 97 HOH HOH A . H 4 HOH 98 498 124 HOH HOH A . H 4 HOH 99 499 379 HOH HOH A . H 4 HOH 100 500 119 HOH HOH A . H 4 HOH 101 501 77 HOH HOH A . H 4 HOH 102 502 80 HOH HOH A . H 4 HOH 103 503 199 HOH HOH A . H 4 HOH 104 504 387 HOH HOH A . H 4 HOH 105 505 3 HOH HOH A . H 4 HOH 106 506 432 HOH HOH A . H 4 HOH 107 507 376 HOH HOH A . H 4 HOH 108 508 355 HOH HOH A . H 4 HOH 109 509 40 HOH HOH A . H 4 HOH 110 510 172 HOH HOH A . H 4 HOH 111 511 375 HOH HOH A . H 4 HOH 112 512 460 HOH HOH A . H 4 HOH 113 513 157 HOH HOH A . H 4 HOH 114 514 22 HOH HOH A . H 4 HOH 115 515 467 HOH HOH A . H 4 HOH 116 516 414 HOH HOH A . H 4 HOH 117 517 477 HOH HOH A . H 4 HOH 118 518 145 HOH HOH A . H 4 HOH 119 519 234 HOH HOH A . H 4 HOH 120 520 232 HOH HOH A . H 4 HOH 121 521 488 HOH HOH A . H 4 HOH 122 522 493 HOH HOH A . H 4 HOH 123 523 143 HOH HOH A . H 4 HOH 124 524 312 HOH HOH A . H 4 HOH 125 525 214 HOH HOH A . H 4 HOH 126 526 457 HOH HOH A . H 4 HOH 127 527 423 HOH HOH A . H 4 HOH 128 528 491 HOH HOH A . H 4 HOH 129 529 373 HOH HOH A . H 4 HOH 130 530 485 HOH HOH A . H 4 HOH 131 531 481 HOH HOH A . H 4 HOH 132 532 462 HOH HOH A . H 4 HOH 133 533 30 HOH HOH A . H 4 HOH 134 534 389 HOH HOH A . H 4 HOH 135 535 176 HOH HOH A . H 4 HOH 136 536 446 HOH HOH A . H 4 HOH 137 537 363 HOH HOH A . H 4 HOH 138 538 197 HOH HOH A . H 4 HOH 139 539 371 HOH HOH A . H 4 HOH 140 540 499 HOH HOH A . H 4 HOH 141 541 480 HOH HOH A . H 4 HOH 142 542 66 HOH HOH A . H 4 HOH 143 543 431 HOH HOH A . H 4 HOH 144 544 361 HOH HOH A . H 4 HOH 145 545 316 HOH HOH A . H 4 HOH 146 546 365 HOH HOH A . H 4 HOH 147 547 411 HOH HOH A . H 4 HOH 148 548 62 HOH HOH A . H 4 HOH 149 549 475 HOH HOH A . H 4 HOH 150 550 444 HOH HOH A . H 4 HOH 151 551 448 HOH HOH A . H 4 HOH 152 552 183 HOH HOH A . H 4 HOH 153 553 385 HOH HOH A . H 4 HOH 154 554 502 HOH HOH A . H 4 HOH 155 555 314 HOH HOH A . H 4 HOH 156 556 466 HOH HOH A . H 4 HOH 157 557 215 HOH HOH A . H 4 HOH 158 558 359 HOH HOH A . H 4 HOH 159 559 445 HOH HOH A . H 4 HOH 160 560 344 HOH HOH A . H 4 HOH 161 561 418 HOH HOH A . H 4 HOH 162 562 55 HOH HOH A . H 4 HOH 163 563 511 HOH HOH A . H 4 HOH 164 564 63 HOH HOH A . H 4 HOH 165 565 386 HOH HOH A . H 4 HOH 166 566 94 HOH HOH A . H 4 HOH 167 567 287 HOH HOH A . H 4 HOH 168 568 447 HOH HOH A . I 4 HOH 1 401 452 HOH HOH B . I 4 HOH 2 402 118 HOH HOH B . I 4 HOH 3 403 227 HOH HOH B . I 4 HOH 4 404 310 HOH HOH