data_5mn0-assembly-1_atom_site # loop_ _atom_site.group_PDB _atom_site.id _atom_site.type_symbol _atom_site.label_atom_id _atom_site.label_alt_id _atom_site.label_comp_id _atom_site.label_asym_id _atom_site.label_entity_id _atom_site.label_seq_id _atom_site.pdbx_PDB_ins_code _atom_site.Cartn_x _atom_site.Cartn_y _atom_site.Cartn_z _atom_site.occupancy _atom_site.B_iso_or_equiv _atom_site.pdbx_formal_charge _atom_site.auth_seq_id _atom_site.auth_comp_id _atom_site.auth_asym_id _atom_site.auth_atom_id _atom_site.pdbx_PDB_model_num _atom_site.pdbe_label_seq_id _atom_site.orig_label_asym_id _atom_site.orig_auth_asym_id ATOM 1 N N . PRO A 1 21 ? 20.025 -8.386 49.340 1.0 91.85 ? 21 PRO A N 1 21 . A ATOM 2 C CA . PRO A 1 21 ? 19.129 -7.542 48.537 1.0 88.98 ? 21 PRO A CA 1 21 . A ATOM 3 C C . PRO A 1 21 ? 19.056 -6.095 49.046 1.0 94.91 ? 21 PRO A C 1 21 . A ATOM 4 O O . PRO A 1 21 ? 19.210 -5.875 50.252 1.0 91.27 ? 21 PRO A O 1 21 . A ATOM 5 C CB . PRO A 1 21 ? 17.773 -8.242 48.681 1.0 87.41 ? 21 PRO A CB 1 21 . A ATOM 6 C CG . PRO A 1 21 ? 17.847 -8.922 50.019 1.0 88.22 ? 21 PRO A CG 1 21 . A ATOM 7 C CD . PRO A 1 21 ? 19.286 -9.345 50.184 1.0 89.37 ? 21 PRO A CD 1 21 . A ATOM 8 N N . THR A 1 22 ? 18.819 -5.143 48.139 1.0 88.74 ? 22 THR A N 1 22 . A ATOM 9 C CA . THR A 1 22 ? 18.765 -3.718 48.444 1.0 88.91 ? 22 THR A CA 1 22 . A ATOM 10 C C . THR A 1 22 ? 17.325 -3.228 48.510 1.0 81.04 ? 22 THR A C 1 22 . A ATOM 11 O O . THR A 1 22 ? 16.464 -3.667 47.743 1.0 80.31 ? 22 THR A O 1 22 . A ATOM 12 C CB . THR A 1 22 ? 19.508 -2.896 47.387 1.0 91.79 ? 22 THR A CB 1 22 . A ATOM 13 O OG1 . THR A 1 22 ? 20.682 -3.599 46.963 1.0 106.94 ? 22 THR A OG1 1 22 . A ATOM 14 C CG2 . THR A 1 22 ? 19.905 -1.538 47.952 1.0 82.57 ? 22 THR A CG2 1 22 . A ATOM 15 N N . TYR A 1 23 ? 17.077 -2.278 49.407 1.0 65.65 ? 23 TYR A N 1 23 . A ATOM 16 C CA . TYR A 1 23 ? 15.737 -1.745 49.608 1.0 71.94 ? 23 TYR A CA 1 23 . A ATOM 17 C C . TYR A 1 23 ? 15.749 -0.224 49.525 1.0 72.67 ? 23 TYR A C 1 23 . A ATOM 18 O O . TYR A 1 23 ? 16.740 0.426 49.870 1.0 68.38 ? 23 TYR A O 1 23 . A ATOM 19 C CB . TYR A 1 23 ? 15.164 -2.206 50.961 1.0 74.03 ? 23 TYR A CB 1 23 . A ATOM 20 C CG . TYR A 1 23 ? 15.052 -3.710 51.070 1.0 78.73 ? 23 TYR A CG 1 23 . A ATOM 21 C CD1 . TYR A 1 23 ? 13.932 -4.378 50.590 1.0 81.34 ? 23 TYR A CD1 1 23 . A ATOM 22 C CD2 . TYR A 1 23 ? 16.071 -4.465 51.641 1.0 85.6 ? 23 TYR A CD2 1 23 . A ATOM 23 C CE1 . TYR A 1 23 ? 13.827 -5.757 50.676 1.0 82.38 ? 23 TYR A CE1 1 23 . A ATOM 24 C CE2 . TYR A 1 23 ? 15.978 -5.849 51.730 1.0 85.17 ? 23 TYR A CE2 1 23 . A ATOM 25 C CZ . TYR A 1 23 ? 14.853 -6.489 51.245 1.0 86.23 ? 23 TYR A CZ 1 23 . A ATOM 26 O OH . TYR A 1 23 ? 14.756 -7.863 51.331 1.0 89.74 ? 23 TYR A OH 1 23 . A ATOM 27 N N . THR A 1 24 ? 14.640 0.339 49.044 1.0 66.57 ? 24 THR A N 1 24 . A ATOM 28 C CA . THR A 1 24 ? 14.471 1.784 49.058 1.0 63.48 ? 24 THR A CA 1 24 . A ATOM 29 C C . THR A 1 24 ? 14.524 2.298 50.492 1.0 72.87 ? 24 THR A C 1 24 . A ATOM 30 O O . THR A 1 24 ? 14.405 1.535 51.449 1.0 66.67 ? 24 THR A O 1 24 . A ATOM 31 C CB . THR A 1 24 ? 13.139 2.175 48.425 1.0 60.24 ? 24 THR A CB 1 24 . A ATOM 32 O OG1 . THR A 1 24 ? 12.078 1.505 49.118 1.0 54.36 ? 24 THR A OG1 1 24 . A ATOM 33 C CG2 . THR A 1 24 ? 13.116 1.808 46.934 1.0 61.68 ? 24 THR A CG2 1 24 . A ATOM 34 N N . THR A 1 25 ? 14.704 3.609 50.636 1.0 70.96 ? 25 THR A N 1 25 . A ATOM 35 C CA . THR A 1 25 ? 14.766 4.247 51.954 1.0 61.48 ? 25 THR A CA 1 25 . A ATOM 36 C C . THR A 1 25 ? 14.046 5.586 51.916 1.0 57.18 ? 25 THR A C 1 25 . A ATOM 37 O O . THR A 1 25 ? 14.563 6.616 52.353 1.0 59.69 ? 25 THR A O 1 25 . A ATOM 38 C CB . THR A 1 25 ? 16.199 4.456 52.439 1.0 69.61 ? 25 THR A CB 1 25 . A ATOM 39 O OG1 . THR A 1 25 ? 16.900 5.294 51.509 1.0 73.45 ? 25 THR A OG1 1 25 . A ATOM 40 C CG2 . THR A 1 25 ? 16.938 3.120 52.618 1.0 75.44 ? 25 THR A CG2 1 25 . A ATOM 41 N N . HIS A 1 26 ? 12.826 5.579 51.390 1.0 56.43 ? 26 HIS A N 1 26 . A ATOM 42 C CA . HIS A 1 26 ? 12.039 6.800 51.367 1.0 56.74 ? 26 HIS A CA 1 26 . A ATOM 43 C C . HIS A 1 26 ? 11.655 7.281 52.764 1.0 71.49 ? 26 HIS A C 1 26 . A ATOM 44 O O . HIS A 1 26 ? 11.180 8.411 52.896 1.0 86.08 ? 26 HIS A O 1 26 . A ATOM 45 C CB . HIS A 1 26 ? 10.808 6.577 50.489 1.0 47.86 ? 26 HIS A CB 1 26 . A ATOM 46 C CG . HIS A 1 26 ? 11.155 6.217 49.077 1.0 55.66 ? 26 HIS A CG 1 26 . A ATOM 47 N ND1 . HIS A 1 26 ? 12.226 6.777 48.413 1.0 57.74 ? 26 HIS A ND1 1 26 . A ATOM 48 C CD2 . HIS A 1 26 ? 10.601 5.330 48.217 1.0 58.88 ? 26 HIS A CD2 1 26 . A ATOM 49 C CE1 . HIS A 1 26 ? 12.305 6.266 47.196 1.0 59.74 ? 26 HIS A CE1 1 26 . A ATOM 50 N NE2 . HIS A 1 26 ? 11.330 5.387 47.051 1.0 60.58 ? 26 HIS A NE2 1 26 . A ATOM 51 N N . HIS A 1 27 ? 11.868 6.471 53.807 1.0 76.47 ? 27 HIS A N 1 27 . A ATOM 52 C CA . HIS A 1 27 ? 11.550 6.889 55.171 1.0 73.3 ? 27 HIS A CA 1 27 . A ATOM 53 C C . HIS A 1 27 ? 12.577 7.849 55.756 1.0 70.7 ? 27 HIS A C 1 27 . A ATOM 54 O O . HIS A 1 27 ? 12.318 8.435 56.811 1.0 74.14 ? 27 HIS A O 1 27 . A ATOM 55 C CB . HIS A 1 27 ? 11.414 5.669 56.097 1.0 72.76 ? 27 HIS A CB 1 27 . A ATOM 56 C CG . HIS A 1 27 ? 12.686 4.897 56.280 1.0 65.89 ? 27 HIS A CG 1 27 . A ATOM 57 N ND1 . HIS A 1 27 ? 13.112 3.940 55.383 1.0 70.31 ? 27 HIS A ND1 1 27 . A ATOM 58 C CD2 . HIS A 1 27 ? 13.625 4.943 57.255 1.0 68.36 ? 27 HIS A CD2 1 27 . A ATOM 59 C CE1 . HIS A 1 27 ? 14.254 3.424 55.803 1.0 71.75 ? 27 HIS A CE1 1 27 . A ATOM 60 N NE2 . HIS A 1 27 ? 14.588 4.017 56.936 1.0 63.63 ? 27 HIS A NE2 1 27 . A ATOM 61 N N . LEU A 1 28 ? 13.724 8.028 55.108 1.0 62.51 ? 28 LEU A N 1 28 . A ATOM 62 C CA . LEU A 1 28 ? 14.779 8.872 55.647 1.0 62.56 ? 28 LEU A CA 1 28 . A ATOM 63 C C . LEU A 1 28 ? 14.627 10.344 55.288 1.0 63.11 ? 28 LEU A C 1 28 . A ATOM 64 O O . LEU A 1 28 ? 15.389 11.172 55.800 1.0 65.67 ? 28 LEU A O 1 28 . A ATOM 65 C CB . LEU A 1 28 ? 16.146 8.391 55.160 1.0 58.6 ? 28 LEU A CB 1 28 . A ATOM 66 C CG . LEU A 1 28 ? 16.577 6.978 55.522 1.0 70.31 ? 28 LEU A CG 1 28 . A ATOM 67 C CD1 . LEU A 1 28 ? 17.934 6.676 54.898 1.0 75.31 ? 28 LEU A CD1 1 28 . A ATOM 68 C CD2 . LEU A 1 28 ? 16.616 6.790 57.032 1.0 67.2 ? 28 LEU A CD2 1 28 . A ATOM 69 N N . ALA A 1 29 ? 13.691 10.699 54.416 1.0 66.58 ? 29 ALA A N 1 29 . A ATOM 70 C CA . ALA A 1 29 ? 13.519 12.091 54.019 1.0 69.08 ? 29 ALA A CA 1 29 . A ATOM 71 C C . ALA A 1 29 ? 12.041 12.448 54.016 1.0 67.95 ? 29 ALA A C 1 29 . A ATOM 72 O O . ALA A 1 29 ? 11.226 11.725 53.429 1.0 63.66 ? 29 ALA A O 1 29 . A ATOM 73 C CB . ALA A 1 29 ? 14.134 12.352 52.645 1.0 49.98 ? 29 ALA A CB 1 29 . A ATOM 74 N N . ILE A 1 30 ? 11.700 13.549 54.681 1.0 61.36 ? 30 ILE A N 1 30 . A ATOM 75 C CA . ILE A 1 30 ? 10.330 14.062 54.596 1.0 68.25 ? 30 ILE A CA 1 30 . A ATOM 76 C C . ILE A 1 30 ? 10.038 14.408 53.142 1.0 59.1 ? 30 ILE A C 1 30 . A ATOM 77 O O . ILE A 1 30 ? 10.846 15.115 52.513 1.0 52.62 ? 30 ILE A O 1 30 . A ATOM 78 C CB . ILE A 1 30 ? 10.155 15.304 55.494 1.0 59.37 ? 30 ILE A CB 1 30 . A ATOM 79 C CG1 . ILE A 1 30 ? 10.556 14.997 56.934 1.0 72.92 ? 30 ILE A CG1 1 30 . A ATOM 80 C CG2 . ILE A 1 30 ? 8.720 15.803 55.435 1.0 58.19 ? 30 ILE A CG2 1 30 . A ATOM 81 C CD1 . ILE A 1 30 ? 10.400 16.181 57.867 1.0 73.85 ? 30 ILE A CD1 1 30 . A ATOM 82 N N . PRO A 1 31 ? 8.940 13.940 52.555 1.0 58.99 ? 31 PRO A N 1 31 . A ATOM 83 C CA . PRO A 1 31 ? 8.624 14.338 51.178 1.0 59.58 ? 31 PRO A CA 1 31 . A ATOM 84 C C . PRO A 1 31 ? 8.077 15.752 51.124 1.0 57.56 ? 31 PRO A C 1 31 . A ATOM 85 O O . PRO A 1 31 ? 7.492 16.262 52.085 1.0 50.87 ? 31 PRO A O 1 31 . A ATOM 86 C CB . PRO A 1 31 ? 7.570 13.317 50.729 1.0 46.74 ? 31 PRO A CB 1 31 . A ATOM 87 C CG . PRO A 1 31 ? 6.997 12.759 51.957 1.0 67.26 ? 31 PRO A CG 1 31 . A ATOM 88 C CD . PRO A 1 31 ? 7.976 12.966 53.096 1.0 64.57 ? 31 PRO A CD 1 31 . A ATOM 89 N N . SER A 1 32 ? 8.298 16.393 49.978 1.0 55.63 ? 32 SER A N 1 32 . A ATOM 90 C CA . SER A 1 32 ? 7.762 17.724 49.758 1.0 47.26 ? 32 SER A CA 1 32 . A ATOM 91 C C . SER A 1 32 ? 6.256 17.721 50.001 1.0 48.67 ? 32 SER A C 1 32 . A ATOM 92 O O . SER A 1 32 ? 5.556 16.777 49.629 1.0 49.41 ? 32 SER A O 1 32 . A ATOM 93 C CB . SER A 1 32 ? 8.083 18.177 48.327 1.0 47.6 ? 32 SER A CB 1 32 . A ATOM 94 O OG . SER A 1 32 ? 7.529 19.453 48.051 1.0 59.79 ? 32 SER A OG 1 32 . A ATOM 95 N N . GLY A 1 33 ? 5.761 18.766 50.653 1.0 50.27 ? 33 GLY A N 1 33 . A ATOM 96 C CA . GLY A 1 33 ? 4.340 18.912 50.885 1.0 54.39 ? 33 GLY A CA 1 33 . A ATOM 97 C C . GLY A 1 33 ? 3.833 18.407 52.225 1.0 59.12 ? 33 GLY A C 1 33 . A ATOM 98 O O . GLY A 1 33 ? 