B . I 4 HOH 5 405 402 HOH HOH B . I 4 HOH 6 406 127 HOH HOH B . I 4 HOH 7 407 61 HOH HOH B . I 4 HOH 8 408 455 HOH HOH B . I 4 HOH 9 409 182 HOH HOH B . I 4 HOH 10 410 173 HOH HOH B . I 4 HOH 11 411 392 HOH HOH B . I 4 HOH 12 412 498 HOH HOH B . I 4 HOH 13 413 487 HOH HOH B . I 4 HOH 14 414 56 HOH HOH B . I 4 HOH 15 415 169 HOH HOH B . I 4 HOH 16 416 34 HOH HOH B . I 4 HOH 17 417 299 HOH HOH B . I 4 HOH 18 418 142 HOH HOH B . I 4 HOH 19 419 334 HOH HOH B . I 4 HOH 20 420 166 HOH HOH B . I 4 HOH 21 421 105 HOH HOH B . I 4 HOH 22 422 439 HOH HOH B . I 4 HOH 23 423 219 HOH HOH B . I 4 HOH 24 424 207 HOH HOH B . I 4 HOH 25 425 470 HOH HOH B . I 4 HOH 26 426 367 HOH HOH B . I 4 HOH 27 427 233 HOH HOH B . I 4 HOH 28 428 326 HOH HOH B . I 4 HOH 29 429 146 HOH HOH B . I 4 HOH 30 430 79 HOH HOH B . I 4 HOH 31 431 390 HOH HOH B . I 4 HOH 32 432 304 HOH HOH B . I 4 HOH 33 433 438 HOH HOH B . I 4 HOH 34 434 39 HOH HOH B . I 4 HOH 35 435 167 HOH HOH B . I 4 HOH 36 436 171 HOH HOH B . I 4 HOH 37 437 246 HOH HOH B . I 4 HOH 38 438 133 HOH HOH B . I 4 HOH 39 439 28 HOH HOH B . I 4 HOH 40 440 223 HOH HOH B . I 4 HOH 41 441 41 HOH HOH B . I 4 HOH 42 442 128 HOH HOH B . I 4 HOH 43 443 483 HOH HOH B . I 4 HOH 44 444 60 HOH HOH B . I 4 HOH 45 445 200 HOH HOH B . I 4 HOH 46 446 218 HOH HOH B . I 4 HOH 47 447 37 HOH HOH B . I 4 HOH 48 448 81 HOH HOH B . I 4 HOH 49 449 23 HOH HOH B . I 4 HOH 50 450 70 HOH HOH B . I 4 HOH 51 451 193 HOH HOH B . I 4 HOH 52 452 2 HOH HOH B . I 4 HOH 53 453 156 HOH HOH B . I 4 HOH 54 454 44 HOH HOH B . I 4 HOH 55 455 422 HOH HOH B . I 4 HOH 56 456 92 HOH HOH B . I 4 HOH 57 457 71 HOH HOH B . I 4 HOH 58 458 285 HOH HOH B . I 4 HOH 59 459 366 HOH HOH B . I 4 HOH 60 460 451 HOH HOH B . I 4 HOH 61 461 263 HOH HOH B . I 4 HOH 62 462 4 HOH HOH B . I 4 HOH 63 463 190 HOH HOH B . I 4 HOH 64 464 8 HOH HOH B . I 4 HOH 65 465 6 HOH HOH B . I 4 HOH 66 466 259 HOH HOH B . I 4 HOH 67 467 27 HOH HOH B . I 4 HOH 68 468 43 HOH HOH B . I 4 HOH 69 469 5 HOH HOH B . I 4 HOH 70 470 397 HOH HOH B . I 4 HOH 71 471 107 HOH HOH B . I 4 HOH 72 472 89 HOH HOH B . I 4 HOH 73 473 486 HOH HOH B . I 4 HOH 74 474 203 HOH HOH B . I 4 HOH 75 475 120 HOH HOH B . I 4 HOH 76 476 264 HOH HOH B . I 4 HOH 77 477 204 HOH HOH B . I 4 HOH 78 478 343 HOH HOH B . I 4 HOH 79 479 220 HOH HOH B . I 4 HOH 80 480 476 HOH HOH B . I 4 HOH 81 481 296 HOH HOH B . I 4 HOH 82 482 202 HOH HOH B . I 