2.671 18.669 52.551 1.0 68.11 ? 33 GLY A O 1 33 . A ATOM 99 N N . VAL A 1 34 ? 4.649 17.697 53.013 1.0 54.96 ? 34 VAL A N 1 34 . A ATOM 100 C CA . VAL A 1 34 ? 4.196 17.210 54.314 1.0 56.0 ? 34 VAL A CA 1 34 . A ATOM 101 C C . VAL A 1 34 ? 5.021 17.848 55.424 1.0 51.85 ? 34 VAL A C 1 34 . A ATOM 102 O O . VAL A 1 34 ? 6.196 18.184 55.248 1.0 51.57 ? 34 VAL A O 1 34 . A ATOM 103 C CB . VAL A 1 34 ? 4.246 15.669 54.446 1.0 65.16 ? 34 VAL A CB 1 34 . A ATOM 104 C CG1 . VAL A 1 34 ? 3.720 14.995 53.194 1.0 49.81 ? 34 VAL A CG1 1 34 . A ATOM 105 C CG2 . VAL A 1 34 ? 5.650 15.190 54.820 1.0 62.81 ? 34 VAL A CG2 1 34 . A ATOM 106 N N . THR A 1 35 ? 4.398 17.993 56.586 1.0 49.44 ? 35 THR A N 1 35 . A ATOM 107 C CA . THR A 1 35 ? 5.053 18.611 57.730 1.0 54.58 ? 35 THR A CA 1 35 . A ATOM 108 C C . THR A 1 35 ? 5.806 17.568 58.551 1.0 62.12 ? 35 THR A C 1 35 . A ATOM 109 O O . THR A 1 35 ? 5.558 16.361 58.455 1.0 57.74 ? 35 THR A O 1 35 . A ATOM 110 C CB . THR A 1 35 ? 4.026 19.325 58.608 1.0 56.79 ? 35 THR A CB 1 35 . A ATOM 111 O OG1 . THR A 1 35 ? 3.213 18.354 59.275 1.0 57.02 ? 35 THR A OG1 1 35 . A ATOM 112 C CG2 . THR A 1 35 ? 3.124 20.199 57.737 1.0 55.12 ? 35 THR A CG2 1 35 . A ATOM 113 N N . GLN A 1 36 ? 6.749 18.052 59.364 1.0 69.47 ? 36 GLN A N 1 36 . A ATOM 114 C CA . GLN A 1 36 ? 7.469 17.160 60.269 1.0 73.2 ? 36 GLN A CA 1 36 . A ATOM 115 C C . GLN A 1 36 ? 6.503 16.366 61.141 1.0 68.75 ? 36 GLN A C 1 36 . A ATOM 116 O O . GLN A 1 36 ? 6.676 15.155 61.325 1.0 59.96 ? 36 GLN A O 1 36 . A ATOM 117 C CB . GLN A 1 36 ? 8.438 17.952 61.150 1.0 82.02 ? 36 GLN A CB 1 36 . A ATOM 118 C CG . GLN A 1 36 ? 9.433 17.084 61.925 1.0 85.3 ? 36 GLN A CG 1 36 . A ATOM 119 C CD . GLN A 1 36 ? 10.721 16.820 61.152 1.0 99.82 ? 36 GLN A CD 1 36 . A ATOM 120 O OE1 . GLN A 1 36 ? 11.207 17.679 60.410 1.0 99.9 ? 36 GLN A OE1 1 36 . A ATOM 121 N NE2 . GLN A 1 36 ? 11.281 15.629 61.327 1.0 105.41 ? 36 GLN A NE2 1 36 . A ATOM 122 N N . ASP A 1 37 ? 5.478 17.030 61.685 1.0 72.15 ? 37 ASP A N 1 37 . A ATOM 123 C CA . ASP A 1 37 ? 4.521 16.341 62.549 1.0 78.12 ? 37 ASP A CA 1 37 . A ATOM 124 C C . ASP A 1 37 ? 3.752 15.273 61.777 1.0 70.54 ? 37 ASP A C 1 37 . A ATOM 125 O O . ASP A 1 37 ? 3.626 14.133 62.237 1.0 65.87 ? 37 ASP A O 1 37 . A ATOM 126 C CB . ASP A 1 37 ? 3.556 17.346 63.182 1.0 79.73 ? 37 ASP A CB 1 37 . A ATOM 127 C CG . ASP A 1 37 ? 4.186 18.128 64.324 1.0 91.28 ? 37 ASP A CG 1 37 . A ATOM 128 O OD1 . ASP A 1 37 ? 3.633 19.189 64.689 1.0 94.68 ? 37 ASP A OD1 1 37 . A ATOM 129 O OD2 . ASP A 1 37 ? 5.227 17.684 64.860 1.0 91.77 ? 37 ASP A OD2 1 37 . A ATOM 130 N N . GLU A 1 38 ? 3.210 15.628 60.610 1.0 67.16 ? 38 GLU A N 1 38 . A ATOM 131 C CA . GLU A 1 38 ? 2.540 14.624 59.787 1.0 62.9 ? 38 GLU A CA 1 38 . A ATOM 132 C C . GLU A 1 38 ? 3.475 13.462 59.472 1.0 62.82 ? 38 GLU A C 1 38 . A ATOM 133 O O . GLU A 1 38 ? 3.045 12.301 59.465 1.0 54.08 ? 38 GLU A O 1 38 . A ATOM 134 C CB . GLU A 1 38 ? 2.014 15.267 58.497 1.0 53.85 ? 38 GLU A CB 1 38 . A ATOM 135 C CG . GLU A 1 38 ? 0.942 16.328 58.748 1.0 71.78 ? 38 GLU A CG 1 38 . A ATOM 136 C CD . GLU A 1 38 ? 0.680 17.212 57.543 1.0 73.65 ? 38 GLU A CD 1 38 . A ATOM 137 O OE1 . GLU A 1 38 ? 1.616 17.418 56.743 1.0 65.32 ? 38 GLU A OE1 1 38 . A ATOM 138 O OE2 . GLU A 1 38 ? -0.461 17.704 57.408 1.0 85.25 ? 38 GLU A OE2 1 38 . A ATOM 139 N N . PHE A 1 39 ? 4.761 13.748 59.252 1.0 60.34 ? 39 PHE A N 1 39 . A ATOM 140 C CA . PHE A 1 39 ? 5.715 12.705 58.901 1.0 64.64 ? 39 PHE A CA 1 39 . A ATOM 141 C C . PHE A 1 39 ? 6.128 11.833 60.081 1.0 63.25 ? 39 PHE A C 1 39 . A ATOM 142 O O . PHE A 1 39 ? 6.595 10.711 59.863 1.0 61.73 ? 39 PHE A O 1 39 . A ATOM 143 C CB . PHE A 1 39 ? 6.969 13.310 58.259 1.0 70.18 ? 39 PHE A CB 1 39 . A ATOM 144 C CG . PHE A 1 39 ? 7.811 12.303 57.525 1.0 69.09 ? 39 PHE A CG 1 39 . A ATOM 145 C CD1 . PHE A 1 39 ? 7.240 11.473 56.571 1.0 62.61 ? 39 PHE A CD1 1 39 . A ATOM 146 C CD2 . PHE A 1 39 ? 9.171 12.186 57.779 1.0 69.23 ? 39 PHE A CD2 1 39 . A ATOM 147 C CE1 . PHE A 1 39 ? 8.003 10.534 55.882 1.0 56.0 ? 39 PHE A CE1 1 39 . A ATOM 148 C CE2 . PHE A 1 39 ? 9.946 11.250 57.095 1.0 73.32 ? 39 PHE A CE2 1 39 . A ATOM 149 C CZ . PHE A 1 39 ? 9.359 10.425 56.136 1.0 62.32 ? 39 PHE A CZ 1 39 . A ATOM 150 N N . ASP A 1 40 ? 5.991 12.301 61.324 1.0 61.07 ? 40 ASP A N 1 40 . A ATOM 151 C CA . ASP A 1 40 ? 6.188 11.376 62.435 1.0 71.42 ? 40 ASP A CA 1 40 . A ATOM 152 C C . ASP A 1 40 ? 5.251 10.182 62.291 1.0 74.2 ? 40 ASP A C 1 40 . A ATOM 153 O O . ASP A 1 40 ? 5.642 9.029 62.517 1.0 71.52 ? 40 ASP A O 1 40 . A ATOM 154 C CB . ASP A 1 40 ? 5.968 12.080 63.776 1.0 72.22 ? 40 ASP A CB 1 40 . A ATOM 155 C CG . ASP A 1 40 ? 7.022 13.126 64.067 1.0 81.03 ? 40 ASP A CG 1 40 . A ATOM 156 O OD1 . ASP A 1 40 ? 8.179 12.966 63.617 1.0 79.7 ? 40 ASP A OD1 1 40 . A ATOM 157 O OD2 . ASP A 1 40 ? 6.689 14.115 64.755 1.0 93.95 ? 40 ASP A OD2 1 40 . A ATOM 158 N N . GLU A 1 41 ? 4.008 10.447 61.884 1.0 68.05 ? 41 GLU A N 1 41 . A ATOM 159 C CA . GLU A 1 41 ? 3.046 9.380 61.636 1.0 66.24 ? 41 GLU A CA 1 41 . A ATOM 160 C C . GLU A 1 41 ? 3.267 8.737 60.264 1.0 74.34 ? 41 GLU A C 1 41 . A ATOM 161 O O . GLU A 1 41 ? 3.272 7.508 60.138 1.0 73.52 ? 41 GLU A O 1 41 . A ATOM 162 C CB . GLU A 1 41 ? 1.625 9.934 61.764 1.0 65.13 ? 41 GLU A CB 1 41 . A ATOM 163 C CG . GLU A 1 41 ? 0.525 8.937 61.457 1.0 85.25 ? 41 GLU A CG 1 41 . A ATOM 164 C CD . GLU A 1 41 ? -0.856 9.473 61.785 1.0 92.2 ? 41 GLU A CD 1 41 . A ATOM 165 O OE1 . GLU A 1 41 ? -1.848 8.896 61.291 1.0 105.0 ? 41 GLU A OE1 1 41 . A ATOM 166 O OE2 . GLU A 1 41 ? -0.951 10.468 62.535 1.0 83.61 ? 41 GLU A OE2 1 41 . A ATOM 167 N N . LEU A 1 42 ? 3.476 9.548 59.223 1.0 72.52 ? 42 LEU A N 1 42 . A ATOM 168 C CA . LEU A 1 42 ? 3.523 9.000 57.871 1.0 66.24 ? 42 LEU A CA 1 42 . A ATOM 169 C C . LEU A 1 42 ? 4.778 8.167 57.637 1.0 67.13 ? 42 LEU A C 1 42 . A ATOM 170 O O . LEU A 1 42 ? 4.753 7.206 56.857 1.0 64.25 ? 42 LEU A O 1 42 . A ATOM 171 C CB . LEU A 1 42 ? 3.420 10.133 56.852 1.0 70.28 ? 42 LEU A CB 1 42 . A ATOM 172 C CG . LEU A 1 42 ? 2.014 10.734 56.781 1.0 68.37 ? 42 LEU A CG 1 42 . A ATOM 173 C CD1 . LEU A 1 42 ? 1.949 11.910 55.811 1.0 64.66 ? 42 LEU A CD1 1 42 . A ATOM 174 C CD2 . LEU A 1 42 ? 1.000 9.647 56.402 1.0 68.64 ? 42 LEU A CD2 1 42 . A ATOM 175 N N . LYS A 1 43 ? 5.876 8.507 58.307 1.0 72.56 ? 43 LYS A N 1 43 . A ATOM 176 C CA . LYS A 1 43 ? 7.102 7.731 58.164 1.0 75.89 ? 43 LYS A CA 1 43 . A ATOM 177 C C . LYS A 1 43 ? 6.877 6.240 58.386 1.0 73.61 ? 43 LYS A C 1 43 . A ATOM 178 O O . LYS A 1 43 ? 7.554 5.411 57.764 1.0 68.06 ? 43 LYS A O 1 43 . A ATOM 179 C CB . LYS A 1 43 ? 8.149 8.249 59.143 1.0 83.78 ? 43 LYS A CB 1 43 . A ATOM 180 C CG . LYS A 1 43 ? 9.506 7.613 58.971 1.0 82.57 ? 43 LYS A CG 1 43 . A ATOM 181 C CD . LYS A 1 43 ? 10.473 8.183 59.987 1.0 81.26 ? 43 LYS A CD 1 43 . A ATOM 182 C CE . LYS A 1 43 ? 11.048 7.096 60.855 1.0 94.9 ? 43 LYS A CE 1 43 . A ATOM 183 N NZ . LYS A 1 43 ? 10.040 6.526 61.804 1.0 95.62 ? 43 LYS A NZ 1 43 . A ATOM 184 N N . GLN A 1 44 ? 5.939 5.878 59.270 1.0 68.4 ? 44 GLN A N 1 44 . A ATOM 185 C CA . GLN A 1 44 ? 5.708 4.469 59.575 1.0 75.95 ? 44 GLN A CA 1 44 . A ATOM 186 C C . GLN A 1 44 ? 5.055 3.737 58.407 1.0 71.22 ? 44 GLN A C 1 44 . A ATOM 187 O O . GLN A 1 44 ? 5.346 2.556 58.178 1.0 72.74 ? 44 GLN A O 1 44 . A ATOM 188 C CB . GLN A 1 44 ? 4.839 4.334 60.827 1.0 71.36 ? 44 GLN A CB 1 44 . A ATOM 189 C CG . GLN A 1 44 ? 5.257 5.236 61.972 1.0 81.76 ? 44 GLN A CG 1 44 . A ATOM 190 C CD . GLN A 1 44 ? 4.552 4.907 63.288 1.0 88.34 ? 44 GLN A CD 1 44 . A ATOM 191 O OE1 . GLN A 1 44 ? 4.144 5.807 64.029 1.0 87.3 ? 44 GLN A OE1 1 44 . A ATOM 192 N NE2 . GLN A 1 44 ? 4.416 3.618 63.585 1.0 84.87 ? 44 GLN A NE2 1 44 . A ATOM 193 N N . SER A 1 45 ? 4.156 4.407 57.679 1.0 72.75 ? 45 SER A N 1 45 . A ATOM 194 C CA . SER A 1 45 ? 3.512 3.785 56.523 1.0 72.11 ? 45 SER A CA 1 45 . A ATOM 195 C C . SER A 1 45 ? 4.454 3.690 55.334 1.0 47.37 ? 45 SER A C 1 45 . A ATOM 196 O O . SER A 1 45 ? 4.394 2.714 54.587 1.0 55.67 ? 45 SER A O 1 45 . A ATOM 197 C CB . SER A 1 45 ? 2.253 4.556 56.141 1.0 73.5 ? 45 SER A CB 1 45 . A ATOM 198 O OG . SER A 1 45 ? 1.430 4.743 57.279 1.0 90.48 ? 45 SER A OG 1 45 . A ATOM 199 N N . VAL A 1 46 ? 5.332 4.679 55.154 1.0 51.6 ? 46 VAL A N 1 46 . A ATOM 200 C CA . VAL A 1 46 ? 6.413 4.555 54.175 1.0 56.46 ? 46 VAL A CA 1 46 . A ATOM 201 C C . VAL A 1 46 ? 7.156 3.240 54.376 1.0 68.8 ? 46 VAL A C 1 46 . A ATOM 202 O O . VAL A 1 46 ? 