4 HOH 83 483 179 HOH HOH B . I 4 HOH 84 484 125 HOH HOH B . I 4 HOH 85 485 456 HOH HOH B . I 4 HOH 86 486 29 HOH HOH B . I 4 HOH 87 487 153 HOH HOH B . I 4 HOH 88 488 453 HOH HOH B . I 4 HOH 89 489 108 HOH HOH B . I 4 HOH 90 490 495 HOH HOH B . I 4 HOH 91 491 469 HOH HOH B . I 4 HOH 92 492 229 HOH HOH B . I 4 HOH 93 493 139 HOH HOH B . I 4 HOH 94 494 395 HOH HOH B . I 4 HOH 95 495 19 HOH HOH B . I 4 HOH 96 496 196 HOH HOH B . I 4 HOH 97 497 49 HOH HOH B . I 4 HOH 98 498 114 HOH HOH B . I 4 HOH 99 499 404 HOH HOH B . I 4 HOH 100 500 101 HOH HOH B . I 4 HOH 101 501 231 HOH HOH B . I 4 HOH 102 502 441 HOH HOH B . I 4 HOH 103 503 224 HOH HOH B . I 4 HOH 104 504 489 HOH HOH B . I 4 HOH 105 505 471 HOH HOH B . I 4 HOH 106 506 407 HOH HOH B . I 4 HOH 107 507 504 HOH HOH B . I 4 HOH 108 508 152 HOH HOH B . I 4 HOH 109 509 135 HOH HOH B . I 4 HOH 110 510 67 HOH HOH B . I 4 HOH 111 511 201 HOH HOH B . I 4 HOH 112 512 126 HOH HOH B . I 4 HOH 113 513 509 HOH HOH B . I 4 HOH 114 514 192 HOH HOH B . I 4 HOH 115 515 430 HOH HOH B . I 4 HOH 116 516 51 HOH HOH B . I 4 HOH 117 517 88 HOH HOH B . I 4 HOH 118 518 123 HOH HOH B . I 4 HOH 119 519 501 HOH HOH B . I 4 HOH 120 520 100 HOH HOH B . I 4 HOH 121 521 450 HOH HOH B . I 4 HOH 122 522 406 HOH HOH B . I 4 HOH 123 523 309 HOH HOH B . I 4 HOH 124 524 437 HOH HOH B . I 4 HOH 125 525 490 HOH HOH B . I 4 HOH 126 526 464 HOH HOH B . I 4 HOH 127 527 396 HOH HOH B . I 4 HOH 128 528 212 HOH HOH B . I 4 HOH 129 529 434 HOH HOH B . I 4 HOH 130 530 59 HOH HOH B . I 4 HOH 131 531 235 HOH HOH B . I 4 HOH 132 532 164 HOH HOH B . I 4 HOH 133 533 111 HOH HOH B . I 4 HOH 134 534 394 HOH HOH B . I 4 HOH 135 535 292 HOH HOH B . I 4 HOH 136 536 109 HOH HOH B . I 4 HOH 137 537 398 HOH HOH B . I 4 HOH 138 538 327 HOH HOH B . I 4 HOH 139 539 322 HOH HOH B . I 4 HOH 140 540 508 HOH HOH B . I 4 HOH 141 541 403 HOH HOH B . I 4 HOH 142 542 472 HOH HOH B . I 4 HOH 143 543 421 HOH HOH B . I 4 HOH 144 544 436 HOH HOH B . I 4 HOH 145 545 454 HOH HOH B . I 4 HOH 146 546 505 HOH HOH B . I 4 HOH 147 547 168 HOH HOH B . I 4 HOH 148 548 507 HOH HOH B . I 4 HOH 149 549 435 HOH HOH B . I 4 HOH 150 550 393 HOH HOH B . I 4 HOH 151 551 433 HOH HOH B . I 4 HOH 152 552 162 HOH HOH B . I 4 HOH 153 553 189 HOH HOH B . I 4 HOH 154 554 289 HOH HOH B . I 4 HOH 155 555 503 HOH HOH B . I 4 HOH 156 556 72 HOH HOH B . I 4 HOH 157 557 506 HOH HOH B . I 4 HOH 158 558 