7.358 2.463 53.435 1.0 62.6 ? 46 VAL A O 1 46 . A ATOM 203 C CB . VAL A 1 46 ? 7.363 5.763 54.274 1.0 55.7 ? 46 VAL A CB 1 46 . A ATOM 204 C CG1 . VAL A 1 46 ? 8.574 5.577 53.361 1.0 47.16 ? 46 VAL A CG1 1 46 . A ATOM 205 C CG2 . VAL A 1 46 ? 6.624 7.051 53.925 1.0 50.92 ? 46 VAL A CG2 1 46 . A ATOM 206 N N . VAL A 1 47 ? 7.580 2.973 55.614 1.0 71.5 ? 47 VAL A N 1 47 . A ATOM 207 C CA . VAL A 1 47 ? 8.221 1.698 55.919 1.0 63.51 ? 47 VAL A CA 1 47 . A ATOM 208 C C . VAL A 1 47 ? 7.285 0.546 55.578 1.0 66.74 ? 47 VAL A C 1 47 . A ATOM 209 O O . VAL A 1 47 ? 7.695 -0.447 54.965 1.0 66.03 ? 47 VAL A O 1 47 . A ATOM 210 C CB . VAL A 1 47 ? 8.661 1.665 57.398 1.0 68.37 ? 47 VAL A CB 1 47 . A ATOM 211 C CG1 . VAL A 1 47 ? 9.253 0.305 57.759 1.0 64.66 ? 47 VAL A CG1 1 47 . A ATOM 212 C CG2 . VAL A 1 47 ? 9.659 2.800 57.684 1.0 59.22 ? 47 VAL A CG2 1 47 . A ATOM 213 N N . GLU A 1 48 ? 6.005 0.677 55.929 1.0 70.63 ? 48 GLU A N 1 48 . A ATOM 214 C CA . GLU A 1 48 ? 5.089 -0.449 55.786 1.0 69.55 ? 48 GLU A CA 1 48 . A ATOM 215 C C . GLU A 1 48 ? 4.726 -0.729 54.332 1.0 64.19 ? 48 GLU A C 1 48 . A ATOM 216 O O . GLU A 1 48 ? 4.716 -1.892 53.919 1.0 59.55 ? 48 GLU A O 1 48 . A ATOM 217 C CB . GLU A 1 48 ? 3.824 -0.206 56.606 1.0 73.33 ? 48 GLU A CB 1 48 . A ATOM 218 C CG . GLU A 1 48 ? 2.935 -1.434 56.701 1.0 88.14 ? 48 GLU A CG 1 48 . A ATOM 219 C CD . GLU A 1 48 ? 1.798 -1.248 57.681 1.0 91.3 ? 48 GLU A CD 1 48 . A ATOM 220 O OE1 . GLU A 1 48 ? 1.663 -0.129 58.231 1.0 91.27 ? 48 GLU A OE1 1 48 . A ATOM 221 O OE2 . GLU A 1 48 ? 1.038 -2.218 57.895 1.0 94.07 ? 48 GLU A OE2 1 48 . A ATOM 222 N N . PHE A 1 49 ? 4.413 0.312 53.543 1.0 71.29 ? 49 PHE A N 1 49 . A ATOM 223 C CA . PHE A 1 49 ? 3.850 0.139 52.203 1.0 69.99 ? 49 PHE A CA 1 49 . A ATOM 224 C C . PHE A 1 49 ? 4.720 0.660 51.067 1.0 61.56 ? 49 PHE A C 1 49 . A ATOM 225 O O . PHE A 1 49 ? 4.582 0.182 49.944 1.0 56.47 ? 49 PHE A O 1 49 . A ATOM 226 C CB . PHE A 1 49 ? 2.496 0.853 52.085 1.0 72.82 ? 49 PHE A CB 1 49 . A ATOM 227 C CG . PHE A 1 49 ? 1.571 0.584 53.213 1.0 67.04 ? 49 PHE A CG 1 49 . A ATOM 228 C CD1 . PHE A 1 49 ? 1.277 -0.712 53.580 1.0 66.19 ? 49 PHE A CD1 1 49 . A ATOM 229 C CD2 . PHE A 1 49 ? 1.005 1.637 53.925 1.0 72.5 ? 49 PHE A CD2 1 49 . A ATOM 230 C CE1 . PHE A 1 49 ? 0.424 -0.968 54.632 1.0 68.2 ? 49 PHE A CE1 1 49 . A ATOM 231 C CE2 . PHE A 1 49 ? 0.149 1.393 54.976 1.0 78.82 ? 49 PHE A CE2 1 49 . A ATOM 232 C CZ . PHE A 1 49 ? -0.145 0.085 55.330 1.0 75.74 ? 49 PHE A CZ 1 49 . A ATOM 233 N N . HIS A 1 50 ? 5.567 1.654 51.316 1.0 60.73 ? 50 HIS A N 1 50 . A ATOM 234 C CA . HIS A 1 50 ? 6.354 2.266 50.260 1.0 47.47 ? 50 HIS A CA 1 50 . A ATOM 235 C C . HIS A 1 50 ? 7.823 1.907 50.409 1.0 53.88 ? 50 HIS A C 1 50 . A ATOM 236 O O . HIS A 1 50 ? 8.703 2.769 50.360 1.0 55.56 ? 50 HIS A O 1 50 . A ATOM 237 C CB . HIS A 1 50 ? 6.121 3.777 50.268 1.0 45.87 ? 50 HIS A CB 1 50 . A ATOM 238 C CG . HIS A 1 50 ? 4.670 4.136 50.232 1.0 45.05 ? 50 HIS A CG 1 50 . A ATOM 239 N ND1 . HIS A 1 50 ? 3.969 4.291 49.057 1.0 53.02 ? 50 HIS A ND1 1 50 . A ATOM 240 C CD2 . HIS A 1 50 ? 3.773 4.312 51.228 1.0 46.32 ? 50 HIS A CD2 1 50 . A ATOM 241 C CE1 . HIS A 1 50 ? 2.706 4.565 49.330 1.0 50.95 ? 50 HIS A CE1 1 50 . A ATOM 242 N NE2 . HIS A 1 50 ? 2.561 4.586 50.643 1.0 51.47 ? 50 HIS A NE2 1 50 . A ATOM 243 N N . THR A 1 51 ? 8.091 0.625 50.607 1.0 60.73 ? 51 THR A N 1 51 . A ATOM 244 C CA . THR A 1 51 ? 9.441 0.088 50.574 1.0 68.1 ? 51 THR A CA 1 51 . A ATOM 245 C C . THR A 1 51 ? 9.488 -0.964 49.474 1.0 71.24 ? 51 THR A C 1 51 . A ATOM 246 O O . THR A 1 51 ? 8.564 -1.773 49.339 1.0 68.99 ? 51 THR A O 1 51 . A ATOM 247 C CB . THR A 1 51 ? 9.838 -0.502 51.933 1.0 77.32 ? 51 THR A CB 1 51 . A ATOM 248 O OG1 . THR A 1 51 ? 9.642 0.489 52.950 1.0 77.47 ? 51 THR A OG1 1 51 . A ATOM 249 C CG2 . THR A 1 51 ? 11.306 -0.926 51.930 1.0 67.08 ? 51 THR A CG2 1 51 . A ATOM 250 N N . TYR A 1 52 ? 10.535 -0.925 48.664 1.0 57.95 ? 52 TYR A N 1 52 . A ATOM 251 C CA . TYR A 1 52 ? 10.672 -1.832 47.541 1.0 58.64 ? 52 TYR A CA 1 52 . A ATOM 252 C C . TYR A 1 52 ? 12.053 -2.456 47.552 1.0 58.27 ? 52 TYR A C 1 52 . A ATOM 253 O O . TYR A 1 52 ? 13.030 -1.845 47.995 1.0 64.4 ? 52 TYR A O 1 52 . A ATOM 254 C CB . TYR A 1 52 ? 10.472 -1.119 46.186 1.0 53.95 ? 52 TYR A CB 1 52 . A ATOM 255 C CG . TYR A 1 52 ? 9.144 -0.435 45.999 1.0 53.31 ? 52 TYR A CG 1 52 . A ATOM 256 C CD1 . TYR A 1 52 ? 8.100 -1.069 45.341 1.0 50.22 ? 52 TYR A CD1 1 52 . A ATOM 257 C CD2 . TYR A 1 52 ? 8.943 0.865 46.455 1.0 55.55 ? 52 TYR A CD2 1 52 . A ATOM 258 C CE1 . TYR A 1 52 ? 6.887 -0.432 45.149 1.0 64.04 ? 52 TYR A CE1 1 52 . A ATOM 259 C CE2 . TYR A 1 52 ? 7.736 1.507 46.271 1.0 61.61 ? 52 TYR A CE2 1 52 . A ATOM 260 C CZ . TYR A 1 52 ? 6.711 0.857 45.609 1.0 53.11 ? 52 TYR A CZ 1 52 . A ATOM 261 O OH . TYR A 1 52 ? 5.504 1.492 45.422 1.0 47.01 ? 52 TYR A OH 1 52 . A ATOM 262 N N . GLN A 1 53 ? 12.127 -3.672 47.037 1.0 62.49 ? 53 GLN A N 1 53 . A ATOM 263 C CA . GLN A 1 53 ? 13.403 -4.320 46.795 1.0 70.22 ? 53 GLN A CA 1 53 . A ATOM 264 C C . GLN A 1 53 ? 13.928 -3.850 45.445 1.0 71.48 ? 53 GLN A C 1 53 . A ATOM 265 O O . GLN A 1 53 ? 13.245 -3.985 44.426 1.0 83.44 ? 53 GLN A O 1 53 . A ATOM 266 C CB . GLN A 1 53 ? 13.247 -5.834 46.831 1.0 70.7 ? 53 GLN A CB 1 53 . A ATOM 267 C CG . GLN A 1 53 ? 14.553 -6.566 46.950 1.0 73.99 ? 53 GLN A CG 1 53 . A ATOM 268 C CD . GLN A 1 53 ? 14.350 -8.045 47.167 1.0 82.02 ? 53 GLN A CD 1 53 . A ATOM 269 O OE1 . GLN A 1 53 ? 13.450 -8.455 47.901 1.0 84.34 ? 53 GLN A OE1 1 53 . A ATOM 270 N NE2 . GLN A 1 53 ? 15.176 -8.857 46.520 1.0 89.77 ? 53 GLN A NE2 1 53 . A ATOM 271 N N . LEU A 1 54 ? 15.130 -3.287 45.443 1.0 70.14 ? 54 LEU A N 1 54 . A ATOM 272 C CA . LEU A 1 54 ? 15.739 -2.730 44.245 1.0 74.63 ? 54 LEU A CA 1 54 . A ATOM 273 C C . LEU A 1 54 ? 16.645 -3.753 43.576 1.0 81.47 ? 54 LEU A C 1 54 . A ATOM 274 O O . LEU A 1 54 ? 17.285 -4.576 44.238 1.0 95.41 ? 54 LEU A O 1 54 . A ATOM 275 C CB . LEU A 1 54 ? 16.544 -1.466 44.569 1.0 74.56 ? 54 LEU A CB 1 54 . A ATOM 276 C CG . LEU A 1 54 ? 15.794 -0.197 44.995 1.0 71.42 ? 54 LEU A CG 1 54 . A ATOM 277 C CD1 . LEU A 1 54 ? 16.770 0.903 45.366 1.0 74.72 ? 54 LEU A CD1 1 54 . A ATOM 278 C CD2 . LEU A 1 54 ? 14.856 0.302 43.911 1.0 57.72 ? 54 LEU A CD2 1 54 . A ATOM 279 N N . SER A 1 55 ? 16.687 -3.690 42.250 1.0 72.54 ? 55 SER A N 1 55 . A ATOM 280 C CA . SER A 1 55 ? 17.504 -4.595 41.462 1.0 84.17 ? 55 SER A CA 1 55 . A ATOM 281 C C . SER A 1 55 ? 17.866 -3.893 40.165 1.0 98.95 ? 55 SER A C 1 55 . A ATOM 282 O O . SER A 1 55 ? 17.325 -2.832 39.838 1.0 113.85 ? 55 SER A O 1 55 . A ATOM 283 C CB . SER A 1 55 ? 16.773 -5.914 41.188 1.0 85.68 ? 55 SER A CB 1 55 . A ATOM 284 O OG . SER A 1 55 ? 15.538 -5.693 40.527 1.0 85.4 ? 55 SER A OG 1 55 . A ATOM 285 N N . GLN A 1 56 ? 18.802 -4.495 39.430 1.0 100.52 ? 56 GLN A N 1 56 . A ATOM 286 C CA . GLN A 1 56 ? 19.173 -4.013 38.105 1.0 103.5 ? 56 GLN A CA 1 56 . A ATOM 287 C C . GLN A 1 56 ? 19.368 -2.499 38.097 1.0 96.24 ? 56 GLN A C 1 56 . A ATOM 288 O O . GLN A 1 56 ? 19.669 -1.887 39.132 1.0 97.36 ? 56 GLN A O 1 56 . A ATOM 289 C CB . GLN A 1 56 ? 18.108 -4.425 37.076 1.0 107.92 ? 56 GLN A CB 1 56 . A ATOM 290 C CG . GLN A 1 56 ? 18.583 -4.430 35.614 1.0 108.56 ? 56 GLN A CG 1 56 . A ATOM 291 C CD . GLN A 1 56 ? 17.740 -3.544 34.690 1.0 106.58 ? 56 GLN A CD 1 56 . A ATOM 292 O OE1 . GLN A 1 56 ? 17.410 -2.401 35.022 1.0 100.11 ? 56 GLN A OE1 1 56 . A ATOM 293 N NE2 . GLN A 1 56 ? 17.407 -4.072 33.514 1.0 104.15 ? 56 GLN A NE2 1 56 . A ATOM 294 N N . ASN A 1 57 ? 19.224 -1.893 36.922 1.0 88.9 ? 57 ASN A N 1 57 . A ATOM 295 C CA . ASN A 1 57 ? 19.115 -0.445 36.806 1.0 86.62 ? 57 ASN A CA 1 57 . A ATOM 296 C C . ASN A 1 57 ? 17.673 -0.095 37.154 1.0 81.44 ? 57 ASN A C 1 57 . A ATOM 297 O O . ASN A 1 57 ? 16.800 -0.019 36.290 1.0 84.54 ? 57 ASN A O 1 57 . A ATOM 298 C CB . ASN A 1 57 ? 19.510 0.015 35.407 1.0 81.49 ? 57 ASN A CB 1 57 . A ATOM 299 N N . GLN A 1 58 ? 17.407 0.073 38.448 1.0 77.78 ? 58 GLN A N 1 58 . A ATOM 300 C CA . GLN A 1 58 ? 16.092 0.478 38.917 1.0 67.65 ? 58 GLN A CA 1 58 . A ATOM 301 C C . GLN A 1 58 ? 16.198 1.710 39.803 1.0 73.03 ? 58 GLN A C 1 58 . A ATOM 302 O O . GLN A 1 58 ? 17.219 1.955 40.448 1.0 77.82 ? 58 GLN A O 1 58 . A ATOM 303 C CB . GLN A 1 58 ? 15.397 -0.635 39.689 1.0 62.17 ? 58 GLN A CB 1 58 . A ATOM 304 C CG . GLN A 1 58 ? 14.698 -1.655 38.827 1.0 68.45 ? 58 GLN A CG 1 58 . A ATOM 305 C CD . GLN A 1 58 ? 13.740 -2.502 39.631 1.0 74.75 ? 58 GLN A CD 1 58 . A ATOM 306 O OE1 . GLN A 1 58 ? 14.003 -2.819 40.794 1.0 69.07 ? 58 GLN A OE1 1 58 . A ATOM 307 N NE2 . GLN A 1 58 ? 12.605 -2.851 39.030 1.0 82.49 ? 58 GLN A NE2 1 58 . A ATOM 308 N N . CYS A 1 59 ? 15.117 2.480 39.831 1.0 69.94 ? 59 CYS A N 1 59 . A ATOM 309 C CA . CYS A 1 59 ? 15.023 3.653 40.679 1.0 65.26 ? 59 CYS A CA 1 59 . A ATOM 310 C C . CYS A 1 59 ? 13.613 3.724 41.239 1.0 54.19 ? 59 CYS A C 1 59 . A ATOM 311 O O . CYS A 1 59 ? 12.706 3.029 40.775 1.0 54.99 ? 59 CYS A O 1 59 . A ATOM 312 C CB . CYS A 1 59 ? 15.363 4.931 39.916 1.0 74.63 ? 59 CYS A CB 1 59 . A ATOM 313 S SG . CYS A 1 59 ? 14.029 5.451 38.844 1.0 81.57 ? 59 CYS A SG 1 59 . A ATOM 314 N N . SER A 1 60 ? 13.435 4.582 42.236 1.0 52.22 ? 60 SER A N 1 60 . A ATOM 315 C CA . SER A 1 60 ? 12.188 4.624 42.978 1.0 57.26 ? 60 SER A CA 1 60 . A ATOM 316 C C . SER A 1 60 ? 12.046 5.985 43.639 1.0 56.01 ? 60 SER A C 1 60 . A ATOM 317 O O . SER A 1 60 ? 13.034 6.638 43.983 1.0 64.23 ? 60 SER A O 1 60 . A ATOM 318 C CB . SER A 1 60 ? 12.127 3.518 44.038 1.0 56.15 ? 60 SER A CB 1 60 . A ATOM 319 O OG . SER A 1 60 ? 10.937 3.602 44.803 1.0 53.33 ? 60 SER A OG 1 60 . A ATOM 320 N N . SER A 1 61 ? 10.798 6.382 43.849 1.0 43.11 ? 61 SER A N 1 61 . A ATOM 321 C CA . SER A 1 61 ? 10.464 7.735 44.249 1.0 45.56 ? 61 SER A CA 1 61 . A ATOM 322 C C . SER A 1 61 ? 9.200 7.682 45.096 1.0 55.76 ? 61 SER A C 1 61 . A ATOM 323 O O . SER A 1 61 ? 8.369 6.782 44.940 1.0 48.57 ? 61 SER A O 1 61 . A ATOM 324 C CB . SER A 1 61 ? 10.281 8.630 43.004 1.0 46.69 ? 61 SER A CB 1 61 . A ATOM 325 O OG . SER A 1 61 ? 10.414 9.999 43.313 1.0 52.76 ? 61 SER A OG 1 61 . A ATOM 326 N N . LEU A 1 62 ? 9.081 8.635 46.022 1.0 46.21 ? 62 LEU A N 1 62 . A ATOM 327 C CA . LEU A 1 62 ? 7.925 8.757 46.904 1.0 41.06 ? 62 LEU A CA 1 62 . A ATOM 328 C C . LEU A 1 62 ? 7.416 10.183 46.799 1.0 50.36 ? 62 LEU A C 1 62 . A ATOM 329 O O . LEU A 1 62 ? 8.197 11.132 46.926 1.0 48.88 ? 62 LEU A O 1 62 . A ATOM 330 C CB . LEU A 1 62 ? 8.278 8.425 48.366 1.0 41.34 ? 62 LEU A CB 1 62 . A ATOM 331 C CG . LEU A 1 62 ? 7.234 8.830 49.411 1.0 48.42 ? 62 LEU A CG 1 62 . A ATOM 332 C CD1 . LEU A 1 62 ? 5.972 8.011 49.279 1.0 48.17 ? 62 LEU A CD1 1 62 . A ATOM 333 C CD2 . LEU A 1 62 ? 7.783 8.730 50.872 1.0 50.94 ? 62 LEU A CD2 1 62 . A ATOM 334 N N . LEU A 1 63 ? 6.123 10.334 46.551 1.0 39.12 ? 63 LEU A N 1 63 . A ATOM 335 C CA . LEU A 1 63 ? 5.514 11.646 46.473 1.0 50.82 ? 63 LEU A CA 1 63 . A ATOM 336 C C . LEU A 1 63 ? 4.311 11.677 47.396 1.0 51.53 ? 63 LEU A C 1 63 . A ATOM 337 O O . LEU A 1 63 ? 3.736 10.639 47.719 1.0 47.75 ? 63 LEU A O 1 63 . A ATOM 338 C CB . LEU A 1 63 ? 5.107 11.991 45.042 1.0 52.63 ? 63 LEU A CB 1 63 . A ATOM 339 C CG . LEU A 1 63 ? 6.251 11.830 44.031 1.0 57.82 ? 63 LEU A CG 1 63 . A ATOM 340 C CD1 . LEU A 1 63 ? 5.832 10.944 42.871 1.0 58.61 ? 63 LEU A CD1 1 63 . A ATOM 341 C CD2 . LEU A 1 63 ? 6.733 13.191 43.539 1.0 63.61 ? 63 LEU A CD2 1 63 . A ATOM 342 N N . ALA A 1 64 ? 3.934 12.880 47.810 1.0 47.2 ? 64 ALA A N 1 64 . A ATOM 343 C CA . ALA A 1 64 ? 2.823 13.067 48.726 1.0 46.34 ? 64 ALA A CA 1 64 . A ATOM 344 C C . ALA A 1 64 ? 1.995 14.237 48.228 1.0 45.57 ? 64 ALA A C 1 64 . A ATOM 345 O O . ALA A 1 64 ? 2.497 15.114 47.525 1.0 38.01 ? 64 ALA A O 1 64 . A ATOM 346 C CB . ALA A 1 64 ? 3.313 13.328 50.155 1.0 40.19 ? 64 ALA A CB 1 64 . A ATOM 347 N N . GLN A 1 65 ? 0.718 14.234 48.596 1.0 40.87 ? 65 GLN A N 1 65 . A ATOM 348 C CA . GLN A 1 65 ? -0.198 15.281 48.170 1.0 42.5 ? 65 GLN A CA 1 65 . A ATOM 349 C C . GLN A 1 65 ? -1.270 15.459 49.234 1.0 54.04 ? 65 GLN A C 1 65 . A ATOM 350 O O . GLN A 1 65 ? -2.021 14.520 49.521 1.0 52.23 ? 65 GLN A O 1 65 . A ATOM 351 C CB . GLN A 1 65 ? -0.843 14.952 46.828 1.0 37.72 ? 65 GLN A CB 1 65 . A ATOM 352 C CG . GLN A 1 65 ? -1.763 16.051 46.353 1.0 50.91 ? 65 GLN A CG 1 65 . A ATOM 353 C CD . GLN A 1 65 ? -1.029 17.378 46.196 1.0 56.1 ? 65 GLN A CD 1 65 . A ATOM 354 O OE1 . GLN A 1 65 ? -0.184 17.535 45.307 1.0 53.1 ? 65 GLN A OE1 1 65 . A ATOM 355 N NE2 . GLN A 1 65 ? -1.342 18.336 47.069 1.0 45.96 ? 65 GLN A NE2 1 65 . A ATOM 356 N N . ARG A 1 66 ? -1.346 16.661 49.805 1.0 52.96 ? 66 ARG A N 1 66 . A ATOM 357 C CA . ARG A 1 66 ? -2.393 16.980 50.763 1.0 55.04 ? 66 ARG A CA 1 66 . A ATOM 358 C C . ARG A 1 66 ? -3.663 17.382 50.032 1.0 47.36 ? 66 ARG A C 1 66 . A ATOM 359 O O . ARG A 1 66 ? -3.627 18.165 49.083 1.0 48.14 ? 66 ARG A O 1 66 . A ATOM 360 C CB . ARG A 1 66 ? -1.949 18.111 51.694 1.0 53.26 ? 66 ARG A CB 1 66 . A ATOM 361 C CG . ARG A 1 66 ? -3.069 18.682 52.565 1.0 69.73 ? 66 ARG A CG 1 66 . A ATOM 362 C CD . ARG A 1 66 ? -2.630 19.965 53.287 1.0 71.14 ? 66 ARG A CD 1 66 . A ATOM 363 N NE . ARG A 1 66 ? -1.199 19.943 53.569 1.0 61.58 ? 66 ARG A NE 1 66 . A ATOM 364 C CZ . ARG A 1 66 ? -0.658 19.219 54.534 1.0 49.44 ? 66 ARG A CZ 1 66 . A ATOM 365 N NH1 . ARG A 1 66 ? -1.444 18.485 55.292 1.0 65.77 ? 66 ARG A NH1 1 66 . A ATOM 366 N NH2 . ARG A 1 66 ? 0.653 19.222 54.736 1.0 53.48 ? 66 ARG A NH2 1 66 . A ATOM 367 N N . ILE A 1 67 ? -4.790 16.852 50.494 1.0 47.62 ? 67 ILE A N 1 67 . A ATOM 368 C CA . ILE A 1 67 ? -6.105 17.118 49.929 1.0 48.48 ? 67 ILE A CA 1 67 . A ATOM 369 C C . ILE A 1 67 ? -7.025 17.613 51.035 1.0 52.66 ? 67 ILE A C 1 67 . A ATOM 370 O O . ILE A 1 67 ? -7.056 17.037 52.128 1.0 54.85 ? 67 ILE A O 1 67 . A ATOM 371 C CB . ILE A 1 67 ? -6.697 15.856 49.275 1.0 43.14 ? 67 ILE A CB 1 67 . A ATOM 372 C CG1 . ILE A 1 67 ? -5.722 15.298 48.232 1.0 48.62 ? 67 ILE A CG1 1 67 . A ATOM 373 C CG2 . ILE A 1 67 ? -8.085 16.155 48.695 1.0 41.86 ? 67 ILE A CG2 1 67 . A ATOM 374 C CD1 . ILE A 1 67 ? -6.284 14.152 47.398 1.0 43.57 ? 67 ILE A CD1 1 67 . A ATOM 375 N N . ARG A 1 68 ? -7.781 18.669 50.748 1.0 53.29 ? 68 ARG A N 1 68 . A ATOM 376 C CA . ARG A 1 68 ? -8.797 19.168 51.671 1.0 55.75 ? 68 ARG A CA 1 68 . A ATOM 377 C C . ARG A 1 68 ? -10.086 18.362 51.471 1.0 55.41 ? 68 ARG A C 1 68 . A ATOM 378 O O . ARG A 1 68 ? -11.128 18.863 51.042 1.0 62.23 ? 68 ARG A O 1 68 . A ATOM 379 C CB . ARG A 1 68 ? -9.002 20.668 51.473 1.0 62.46 ? 68 ARG A CB 1 68 . A ATOM 380 C CG . ARG A 1 68 ? -7.839 21.531 51.993 1.0 68.48 ? 68 ARG A CG 1 68 . A ATOM 381 C CD . ARG A 1 68 ? -7.804 22.937 51.354 1.0 75.83 ? 68 ARG A CD 1 68 . A ATOM 382 N NE . ARG A 1 68 ? -9.112 23.586 51.389 1.0 83.87 ? 68 ARG A NE 1 68 . A ATOM 383 C CZ . ARG A 1 68 ? -9.609 24.209 52.455 1.0 97.33 ? 68 ARG A CZ 1 68 . A ATOM 384 N NH1 . ARG A 1 68 ? -8.905 24.275 53.579 1.0 99.52 ? 68 ARG A NH1 1 68 . A ATOM 385 N NH2 . ARG A 1 68 ? -10.812 24.771 52.400 1.0 107.08 ? 68 ARG A NH2 1 68 . A ATOM 386 N N . ALA A 1 69 ? -9.986 17.070 51.777 1.0 51.24 ? 69 ALA A N 1 69 . A ATOM 387 C CA . ALA A 1 69 ? -11.117 16.154 51.727 1.0 57.23 ? 69 ALA A CA 1 69 . A ATOM 388 C C . ALA A 1 69 ? -10.965 15.133 52.845 1.0 60.03 ? 69 ALA A C 1 69 . A ATOM 389 O O . ALA A 1 69 ? -9.849 14.891 53.322 1.0 57.31 ? 69 ALA A O 1 69 . A ATOM 390 C CB . ALA A 1 69 ? -11.210 15.442 50.369 1.0 62.48 ? 69 ALA A CB 1 69 . A ATOM 391 N N . PRO A 1 70 ? -12.064 14.524 53.294 1.0 64.68 ? 70 PRO A N 1 70 . A ATOM 392 C CA . PRO A 1 70 ? -11.938 13.404 54.240 1.0 60.43 ? 70 PRO A CA 1 70 . A ATOM 393 C C . PRO A 1 70 ? -11.305 12.207 53.544 1.0 61.91 ? 70 PRO A C 1 70 . A ATOM 394 O O . PRO A 1 70 ? -11.465 12.009 52.335 1.0 55.96 ? 70 PRO A O 1 70 . A ATOM 395 C CB . PRO A 1 70 ? -13.387 13.113 54.656 1.0 54.32 ? 70 PRO A CB 1 70 . A ATOM 396 C CG . PRO A 1 70 ? -14.207 14.306 54.156 1.0 58.78 ? 70 PRO A CG 1 70 . A ATOM 397 C CD . PRO A 1 70 ? -13.469 14.816 52.954 1.0 58.57 ? 70 PRO A CD 1 70 . A ATOM 398 N N . ASN A 1 71 ? -10.562 11.409 54.318 1.0 53.01 ? 71 ASN A N 1 71 . A ATOM 399 C CA . ASN A 1 71 ? -9.815 10.314 53.705 1.0 60.5 ? 71 ASN A CA 1 71 . A ATOM 400 C C . ASN A 1 71 ? -10.739 9.255 53.116 1.0 64.98 ? 71 ASN A C 1 71 . A ATOM 401 O O . ASN A 1 71 ? -10.343 8.535 52.192 1.0 74.37 ? 71 ASN A O 1 71 . A ATOM 402 C CB . ASN A 1 71 ? -8.843 9.682 54.706 1.0 53.74 ? 71 ASN A CB 1 71 . A ATOM 403 C CG . ASN A 1 71 ? -9.537 9.138 55.934 1.0 57.79 ? 71 ASN A CG 1 71 . A ATOM 404 O OD1 . ASN A 1 71 ? -9.865 9.881 56.848 1.0 50.21 ? 71 ASN A OD1 1 71 . A ATOM 405 N ND2 . ASN A 1 71 ? -9.763 7.837 55.960 1.0 62.3 ? 71 ASN A ND2 1 71 . A ATOM 406 N N . ASP A 1 72 ? -11.970 9.147 53.617 1.0 61.72 ? 72 ASP A N 1 72 . A ATOM 407 C CA . ASP A 1 72 ? -12.919 8.231 52.991 1.0 70.16 ? 72 ASP A CA 1 72 . A ATOM 408 C C . ASP A 1 72 ? -13.281 8.692 51.583 1.0 65.54 ? 72 ASP A C 1 72 . A ATOM 409 O O . ASP A 1 72 ? -13.361 7.874 50.659 1.0 54.02 ? 