138 HOH HOH B . I 4 HOH 159 559 497 HOH HOH B . I 4 HOH 160 560 496 HOH HOH B . I 4 HOH 161 561 187 HOH HOH B . I 4 HOH 162 562 510 HOH HOH B . I 4 HOH 163 563 442 HOH HOH B . # loop_ _entity.id _entity.type _entity.src_method _entity.pdbx_description _entity.formula_weight _entity.pdbx_number_of_molecules _entity.pdbx_ec _entity.pdbx_mutation _entity.pdbx_fragment _entity.details _entity.assembly_id 1 polymer man "Spore coat-associated protein N" 23160.271 1 ? ? ? ? 1 2 non-polymer syn "2-HYDROXYBENZOIC ACID" 138.121 1 ? ? ? ? 1 3 non-polymer syn ethane-1,2-diol 62.068 3 ? ? ? ? 1 4 water nat water 18.015 1 ? ? ? ? 1 # _entity_poly.entity_id 1 _entity_poly.type polypeptide(L) _entity_poly.nstd_linkage no _entity_poly.nstd_monomer yes _entity_poly.pdbx_seq_one_letter_code ;NDIKSKDATFASGTLDLSAKENSASVNLSNLKPGDKLTKDFQFENNGSLAIKEVL(MSE)ALNYGDFKANGGSNTSPEDF LSQFEVTLLTVGKEGGNGYPKNIILDDANLKDLYL(MSE)SAKNDAAAAEKIKKQIDPKFLNASGKVNVATIDGKTAPEY DGVPKTPTDFDQVQ(MSE)EIQFKDDKTKDEKGL(MSE)VQNKYQGNSIKLQFSFEATQWNGLTIK ; _entity_poly.pdbx_seq_one_letter_code_can ;NDIKSKDATFASGTLDLSAKENSASVNLSNLKPGDKLTKDFQFENNGSLAIKEVLMALNYGDFKANGGSNTSPEDFLSQF EVTLLTVGKEGGNGYPKNIILDDANLKDLYLMSAKNDAAAAEKIKKQIDPKFLNASGKVNVATIDGKTAPEYDGVPKTPT DFDQVQMEIQFKDDKTKDEKGLMVQNKYQGNSIKLQFSFEATQWNGLTIK ; _entity_poly.pdbx_strand_id A _entity_poly.pdbx_target_identifier ? _entity_poly.assembly_id 1 # loop_ _pdbx_entity_nonpoly.assembly_id _pdbx_entity_nonpoly.entity_id _pdbx_entity_nonpoly.name _pdbx_entity_nonpoly.comp_id 1 2 "2-HYDROXYBENZOIC ACID" SAL 1 3 ethane-1,2-diol EDO 1 4 water HOH # loop_ _pdbe_entity_remapping.source_coordinates _pdbe_entity_remapping.assembly_id _pdbe_entity_remapping.entity_id _pdbe_entity_remapping.type _pdbe_entity_remapping.description 5OF1 1 1 polypeptide(L) "Spore coat-associated protein N" 5OF1 1 2 ligand "2-HYDROXYBENZOIC ACID" 5OF1 1 3 ligand ethane-1,2-diol 5OF1 1 4 ligand water # loop_ _pdbe_chain_remapping.source_coordinates _pdbe_chain_remapping.assembly_id _pdbe_chain_remapping.model_num _pdbe_chain_remapping.entity_id _pdbe_chain_remapping.orig_auth_asym_id _pdbe_chain_remapping.new_auth_asym_id _pdbe_chain_remapping.orig_label_asym_id _pdbe_chain_remapping.new_label_asym_id _pdbe_chain_remapping.applied_operations 5OF1 1 1 1 A A A A "_1" 5OF1 1 1 2 A C C C "_1" 5OF1 1 1 3 A D D D "_1" 5OF1 1 1 3 A E E E "_1" 5OF1 1 1 3 A F F F "_1" 5OF1 1 1 4 A H H H "_1" #