72 ASP A O 1 72 . A ATOM 410 C CB . ASP A 1 72 ? -14.169 8.088 53.854 1.0 73.6 ? 72 ASP A CB 1 72 . A ATOM 411 C CG . ASP A 1 72 ? -13.924 7.246 55.088 1.0 84.57 ? 72 ASP A CG 1 72 . A ATOM 412 O OD1 . ASP A 1 72 ? -12.865 6.586 55.145 1.0 86.62 ? 72 ASP A OD1 1 72 . A ATOM 413 O OD2 . ASP A 1 72 ? -14.789 7.230 55.991 1.0 88.4 ? 72 ASP A OD2 1 72 . A ATOM 414 N N . VAL A 1 73 ? -13.498 9.997 51.400 1.0 60.39 ? 73 VAL A N 1 73 . A ATOM 415 C CA . VAL A 1 73 ? -13.772 10.524 50.066 1.0 57.21 ? 73 VAL A CA 1 73 . A ATOM 416 C C . VAL A 1 73 ? -12.605 10.251 49.127 1.0 59.65 ? 73 VAL A C 1 73 . A ATOM 417 O O . VAL A 1 73 ? -12.802 9.877 47.963 1.0 47.51 ? 73 VAL A O 1 73 . A ATOM 418 C CB . VAL A 1 73 ? -14.076 12.030 50.135 1.0 56.97 ? 73 VAL A CB 1 73 . A ATOM 419 C CG1 . VAL A 1 73 ? -14.366 12.561 48.747 1.0 60.91 ? 73 VAL A CG1 1 73 . A ATOM 420 C CG2 . VAL A 1 73 ? -15.230 12.306 51.090 1.0 62.45 ? 73 VAL A CG2 1 73 . A ATOM 421 N N . VAL A 1 74 ? -11.374 10.451 49.604 1.0 57.22 ? 74 VAL A N 1 74 . A ATOM 422 C CA . VAL A 1 74 ? -10.218 10.282 48.729 1.0 56.43 ? 74 VAL A CA 1 74 . A ATOM 423 C C . VAL A 1 74 ? -10.026 8.811 48.389 1.0 55.96 ? 74 VAL A C 1 74 . A ATOM 424 O O . VAL A 1 74 ? -9.746 8.453 47.239 1.0 54.31 ? 74 VAL A O 1 74 . A ATOM 425 C CB . VAL A 1 74 ? -8.956 10.881 49.375 1.0 51.82 ? 74 VAL A CB 1 74 . A ATOM 426 C CG1 . VAL A 1 74 ? -7.733 10.546 48.540 1.0 50.53 ? 74 VAL A CG1 1 74 . A ATOM 427 C CG2 . VAL A 1 74 ? -9.091 12.393 49.550 1.0 42.18 ? 74 VAL A CG2 1 74 . A ATOM 428 N N . TRP A 1 75 ? -10.171 7.938 49.387 1.0 48.99 ? 75 TRP A N 1 75 . A ATOM 429 C CA . TRP A 1 75 ? -10.086 6.504 49.147 1.0 58.58 ? 75 TRP A CA 1 75 . A ATOM 430 C C . TRP A 1 75 ? -11.171 6.023 48.190 1.0 58.62 ? 75 TRP A C 1 75 . A ATOM 431 O O . TRP A 1 75 ? -10.935 5.119 47.384 1.0 55.0 ? 75 TRP A O 1 75 . A ATOM 432 C CB . TRP A 1 75 ? -10.187 5.744 50.464 1.0 48.43 ? 75 TRP A CB 1 75 . A ATOM 433 C CG . TRP A 1 75 ? -10.217 4.275 50.252 1.0 58.73 ? 75 TRP A CG 1 75 . A ATOM 434 C CD1 . TRP A 1 75 ? -11.261 3.433 50.480 1.0 63.29 ? 75 TRP A CD1 1 75 . A ATOM 435 C CD2 . TRP A 1 75 ? -9.151 3.469 49.748 1.0 51.84 ? 75 TRP A CD2 1 75 . A ATOM 436 N NE1 . TRP A 1 75 ? -10.909 2.148 50.154 1.0 62.36 ? 75 TRP A NE1 1 75 . A ATOM 437 C CE2 . TRP A 1 75 ? -9.614 2.140 49.712 1.0 52.04 ? 75 TRP A CE2 1 75 . A ATOM 438 C CE3 . TRP A 1 75 ? -7.848 3.742 49.325 1.0 43.41 ? 75 TRP A CE3 1 75 . A ATOM 439 C CZ2 . TRP A 1 75 ? -8.822 1.081 49.266 1.0 54.01 ? 75 TRP A CZ2 1 75 . A ATOM 440 C CZ3 . TRP A 1 75 ? -7.063 2.695 48.878 1.0 43.42 ? 75 TRP A CZ3 1 75 . A ATOM 441 C CH2 . TRP A 1 75 ? -7.552 1.374 48.861 1.0 59.23 ? 75 TRP A CH2 1 75 . A ATOM 442 N N . SER A 1 76 ? -12.378 6.583 48.286 1.0 56.3 ? 76 SER A N 1 76 . A ATOM 443 C CA . SER A 1 76 ? -13.444 6.134 47.400 1.0 50.39 ? 76 SER A CA 1 76 . A ATOM 444 C C . SER A 1 76 ? -13.108 6.385 45.940 1.0 51.48 ? 76 SER A C 1 76 . A ATOM 445 O O . SER A 1 76 ? -13.630 5.677 45.072 1.0 55.67 ? 76 SER A O 1 76 . A ATOM 446 C CB . SER A 1 76 ? -14.762 6.810 47.760 1.0 57.03 ? 76 SER A CB 1 76 . A ATOM 447 O OG . SER A 1 76 ? -14.618 8.215 47.799 1.0 69.7 ? 76 SER A OG 1 76 . A ATOM 448 N N . ILE A 1 77 ? -12.233 7.356 45.657 1.0 52.13 ? 77 ILE A N 1 77 . A ATOM 449 C CA . ILE A 1 77 ? -11.849 7.715 44.292 1.0 48.39 ? 77 ILE A CA 1 77 . A ATOM 450 C C . ILE A 1 77 ? -10.710 6.831 43.798 1.0 48.6 ? 77 ILE A C 1 77 . A ATOM 451 O O . ILE A 1 77 ? -10.827 6.158 42.770 1.0 57.37 ? 77 ILE A O 1 77 . A ATOM 452 C CB . ILE A 1 77 ? -11.439 9.197 44.212 1.0 40.65 ? 77 ILE A CB 1 77 . A ATOM 453 C CG1 . ILE A 1 77 ? -12.635 10.102 44.464 1.0 43.33 ? 77 ILE A CG1 1 77 . A ATOM 454 C CG2 . ILE A 1 77 ? -10.806 9.496 42.864 1.0 49.27 ? 77 ILE A CG2 1 77 . A ATOM 455 C CD1 . ILE A 1 77 ? -12.223 11.488 44.869 1.0 43.26 ? 77 ILE A CD1 1 77 . A ATOM 456 N N . VAL A 1 78 ? -9.594 6.838 44.528 1.0 48.87 ? 78 VAL A N 1 78 . A ATOM 457 C CA . VAL A 1 78 ? -8.393 6.152 44.080 1.0 58.02 ? 78 VAL A CA 1 78 . A ATOM 458 C C . VAL A 1 78 ? -8.511 4.637 44.122 1.0 63.25 ? 78 VAL A C 1 78 . A ATOM 459 O O . VAL A 1 78 ? -7.642 3.952 43.574 1.0 63.06 ? 78 VAL A O 1 78 . A ATOM 460 C CB . VAL A 1 78 ? -7.180 6.600 44.918 1.0 56.7 ? 78 VAL A CB 1 78 . A ATOM 461 C CG1 . VAL A 1 78 ? -7.164 8.122 45.053 1.0 62.88 ? 78 VAL A CG1 1 78 . A ATOM 462 C CG2 . VAL A 1 78 ? -7.196 5.926 46.291 1.0 58.32 ? 78 VAL A CG2 1 78 . A ATOM 463 N N . ARG A 1 79 ? -9.553 4.088 44.753 1.0 61.67 ? 79 ARG A N 1 79 . A ATOM 464 C CA . ARG A 1 79 ? -9.708 2.639 44.766 1.0 55.71 ? 79 ARG A CA 1 79 . A ATOM 465 C C . ARG A 1 79 ? -10.324 2.108 43.479 1.0 56.54 ? 79 ARG A C 1 79 . A ATOM 466 O O . ARG A 1 79 ? -10.193 0.909 43.193 1.0 53.13 ? 79 ARG A O 1 79 . A ATOM 467 C CB . ARG A 1 79 ? -10.552 2.195 45.970 1.0 57.86 ? 79 ARG A CB 1 79 . A ATOM 468 C CG . ARG A 1 79 ? -12.026 2.503 45.846 1.0 50.48 ? 79 ARG A CG 1 79 . A ATOM 469 C CD . ARG A 1 79 ? -12.737 2.215 47.152 1.0 64.14 ? 79 ARG A CD 1 79 . A ATOM 470 N NE . ARG A 1 79 ? -12.809 0.784 47.436 1.0 61.51 ? 79 ARG A NE 1 79 . A ATOM 471 C CZ . ARG A 1 79 ? -13.725 -0.033 46.924 1.0 65.38 ? 79 ARG A CZ 1 79 . A ATOM 472 N NH1 . ARG A 1 79 ? -13.709 -1.319 47.242 1.0 60.38 ? 79 ARG A NH1 1 79 . A ATOM 473 N NH2 . ARG A 1 79 ? -14.653 0.435 46.090 1.0 66.29 ? 79 ARG A NH2 1 79 . A ATOM 474 N N . ARG A 1 80 ? -10.980 2.969 42.696 1.0 48.67 ? 80 ARG A N 1 80 . A ATOM 475 C CA . ARG A 1 80 ? -11.606 2.556 41.436 1.0 61.06 ? 80 ARG A CA 1 80 . A ATOM 476 C C . ARG A 1 80 ? -10.522 2.246 40.407 1.0 58.39 ? 80 ARG A C 1 80 . A ATOM 477 O O . ARG A 1 80 ? -10.155 3.064 39.559 1.0 59.49 ? 80 ARG A O 1 80 . A ATOM 478 C CB . ARG A 1 80 ? -12.563 3.627 40.934 1.0 61.43 ? 80 ARG A CB 1 80 . A ATOM 479 C CG . ARG A 1 80 ? -13.788 3.793 41.805 1.0 69.08 ? 80 ARG A CG 1 80 . A ATOM 480 C CD . ARG A 1 80 ? -14.498 2.463 42.000 1.0 63.67 ? 80 ARG A CD 1 80 . A ATOM 481 N NE . ARG A 1 80 ? -15.091 1.964 40.762 1.0 78.67 ? 80 ARG A NE 1 80 . A ATOM 482 C CZ . ARG A 1 80 ? -16.272 2.358 40.299 1.0 86.22 ? 80 ARG A CZ 1 80 . A ATOM 483 N NH1 . ARG A 1 80 ? -16.978 3.258 40.969 1.0 94.91 ? 80 ARG A NH1 1 80 . A ATOM 484 N NH2 . ARG A 1 80 ? -16.747 1.856 39.170 1.0 91.16 ? 80 ARG A NH2 1 80 . A ATOM 485 N N . PHE A 1 81 ? -10.003 1.023 40.495 1.0 62.08 ? 81 PHE A N 1 81 . A ATOM 486 C CA . PHE A 1 81 ? -9.041 0.537 39.516 1.0 54.87 ? 81 PHE A CA 1 81 . A ATOM 487 C C . PHE A 1 81 ? -9.602 0.593 38.100 1.0 62.82 ? 81 PHE A C 1 81 . A ATOM 488 O O . PHE A 1 81 ? -8.837 0.724 37.134 1.0 61.53 ? 81 PHE A O 1 81 . A ATOM 489 C CB . PHE A 1 81 ? -8.632 -0.892 39.876 1.0 52.71 ? 81 PHE A CB 1 81 . A ATOM 490 C CG . PHE A 1 81 ? -7.637 -1.506 38.931 1.0 53.95 ? 81 PHE A CG 1 81 . A ATOM 491 C CD1 . PHE A 1 81 ? -6.281 -1.259 39.075 1.0 58.12 ? 81 PHE A CD1 1 81 . A ATOM 492 C CD2 . PHE A 1 81 ? -8.053 -2.345 37.911 1.0 52.83 ? 81 PHE A CD2 1 81 . A ATOM 493 C CE1 . PHE A 1 81 ? -5.360 -1.828 38.211 1.0 54.44 ? 81 PHE A CE1 1 81 . A ATOM 494 C CE2 . PHE A 1 81 ? -7.138 -2.923 37.050 1.0 48.43 ? 81 PHE A CE2 1 81 . A ATOM 495 C CZ . PHE A 1 81 ? -5.790 -2.661 37.202 1.0 49.86 ? 81 PHE A CZ 1 81 . A ATOM 496 N N . ASP A 1 82 ? -10.923 0.493 37.952 1.0 64.25 ? 82 ASP A N 1 82 . A ATOM 497 C CA . ASP A 1 82 ? -11.553 0.454 36.634 1.0 58.14 ? 82 ASP A CA 1 82 . A ATOM 498 C C . ASP A 1 82 ? -11.844 1.835 36.064 1.0 69.89 ? 82 ASP A C 1 82 . A ATOM 499 O O . ASP A 1 82 ? -12.292 1.934 34.916 1.0 83.58 ? 82 ASP A O 1 82 . A ATOM 500 C CB . ASP A 1 82 ? -12.855 -0.345 36.693 1.0 55.85 ? 82 ASP A CB 1 82 . A ATOM 501 C CG . ASP A 1 82 ? -13.797 0.158 37.774 1.0 68.14 ? 82 ASP A CG 1 82 . A ATOM 502 O OD1 . ASP A 1 82 ? -13.307 0.732 38.779 1.0 66.12 ? 82 ASP A OD1 1 82 . A ATOM 503 O OD2 . ASP A 1 82 ? -15.025 -0.024 37.622 1.0 67.37 ? 82 ASP A OD2 1 82 . A ATOM 504 N N . GLN A 1 83 ? -11.610 2.901 36.820 1.0 70.14 ? 83 GLN A N 1 83 . A ATOM 505 C CA . GLN A 1 83 ? -11.868 4.260 36.348 1.0 72.46 ? 83 GLN A CA 1 83 . A ATOM 506 C C . GLN A 1 83 ? -10.669 5.150 36.626 1.0 56.33 ? 83 GLN A C 1 83 . A ATOM 507 O O . GLN A 1 83 ? -10.792 6.209 37.247 1.0 50.58 ? 83 GLN A O 1 83 . A ATOM 508 C CB . GLN A 1 83 ? -13.130 4.826 36.989 1.0 85.22 ? 83 GLN A CB 1 83 . A ATOM 509 C CG . GLN A 1 83 ? -14.402 4.357 36.317 1.0 92.67 ? 83 GLN A CG 1 83 . A ATOM 510 C CD . GLN A 1 83 ? -15.639 4.964 36.940 1.0 87.76 ? 83 GLN A CD 1 83 . A ATOM 511 O OE1 . GLN A 1 83 ? -15.675 5.239 38.143 1.0 80.69 ? 83 GLN A OE1 1 83 . A ATOM 512 N NE2 . GLN A 1 83 ? -16.662 5.185 36.122 1.0 92.43 ? 83 GLN A NE2 1 83 . A ATOM 513 N N . PRO A 1 84 ? -9.485 4.754 36.163 1.0 50.59 ? 84 PRO A N 1 84 . A ATOM 514 C CA . PRO A 1 84 ? -8.321 5.629 36.337 1.0 53.52 ? 84 PRO A CA 1 84 . A ATOM 515 C C . PRO A 1 84 ? -8.510 6.997 35.694 1.0 55.69 ? 84 PRO A C 1 84 . A ATOM 516 O O . PRO A 1 84 ? -7.864 7.963 36.115 1.0 60.12 ? 84 PRO A O 1 84 . A ATOM 517 C CB . PRO A 1 84 ? -7.188 4.833 35.672 1.0 57.94 ? 84 PRO A CB 1 84 . A ATOM 518 C CG . PRO A 1 84 ? -7.879 3.994 34.644 1.0 59.17 ? 84 PRO A CG 1 84 . A ATOM 519 C CD . PRO A 1 84 ? -9.206 3.630 35.246 1.0 60.35 ? 84 PRO A CD 1 84 . A ATOM 520 N N . GLN A 1 85 ? -9.386 7.117 34.691 1.0 57.42 ? 85 GLN A N 1 85 . A ATOM 521 C CA . GLN A 1 85 ? -9.535 8.394 33.995 1.0 59.14 ? 85 GLN A CA 1 85 . A ATOM 522 C C . GLN A 1 85 ? -10.274 9.418 34.836 1.0 60.47 ? 85 GLN A C 1 85 . A ATOM 523 O O . GLN A 1 85 ? -10.189 10.611 34.539 1.0 52.29 ? 85 GLN A O 1 85 . A ATOM 524 C CB . GLN A 1 85 ? -10.256 8.214 32.656 1.0 63.55 ? 85 GLN A CB 1 85 . A ATOM 525 C CG . GLN A 1 85 ? -11.654 7.629 32.758 1.0 87.04 ? 85 GLN A CG 1 85 . A ATOM 526 C CD . GLN A 1 85 ? -11.642 6.149 33.104 1.0 90.67 ? 85 GLN A CD 1 85 . A ATOM 527 O OE1 . GLN A 1 85 ? -10.757 5.674 33.813 1.0 80.48 ? 85 GLN A OE1 1 85 . A ATOM 528 N NE2 . GLN A 1 85 ? -12.615 5.413 32.586 1.0 95.92 ? 85 GLN A NE2 1 85 . A ATOM 529 N N . THR A 1 86 ? -10.978 8.984 35.887 1.0 53.52 ? 86 THR A N 1 86 . A ATOM 530 C CA . THR A 1 86 ? -11.656 9.925 36.773 1.0 55.73 ? 86 THR A CA 1 86 . A ATOM 531 C C . THR A 1 86 ? -10.693 10.735 37.632 1.0 58.37 ? 86 THR A C 1 86 . A ATOM 532 O O . THR A 1 86 ? -11.103 11.763 38.185 1.0 68.93 ? 86 THR A O 1 86 . A ATOM 533 C CB . THR A 1 86 ? -12.636 9.184 37.688 1.0 59.43 ? 86 THR A CB 1 86 . A ATOM 534 O OG1 . THR A 1 86 ? -11.907 8.256 38.495 1.0 76.33 ? 86 THR A OG1 1 86 . A ATOM 535 C CG2 . THR A 1 86 ? -13.686 8.418 36.875 1.0 67.38 ? 86 THR A CG2 1 86 . A ATOM 536 N N . TYR A 1 87 ? -9.430 10.306 37.767 1.0 47.98 ? 87 TYR A N 1 87 . A ATOM 537 C CA . TYR A 1 87 ? -8.501 10.991 38.661 1.0 49.94 ? 87 TYR A CA 1 87 . A ATOM 538 C C . TYR A 1 87 ? -7.060 10.883 38.175 1.0 53.24 ? 87 TYR A C 1 87 . A ATOM 539 O O . TYR A 1 87 ? -6.130 10.945 38.986 1.0 59.49 ? 87 TYR A O 1 87 . A ATOM 540 C CB . TYR A 1 87 ? -8.600 10.429 40.101 1.0 59.74 ? 87 TYR A CB 1 87 . A ATOM 541 C CG . TYR A 1 87 ? -8.164 8.985 40.185 1.0 55.59 ? 87 TYR A CG 1 87 . A ATOM 542 C CD1 . TYR A 1 87 ? -9.034 7.959 39.850 1.0 63.75 ? 87 TYR A CD1 1 87 . A ATOM 543 C CD2 . TYR A 1 87 ? -6.872 8.652 40.566 1.0 56.06 ? 87 TYR A CD2 1 87 . A ATOM 544 C CE1 . TYR A 1 87 ? -8.639 6.637 39.908 1.0 69.5 ? 87 TYR A CE1 1 87 . A ATOM 545 C CE2 . TYR A 1 87 ? -6.462 7.333 40.630 1.0 61.7 ? 87 TYR A CE2 1 87 . A ATOM 546 C CZ . TYR A 1 87 ? -7.355 6.328 40.300 1.0 70.69 ? 87 TYR A CZ 1 87 . A ATOM 547 O OH . TYR A 1 87 ? -6.977 5.007 40.350 1.0 72.85 ? 87 TYR A OH 1 87 . A ATOM 548 N N . LYS A 1 88 ? -6.856 10.719 36.870 1.0 50.09 ? 88 LYS A N 1 88 . A ATOM 549 C CA . LYS A 1 88 ? -5.534 10.628 36.262 1.0 47.34 ? 88 LYS A CA 1 88 . A ATOM 550 C C . LYS A 1 88 ? -5.576 11.275 34.889 1.0 47.89 ? 88 LYS A C 1 88 . A ATOM 551 O O . LYS A 1 88 ? -6.582 11.186 34.193 1.0 50.21 ? 88 LYS A O 1 88 . A ATOM 552 C CB . LYS A 1 88 ? -5.068 9.163 36.128 1.0 59.68 ? 88 LYS A CB 1 88 . A ATOM 553 C CG . LYS A 1 88 ? -4.366 8.586 37.361 1.0 53.64 ? 88 LYS A CG 1 88 . A ATOM 554 C CD . LYS A 1 88 ? -4.772 7.141 37.629 1.0 65.06 ? 88 LYS A CD 1 88 . A ATOM 555 C CE . LYS A 1 88 ? -3.857 6.150 36.941 1.0 65.93 ? 88 LYS A CE 1 88 . A ATOM 556 N NZ . LYS A 1 88 ? -2.805 5.645 37.868 1.0 56.34 ? 88 LYS A NZ 1 88 . A ATOM 557 N N . HIS A 1 89 ? -4.502 11.945 34.517 1.0 46.48 ? 89 HIS A N 1 89 . A ATOM 558 C CA . HIS A 1 89 ? -4.418 12.450 33.162 1.0 50.94 ? 89 HIS A CA 1 89 . A ATOM 559 C C . HIS A 1 89 ? -3.885 11.370 32.234 1.0 52.85 ? 89 HIS A C 1 89 . A ATOM 560 O O . HIS A 1 89 ? -3.424 10.306 32.664 1.0 51.51 ? 89 HIS A O 1 89 . A ATOM 561 C CB . HIS A 1 89 ? -3.511 13.680 33.080 1.0 48.66 ? 89 HIS A CB 1 89 . A ATOM 562 C CG . HIS A 1 89 ? -3.941 14.815 33.947 1.0 58.2 ? 89 HIS A CG 1 89 . A ATOM 563 N ND1 . HIS A 1 89 ? -4.962 15.670 33.596 1.0 52.54 ? 89 HIS A ND1 1 89 . A ATOM 564 C CD2 . HIS A 1 89 ? -3.479 15.249 35.143 1.0 62.01 ? 89 HIS A CD2 1 89 . A ATOM 565 C CE1 . HIS A 1 89 ? -5.111 16.584 34.537 1.0 62.1 ? 89 HIS A CE1 1 89 . A ATOM 566 N NE2 . HIS A 1 89 ? -4.226 16.349 35.490 1.0 65.03 ? 89 HIS A NE2 1 89 . A ATOM 567 N N . PHE A 1 90 ? -3.948 11.672 30.938 1.0 50.1 ? 90 PHE A N 1 90 . A ATOM 568 C CA . PHE A 1 90 ? -3.230 11.031 29.853 1.0 45.59 ? 90 PHE A CA 1 90 . A ATOM 569 C C . PHE A 1 90 ? -3.918 9.784 29.326 1.0 52.43 ? 90 PHE A C 1 90 . A ATOM 570 O O . PHE A 1 90 ? -3.344 9.125 28.462 1.0 49.55 ? 90 PHE A O 1 90 . A ATOM 571 C CB . PHE A 1 90 ? -1.790 10.679 30.250 1.0 45.05 ? 90 PHE A CB 1 90 . A ATOM 572 C CG . PHE A 1 90 ? -1.000 11.861 30.714 1.0 49.06 ? 90 PHE A CG 1 90 . A ATOM 573 C CD1 . PHE A 1 90 ? -0.686 12.888 29.839 1.0 47.66 ? 90 PHE A CD1 1 90 . A ATOM 574 C CD2 . PHE A 1 90 ? -0.589 11.959 32.031 1.0 58.15 ? 90 PHE A CD2 1 90 . A ATOM 575 C CE1 . PHE A 1 90 ? 0.029 13.996 30.267 1.0 47.24 ? 90 PHE A CE1 1 90 . A ATOM 576 C CE2 . PHE A 1 90 ? 0.132 13.058 32.467 1.0 52.87 ? 90 PHE A CE2 1 90 . A ATOM 577 C CZ . PHE A 1 90 ? 0.438 14.078 31.585 1.0 52.82 ? 90 PHE A CZ 1 90 . A ATOM 578 N N . ILE A 1 91 ? -5.118 9.452 29.788 1.0 58.43 ? 91 ILE A N 1 91 . A ATOM 579 C CA . ILE A 1 91 ? -5.816 8.245 29.364 1.0 61.12 ? 91 ILE A CA 1 91 . A ATOM 580 C C . ILE A 1 91 ? -6.882 8.657 28.356 1.0 58.61 ? 91 ILE A C 1 91 . A ATOM 581 O O . ILE A 1 91 ? -7.823 9.383 28.693 1.0 70.9 ? 91 ILE A O 1 91 . A ATOM 582 C CB . ILE A 1 91 ? -6.424 7.493 30.558 1.0 53.19 ? 91 ILE A CB 1 91 . A ATOM 583 C CG1 . ILE A 1 91 ? -5.345 7.135 31.577 1.0 51.43 ? 91 ILE A CG1 1 91 . A ATOM 584 C CG2 . ILE A 1 91 ? -7.107 6.218 30.103 1.0 51.88 ? 91 ILE A CG2 1 91 . A ATOM 585 C CD1 . ILE A 1 91 ? -5.896 6.533 32.900 1.0 52.8 ? 91 ILE A CD1 1 91 . A ATOM 586 N N . LYS A 1 92 ? -6.734 8.206 27.109 1.0 51.03 ? 92 LYS A N 1 92 . A ATOM 587 C CA . LYS A 1 92 ? -7.774 8.451 26.109 1.0 50.69 ? 92 LYS A CA 1 92 . A ATOM 588 C C . LYS A 1 92 ? -8.932 7.482 26.272 1.0 59.81 ? 92 LYS A C 1 92 . A ATOM 589 O O . LYS A 1 92 ? -10.096 7.865 26.088 1.0 54.54 ? 92 LYS A O 1 92 . A ATOM 590 C CB . LYS A 1 92 ? -7.203 8.338 24.691 1.0 47.64 ? 92 LYS A CB 1 92 . A ATOM 591 C CG . LYS A 1 92 ? -8.253 8.422 23.567 1.0 53.27 ? 92 LYS A CG 1 92 . A ATOM 592 C CD . LYS A 1 92 ? -7.595 8.435 22.181 1.0 52.22 ? 92 LYS A CD 1 92 . A ATOM 593 C CE . LYS A 1 92 ? -6.792 7.161 21.911 1.0 55.81 ? 92 LYS A CE 1 92 . A ATOM 594 N NZ . LYS A 1 92 ? -6.513 6.939 20.448 1.0 63.09 ? 92 LYS A NZ 1 92 . A ATOM 595 N N . SER A 1 93 ? -8.632 6.233 26.622 1.0 57.33 ? 93 SER A N 1 93 . A ATOM 596 C CA . SER A 1 93 ? -9.656 5.211 26.752 1.0 53.27 ? 93 SER A CA 1 93 . A ATOM 597 C C . SER A 1 93 ? -9.121 4.080 27.622 1.0 53.35 ? 93 SER A C 1 93 . A ATOM 598 O O . SER A 1 93 ? -7.916 3.813 27.657 1.0 47.41 ? 93 SER A O 1 93 . A ATOM 599 C CB . SER A 1 93 ? -10.108 4.688 25.384 1.0 57.83 ? 93 SER A CB 1 93 . A ATOM 600 O OG . SER A 1 93 ? -9.030 4.095 24.670 1.0 62.63 ? 93 SER A OG 1 93 . A ATOM 601 N N . CYS A 1 94 ? -10.043 3.437 28.330 1.0 57.84 ? 94 CYS A N 1 94 . A ATOM 602 C CA . CYS A 1 94 ? -9.745 2.422 29.331 1.0 64.85 ? 94 CYS A CA 1 94 . A ATOM 603 C C . CYS A 1 94 ? -10.779 1.320 29.181 1.0 72.11 ? 94 CYS A C 1 94 . A ATOM 604 O O . CYS A 1 94 ? -11.962 1.601 28.977 1.0 75.61 ? 94 CYS A O 1 94 . A ATOM 605 C CB . CYS A 1 94 ? -9.769 2.997 30.777 1.0 44.68 ? 94 CYS A CB 1 94 . A ATOM 606 S SG . CYS A 1 94 ? -10.387 1.780 31.997 1.0 83.58 ? 94 CYS A SG 1 94 . A ATOM 607 N N . SER A 1 95 ? -10.335 0.069 29.275 1.0 76.86 ? 95 SER A N 1 95 . A ATOM 608 C CA . SER A 1 95 ? -11.237 -1.069 29.168 1.0 75.23 ? 95 SER A CA 1 95 . A ATOM 609 C C . SER A 1 95 ? -10.864 -2.124 30.197 1.0 70.91 ? 95 SER A C 1 95 . A ATOM 610 O O . SER A 1 95 ? -9.682 -2.331 30.481 1.0 65.51 ? 95 SER A O 1 95 . A ATOM 611 C CB . SER A 1 95 ? -11.189 -1.689 27.769 1.0 71.29 ? 95 SER A CB 1 95 . A ATOM 612 O OG . SER A 1 95 ? -9.967 -2.379 27.584 1.0 70.4 ? 95 SER A OG 1 95 . A ATOM 613 N N . VAL A 1 96 ? -11.882 -2.790 30.748 1.0 72.48 ? 96 VAL A N 1 96 . A ATOM 614 C CA . VAL A 1 96 ? -11.707 -3.965 31.593 1.0 76.3 ? 96 VAL A CA 1 96 . A ATOM 615 C C . VAL A 1 96 ? -12.567 -5.093 31.033 1.0 86.54 ? 96 VAL A C 1 96 . A ATOM 616 O O . VAL A 1 96 ? -13.425 -4.886 30.173 1.0 89.6 ? 96 VAL A O 1 96 . A ATOM 617 C CB . VAL A 1 96 ? -12.072 -3.710 33.076 1.0 71.05 ? 96 VAL A CB 1 96 . A ATOM 618 C CG1 . VAL A 1 96 ? -11.041 -2.836 33.758 1.0 67.65 ? 96 VAL A CG1 1 96 . A ATOM 619 C CG2 . VAL A 1 96 ? -13.461 -3.107 33.194 1.0 68.02 ? 96 VAL A CG2 1 96 . A ATOM 620 N N . SER A 1 97 ? -12.334 -6.297 31.555 1.0 98.3 ? 97 SER A N 1 97 . A ATOM 621 C CA . SER A 1 97 ? -13.093 -7.469 31.135 1.0 109.69 ? 97 SER A CA 1 97 . A ATOM 622 C C . SER A 1 97 ? -14.580 -7.300 31.440 1.0 121.68 ? 97 SER A C 1 97 . A ATOM 623 O O . SER A 1 97 ? -14.975 -6.551 32.340 1.0 125.93 ? 97 SER A O 1 97 . A ATOM 624 C CB . SER A 1 97 ? -12.556 -8.718 31.836 1.0 103.71 ? 97 SER A CB 1 97 . A ATOM 625 O OG . SER A 1 97 ? -13.539 -9.741 31.898 1.0 105.31 ? 97 SER A OG 1 97 . A ATOM 626 N N . ASP A 1 98 ? -15.415 -8.017 30.677 1.0 124.14 ? 98 ASP A N 1 98 . A ATOM 627 C CA . ASP A 1 98 ? -16.854 -7.990 30.932 1.0 122.11 ? 98 ASP A CA 1 98 . A ATOM 628 C C . ASP A 1 98 ? -17.190 -8.635 32.274 1.0 114.65 ? 98 ASP A C 1 98 . A ATOM 629 O O . ASP A 1 98 ? -18.098 -8.178 32.978 1.0 118.45 ? 98 ASP A O 1 98 . A ATOM 630 C CB . ASP A 1 98 ? -17.612 -8.683 29.796 1.0 121.91 ? 98 ASP A CB 1 98 . A ATOM 631 C CG . ASP A 1 98 ? -19.127 -8.509 29.904 1.0 124.63 ? 98 ASP A CG 1 98 . A ATOM 632 O OD1 . ASP A 1 98 ? -19.795 -8.496 28.848 1.0 125.32 ? 98 ASP A OD1 1 98 . A ATOM 633 O OD2 . ASP A 1 98 ? -19.654 -8.387 31.035 1.0 123.87 ? 98 ASP A OD2 1 98 . A ATOM 634 N N . ASN A 1 99 ? -16.477 -9.701 32.645 1.0 100.51 ? 99 ASN A N 1 99 . A ATOM 635 C CA . ASN A 1 99 ? -16.652 -10.327 33.949 1.0 95.24 ? 99 ASN A CA 1 99 . A ATOM 636 C C . ASN A 1 99 ? -15.743 -9.724 35.010 1.0 89.85 ? 99 ASN A C 1 99 . A ATOM 637 O O . ASN A 1 99 ? -15.368 -10.409 35.969 1.0 96.03 ? 99 ASN A O 1 99 . A ATOM 638 C CB . ASN A 1 99 ? -16.442 -11.837 33.842 1.0 95.8 ? 99 ASN A CB 1 99 . A ATOM 639 C CG . ASN A 1 99 ? -17.727 -12.575 33.526 1.0 100.8 ? 99 ASN A CG 1 99 . A ATOM 640 O OD1 . ASN A 1 99 ? -18.771 -11.958 33.300 1.0 95.39 ? 99 ASN A OD1 1 99 . A ATOM 641 N ND2 . ASN A 1 99 ? -17.661 -13.905 33.508 1.0 107.53 ? 99 ASN A ND2 1 99 . A ATOM 642 N N . PHE A 1 100 ? -15.388 -8.451 34.860 1.0 91.5 ? 100 PHE A N 1 100 . A ATOM 643 C CA . PHE A 1 100 ? -14.555 -7.777 35.847 1.0 90.76 ? 100 PHE A CA 1 100 . A ATOM 644 C C . PHE A 1 100 ? -15.282 -7.682 37.181 1.0 90.2 ? 100 PHE A C 1 100 . A ATOM 645 O O . PHE A 1 100 ? -16.503 -7.527 37.234 1.0 93.5 ? 100 PHE A O 1 100 . A ATOM 646 C CB . PHE A 1 100 ? -14.175 -6.385 35.341 1.0 88.89 ? 100 PHE A CB 1 100 . A ATOM 647 C CG . PHE A 1 100 ? -13.585 -5.483 36.393 1.0 80.77 ? 100 PHE A CG 1 100 . A ATOM 648 C CD1 . PHE A 1 100 ? -12.227 -5.495 36.654 1.0 86.94 ? 100 PHE A CD1 1 100 . A ATOM 649 C CD2 . PHE A 1 100 ? -14.388 -4.605 37.099 1.0 70.38 ? 100 PHE A CD2 1 100 . A ATOM 650 C CE1 . PHE A 1 100 ? -11.683 -4.651 37.613 1.0 86.66 ? 100 PHE A CE1 1 100 . A ATOM 651 C CE2 . PHE A 1 100 ? -13.852 -3.761 38.058 1.0 75.4 ? 100 PHE A CE2 1 100 . A ATOM 652 C CZ . PHE A 1 100 ? -12.498 -3.784 38.318 1.0 78.84 ? 100 PHE A CZ 1 100 . A ATOM 653 N N . THR A 1 101 ? -14.518 -7.775 38.266 1.0 89.31 ? 101 THR A N 1 101 . A ATOM 654 C CA . THR A 1 101 ? -15.085 -7.735 39.604 1.0 84.45 ? 101 THR A CA 1 101 . A ATOM 655 C C . THR A 1 101 ? -14.212 -6.978 40.592 1.0 85.28 ? 101 THR A C 1 101 . A ATOM 656 O O . THR A 1 101 ? -14.579 -6.879 41.769 1.0 85.7 ? 101 THR A O 1 101 . A ATOM 657 C CB . THR A 1 101 ? -15.321 -9.165 40.118 1.0 88.38 ? 101 THR A CB 1 101 . A ATOM 658 O OG1 . THR A 1 101 ? -16.130 -9.124 41.298 1.0 92.7 ? 101 THR A OG1 1 101 . A ATOM 659 C CG2 . THR A 1 101 ? -13.990 -9.845 40.427 1.0 86.7 ? 101 THR A CG2 1 101 . A ATOM 660 N N . MET A 1 102 ? -13.071 -6.451 40.154 1.0 89.0 ? 102 MET A N 1 102 . A ATOM 661 C CA . MET A 1 102 ? -12.155 -5.679 40.998 1.0 86.11 ? 102 MET A CA 1 102 . A ATOM 662 C C . MET A 1 102 ? -11.603 -6.511 42.152 1.0 74.23 ? 102 MET A C 1 102 . A ATOM 663 O O . MET A 1 102 ? -11.486 -6.039 43.282 1.0 74.07 ? 102 MET A O 1 102 . A ATOM 664 C CB . MET A 1 102 ? -12.803 -4.392 41.518 1.0 95.63 ? 102 MET A CB 1 102 . A ATOM 665 C CG . MET A 1 102 ? -11.786 -3.251 41.666 1.0 96.17 ? 102 MET A CG 1 102 . A ATOM 666 S SD . MET A 1 102 ? -12.384 -1.753 42.472 1.0 90.41 ? 102 MET A SD 1 102 . A ATOM 667 C CE . MET A 1 102 ? -13.669 -1.254 41.331 1.0 84.8 ? 102 MET A CE 1 102 . A ATOM 668 N N . ALA A 1 103 ? -11.250 -7.755 41.860 1.0 70.04 ? 103 ALA A N 1 103 . A ATOM 669 C CA . ALA A 1 103 ? -10.394 -8.541 42.730 1.0 64.93 ? 103 ALA A CA 1 103 . A ATOM 670 C C . ALA A 1 103 ? -8.934 -8.226 42.428 1.0 63.15 ? 103 ALA A C 1 103 . A ATOM 671 O O . ALA A 1 103 ? -8.598 -7.675 41.377 1.0 62.41 ? 103 ALA A O 1 103 . A ATOM 672 C CB . ALA A 1 103 ? -10.660 -10.035 42.538 1.0 70.18 ? 103 ALA A CB 1 103 . A ATOM 673 N N . VAL A 1 104 ? -8.054 -8.574 43.367 1.0 65.48 ? 104 VAL A N 1 104 . A ATOM 674 C CA . VAL A 1 104 ? -6.629 -8.505 43.073 1.0 57.11 ? 104 VAL A CA 1 104 . A ATOM 675 C C . VAL A 1 104 ? -6.321 -9.456 41.925 1.0 57.54 ? 104 VAL A C 1 104 . A ATOM 676 O O . VAL A 1 104 ? -6.853 -10.570 41.858 1.0 58.11 ? 104 VAL A O 1 104 . A ATOM 677 C CB . VAL A 1 104 ? -5.797 -8.825 44.320 1.0 66.03 ? 104 VAL A CB 1 104 . A ATOM 678 C CG1 . VAL A 1 104 ? -4.329 -9.032 43.945 1.0 50.0 ? 104 VAL A CG1 1 104 . A ATOM 679 C CG2 . VAL A 1 104 ? -5.950 -7.710 45.353 1.0 66.82 ? 104 VAL A CG2 1 104 . A ATOM 680 N N . GLY A 1 105 ? -5.479 -9.007 40.999 1.0 52.38 ? 105 GLY A N 1 105 . A ATOM 681 C CA . GLY A 1 105 ? -5.203 -9.727 39.773 1.0 61.72 ? 105 GLY A CA 1 105 . A ATOM 682 C C . GLY A 1 105 ? -5.944 -9.201 38.557 1.0 59.34 ? 105 GLY A C 1 105 . A ATOM 683 O O . GLY A 1 105 ? -5.521 -9.475 37.431 1.0 60.49 ? 105 GLY A O 1 105 . A ATOM 684 N N . SER A 1 106 ? -7.041 -8.467 38.750 1.0 57.6 ? 106 SER A N 1 106 . A ATOM 685 C CA . SER A 1 106 ? -7.728 -7.826 37.637 1.0 58.75 ? 106 SER A CA 1 106 . A ATOM 686 C C . SER A 1 106 ? -6.742 -7.054 36.765 1.0 53.58 ? 106 SER A C 1 106 . A ATOM 687 O O . SER A 1 106 ? -5.668 -6.644 37.210 1.0 51.99 ? 106 SER A O 1 106 . A ATOM 688 C CB . SER A 1 106 ? -8.816 -6.873 38.147 1.0 66.93 ? 106 SER A CB 1 106 . A ATOM 689 O OG . SER A 1 106 ? -9.758 -7.534 38.974 1.0 78.06 ? 106 SER A OG 1 106 . A ATOM 690 N N . THR A 1 107 ? -7.111 -6.869 35.504 1.0 59.43 ? 107 THR A N 1 107 . A ATOM 691 C CA . THR A 1 107 ? -6.301 -6.106 34.570 1.0 61.2 ? 107 THR A CA 1 107 . A ATOM 692 C C . THR A 1 107 ? -7.163 -5.072 33.863 1.0 58.99 ? 107 THR A C 1 107 . A ATOM 693 O O . THR A 1 107 ? -8.380 -5.236 33.716 1.0 54.15 ? 107 THR A O 1 107 . A ATOM 694 C CB . THR A 1 107 ? -5.608 -7.006 33.518 1.0 67.42 ? 107 THR A CB 1 107 . A ATOM 695 O OG1 . THR A 1 107 ? -6.591 -7.783 32.816 1.0 65.75 ? 107 THR A OG1 1 107 . A ATOM 696 C CG2 . THR A 1 107 ? -4.583 -7.928 34.186 1.0 63.76 ? 107 THR A CG2 1 107 . A ATOM 697 N N . ARG A 1 108 ? -6.507 -3.993 33.443 1.0 51.69 ? 108 ARG A N 1 108 . A ATOM 698 C CA . ARG A 1 108 ? -7.103 -2.983 32.590 1.0 50.45 ? 108 ARG A CA 1 108 . A ATOM 699 C C . ARG A 1 108 ? -6.138 -2.704 31.450 1.0 56.94 ? 108 ARG A C 1 108 . A ATOM 700 O O . ARG A 1 108 ? -4.924 -2.893 31.583 1.0 56.44 ? 108 ARG A O 1 108 . A ATOM 701 C CB . ARG A 1 108 ? -7.415 -1.687 33.360 1.0 52.93 ? 108 ARG A CB 1 108 . A ATOM 702 C CG . ARG A 1 108 ? -6.182 -0.990 33.919 1.0 47.71 ? 108 ARG A CG 1 108 . A ATOM 703 C CD . ARG A 1 108 ? -6.521 0.090 34.936 1.0 59.01 ? 108 ARG A CD 1 108 . A ATOM 704 N NE . ARG A 1 108 ? -5.300 0.611 35.534 1.0 55.06 ? 108 ARG A NE 1 108 . A ATOM 705 C CZ . ARG A 1 108 ? -5.247 1.399 36.601 1.0 50.76 ? 108 ARG A CZ 1 108 . A ATOM 706 N NH1 . ARG A 1 108 ? -4.070 1.808 37.046 1.0 49.61 ? 108 ARG A NH1 1 108 . A ATOM 707 N NH2 . ARG A 1 108 ? -6.358 1.771 37.223 1.0 51.43 ? 108 ARG A NH2 1 108 . A ATOM 708 N N . ASP A 1 109 ? -6.694 -2.268 30.324 1.0 51.0 ? 109 ASP A N 1 109 . A ATOM 709 C CA . ASP A 1 109 ? -5.914 -1.825 29.174 1.0 55.21 ? 109 ASP A CA 1 109 . A ATOM 710 C C . ASP A 1 109 ? -6.165 -0.343 28.932 1.0 50.97 ? 109 ASP A C 1 109 . A ATOM 711 O O . ASP A 1 109 ? -7.319 0.087 28.827 1.0 52.46 ? 109 ASP A O 1 109 . A ATOM 712 C CB . ASP A 1 109 ? -6.264 -2.641 27.932 1.0 70.94 ? 109 ASP A CB 1 109 . A ATOM 713 C CG . ASP A 1 109 ? -5.631 -4.010 27.949 1.0 82.13 ? 109 ASP A CG 1 109 . A ATOM 714 O OD1 . ASP A 1 109 ? -6.365 -5.005 28.108 1.0 88.25 ? 109 ASP A OD1 1 109 . A ATOM 715 O OD2 . ASP A 1 109 ? -4.393 -4.090 27.800 1.0 89.5 ? 109 ASP A OD2 1 109 . A ATOM 716 N N . VAL A 1 110 ? -5.087 0.428 28.848 1.0 47.83 ? 110 VAL A N 1 110 . A ATOM 717 C CA . VAL A 1 110 ? -5.142 1.880 28.771 1.0 49.37 ? 110 VAL A CA 1 110 . A ATOM 718 C C . VAL A 1 110 ? -4.663 2.322 27.393 1.0 53.68 ? 110 VAL A C 1 110 . A ATOM 719 O O . VAL A 1 110 ? -3.623 1.856 26.912 1.0 45.28 ? 110 VAL A O 1 110 . A ATOM 720 C CB . VAL A 1 110 ? -4.284 2.517 29.875 1.0 49.58 ? 110 VAL A CB 1 110 . A ATOM 721 C CG1 . VAL A 1 110 ? -4.204 4.009 29.668 1.0 58.84 ? 110 VAL A CG1 1 110 . A ATOM 722 C CG2 . VAL A 1 110 ? -4.869 2.195 31.216 1.0 51.1 ? 110 VAL A CG2 1 110 . A ATOM 723 N N . ASN A 1 111 ? -5.422 3.212 26.759 1.0 50.97 ? 111 ASN A N 1 111 . A ATOM 724 C CA . ASN A 1 111 ? -4.970 3.893 25.553 1.0 51.43 ? 111 ASN A CA 1 111 . A ATOM 725 C C . ASN A 1 111 ? -4.565 5.309 25.929 1.0 49.61 ? 111 ASN A C 1 111 . A ATOM 726 O O . ASN A 1 111 ? -5.390 6.090 26.425 1.0 48.38 ? 111 ASN A O 1 111 . A ATOM 727 C CB . ASN A 1 111 ? -6.043 3.902 24.460 1.0 52.41 ? 111 ASN A CB 1 111 . A ATOM 728 C CG . ASN A 1 111 ? -6.324 2.518 23.928 1.0 57.21 ? 111 ASN A CG 1 111 . A ATOM 729 O OD1 . ASN A 1 111 ? -5.410 1.707 23.766 1.0 53.79 ? 111 ASN A OD1 1 111 . A ATOM 730 N ND2 . ASN A 1 111 ? -7.594 2.225 23.680 1.0 69.35 ? 111 ASN A ND2 1 111 . A ATOM 731 N N . VAL A 1 112 ? -3.294 5.630 25.695 1.0 43.35 ? 112 VAL A N 1 112 . A ATOM 732 C CA . VAL A 1 112 ? -2.742 6.926 26.068 1.0 46.64 ? 112 VAL A CA 1 112 . A ATOM 733 C C . VAL A 1 112 ? -3.151 7.974 25.044 1.0 50.58 ? 112 VAL A C 1 112 . A ATOM 734 O O . VAL A 1 112 ? -3.375 7.669 23.869 1.0 45.89 ? 112 VAL A O 1 112 . A ATOM 735 C CB . VAL A 1 112 ? -1.211 6.831 26.202 1.0 49.48 ? 112 VAL A CB 1 112 . A ATOM 736 C CG1 . VAL A 1 112 ? -0.615 8.210 26.406 1.0 47.3 ? 112 VAL A CG1 1 112 . A ATOM 737 C CG2 . VAL A 1 112 ? -0.833 5.893 27.365 1.0 65.14 ? 112 VAL A CG2 1 112 . A ATOM 738 N N . ILE A 1 113 ? -3.263 9.228 25.490 1.0 46.3 ? 113 ILE A N 1 113 . A ATOM 739 C CA . ILE A 1 113 ? -3.546 10.293 24.531 1.0 45.73 ? 113 ILE A CA 1 113 . A ATOM 740 C C . ILE A 1 113 ? -2.329 10.518 23.640 1.0 43.74 ? 113 ILE A C 1 113 . A ATOM 741 O O . ILE A 1 113 ? -1.211 10.079 23.929 1.0 52.47 ? 113 ILE A O 1 113 . A ATOM 742 C CB . ILE A 1 113 ? -3.969 11.596 25.230 1.0 48.97 ? 113 ILE A CB 1 113 . A ATOM 743 C CG1 . ILE A 1 113 ? -2.849 12.119 26.126 1.0 47.45 ? 113 ILE A CG1 1 113 . A ATOM 744 C CG2 . ILE A 1 113 ? -5.236 11.410 26.046 1.0 39.94 ? 113 ILE A CG2 1 113 . A ATOM 745 C CD1 . ILE A 1 113 ? -3.142 13.501 26.690 1.0 57.34 ? 113 ILE A CD1 1 113 . A ATOM 746 N N . SER A 1 114 ? -2.557 11.203 22.524 1.0 51.05 ? 114 SER A N 1 114 . A ATOM 747 C CA . SER A 1 114 ? -1.490 11.428 21.558 1.0 43.18 ? 114 SER A CA 1 114 . A ATOM 748 C C . SER A 1 114 ? -0.440 12.369 22.124 1.0 51.19 ? 114 SER A C 1 114 . A ATOM 749 O O . SER A 1 114 ? -0.707 13.164 23.030 1.0 49.66 ? 114 SER A O 1 114 . A ATOM 750 C CB . SER A 1 114 ? -2.047 12.026 20.270 1.0 41.18 ? 114 SER A CB 1 114 . A ATOM 751 O OG . SER A 1 114 ? -2.617 13.294 20.520 1.0 39.0 ? 114 SER A OG 1 114 . A ATOM 752 N N . GLY A 1 115 ? 0.759 12.287 21.566 1.0 42.01 ? 115 GLY A N 1 115 . A ATOM 753 C CA . GLY A 1 115 ? 1.796 13.247 21.868 1.0 51.51 ? 115 GLY A CA 1 115 . A ATOM 754 C C . GLY A 1 115 ? 2.747 12.843 22.968 1.0 46.89 ? 115 GLY A C 1 115 . A ATOM 755 O O . GLY A 1 115 ? 3.625 13.636 23.330 1.0 42.52 ? 115 GLY A O 1 115 . A ATOM 756 N N . LEU A 1 116 ? 2.625 11.637 23.488 1.0 47.23 ? 116 LEU A N 1 116 . A ATOM 757 C CA . LEU A 1 116 ? 3.454 11.179 24.579 1.0 46.81 ? 116 LEU A CA 1 116 . A ATOM 758 C C . LEU A 1 116 ? 4.440 10.141 24.089 1.0 53.55 ? 116 LEU A C 1 116 . A ATOM 759 O O . LEU A 1 116 ? 4.265 9.562 23.012 1.0 39.74 ? 116 LEU A O 1 116 . A ATOM 760 C CB . LEU A 1 116 ? 2.586 10.584 25.692 1.0 41.89 ? 116 LEU A CB 1 116 . A ATOM 761 C CG . LEU A 1 116 ? 1.490 11.545 26.155 1.0 55.58 ? 116 LEU A CG 1 116 . A ATOM 762 C CD1 . LEU A 1 116 ? 0.782 11.020 27.391 1.0 56.14 ? 116 LEU A CD1 1 116 . A ATOM 763 C CD2 . LEU A 1 116 ? 2.061 12.926 26.403 1.0 49.66 ? 116 LEU A CD2 1 116 . A ATOM 764 N N . PRO A 1 117 ? 5.474 9.857 24.865 1.0 43.21 ? 117 PRO A N 1 117 . A ATOM 765 C CA . PRO A 1 117 ? 6.402 8.798 24.472 1.0 49.09 ? 117 PRO A CA 1 117 . A ATOM 766 C C . PRO A 1 117 ? 5.827 7.438 24.811 1.0 46.8 ? 117 PRO A C 1 117 . A ATOM 767 O O . PRO A 1 117 ? 6.520 6.601 25.396 1.0 40.91 ? 117 PRO A O 1 117 . A ATOM 768 C CB . PRO A 1 117 ? 7.645 9.107 25.311 1.0 53.79 ? 117 PRO A CB 1 117 . A ATOM 769 C CG . PRO A 1 117 ? 7.070 9.680 26.556 1.0 45.76 ? 117 PRO A CG 1 117 . A ATOM 770 C CD . PRO A 1 117 ? 5.920 10.544 26.090 1.0 45.28 ? 117 PRO A CD 1 117 . A ATOM 771 N N . ALA A 1 118 ? 4.569 7.215 24.440 1.0 43.96 ? 118 ALA A N 1 118 . A ATOM 772 C CA . ALA A 1 118 ? 3.843 6.027 24.848 1.0 44.58 ? 118 ALA A CA 1 118 . A ATOM 773 C C . ALA A 1 118 ? 2.539 5.955 24.069 1.0 38.59 ? 118 ALA A C 1 118 . A ATOM 774 O O . ALA A 1 118 ? 1.996 6.974 23.641 1.0 42.71 ? 118 ALA A O 1 118 . A ATOM 775 C CB . ALA A 1 118 ? 3.562 6.039 26.362 1.0 46.85 ? 118 ALA A CB 1 118 . A ATOM 776 N N . ALA A 1 119 ? 2.026 4.746 23.908 1.0 49.34 ? 119 ALA A N 1 119 . A ATOM 777 C CA . ALA A 1 119 ? 0.751 4.567 23.226 1.0 54.26 ? 119 ALA A CA 1 119 . A ATOM 778 C C . ALA A 1 119 ? -0.233 3.735 24.032 1.0 45.98 ? 119 ALA A C 1 119 . A ATOM 779 O O . ALA A 1 119 ? -1.425 4.058 24.073 1.0 50.66 ? 119 ALA A O 1 119 . A ATOM 780 C CB . ALA A 1 119 ? 0.979 3.923 21.846 1.0 43.56 ? 119 ALA A CB 1 119 . A ATOM 781 N N . THR A 1 120 ? 0.232 2.680 24.689 1.0 40.66 ? 120 THR A N 1 120 . A ATOM 782 C CA . THR A 1 120 ? -0.660 1.773 25.397 1.0 41.27 ? 120 THR A CA 1 120 . A ATOM 783 C C . THR A 1 120 ? -0.033 1.312 26.696 1.0 49.56 ? 120 THR A C 1 120 . A ATOM 784 O O . THR A 1 120 ? 1.184 1.397 26.897 1.0 53.45 ? 120 THR A O 1 120 . A ATOM 785 C CB . THR A 1 120 ? -0.982 0.527 24.574 1.0 56.49 ? 120 THR A CB 1 120 . A ATOM 786 O OG1 . THR A 1 120 ? 0.237 -0.173 24.307 1.0 42.16 ? 120 THR A OG1 1 120 . A ATOM 787 C CG2 . THR A 1 120 ? -1.629 0.905 23.276 1.0 50.17 ? 120 THR A CG2 1 120 . A ATOM 788 N N . SER A 1 121 ? -0.891 0.791 27.570 1.0 44.22 ? 121 SER A N 1 121 . A ATOM 789 C CA . SER A 1 121 ? -0.437 0.201 28.818 1.0 50.23 ? 121 SER A CA 1 121 . A ATOM 790 C C . SER A 1 121 ? -1.389 -0.909 29.225 1.0 44.25 ? 121 SER A C 1 121 . A ATOM 791 O O . SER A 1 121 ? -2.608 -0.773 29.074 1.0 53.24 ? 121 SER A O 1 121 . A ATOM 792 C CB . SER A 1 121 ? -0.356 1.248 29.931 1.0 55.3 ? 121 SER A CB 1 121 . A ATOM 793 O OG . SER A 1 121 ? 0.343 0.722 31.039 1.0 62.49 ? 121 SER A OG 1 121 . A ATOM 794 N N . THR A 1 122 ? -0.827 -1.996 29.741 1.0 46.54 ? 122 THR A N 1 122 . A ATOM 795 C CA . THR A 1 122 ? -1.586 -3.065 30.371 1.0 48.66 ? 122 THR A CA 1 122 . A ATOM 796 C C . THR A 1 122 ? -1.167 -3.149 31.835 1.0 47.39 ? 122 THR A C 1 122 . A ATOM 797 O O . THR A 1 122 ? 0.025 -3.278 32.134 1.0 47.53 ? 122 THR A O 1 122 . A ATOM 798 C CB . THR A 1 122 ? -1.351 -4.399 29.661 1.0 50.74 ? 122 THR A CB 1 122 . A ATOM 799 O OG1 . THR A 1 122 ? -1.838 -4.306 28.322 1.0 62.16 ? 122 THR A OG1 1 122 . A ATOM 800 C CG2 . THR A 1 122 ? -2.087 -5.525 30.378 1.0 53.27 ? 122 THR A CG2 1 122 . A ATOM 801 N N . GLU A 1 123 ? -2.138 -3.054 32.739 1.0 51.4 ? 123 GLU A N 1 123 . A ATOM 802 C CA . GLU A 1 123 ? -1.847 -2.922 34.162 1.0 54.46 ? 123 GLU A CA 1 123 . A ATOM 803 C C . GLU A 1 123 ? -2.639 -3.943 34.977 1.0 51.08 ? 123 GLU A C 1 123 . A ATOM 804 O O . GLU A 1 123 ? -3.814 -4.200 34.696 1.0 53.51 ? 123 GLU A O 1 123 . A ATOM 805 C CB . GLU A 1 123 ? -2.153 -1.485 34.647 1.0 58.77 ? 123 GLU A CB 1 123 . A ATOM 806 C CG . GLU A 1 123 ? -1.139 -0.444 34.164 1.0 67.14 ? 123 GLU A CG 1 123 . A ATOM 807 C CD . GLU A 1 123 ? -1.765 0.925 33.902 1.0 73.88 ? 123 GLU A CD 1 123 . A ATOM 808 O OE1 . GLU A 1 123 ? -2.864 1.201 34.421 1.0 83.45 ? 123 GLU A OE1 1 123 . A ATOM 809 O OE2 . GLU A 1 123 ? -1.154 1.726 33.166 1.0 71.41 ? 123 GLU A OE2 1 123 . A ATOM 810 N N . ARG A 1 124 ? -1.990 -4.516 35.992 1.0 44.76 ? 124 ARG A N 1 124 . A ATOM 811 C CA . ARG A 1 124 ? -2.592 -5.516 36.868 1.0 49.43 ? 124 ARG A CA 1 124 . A ATOM 812 C C . ARG A 1 124 ? -2.726 -4.949 38.277 1.0 57.11 ? 124 ARG A C 1 124 . A ATOM 813 O O . ARG A 1 124 ? -1.761 -4.394 38.808 1.0 50.46 ? 124 ARG A O 1 124 . A ATOM 814 C CB . ARG A 1 124 ? -1.739 -6.780 36.910 1.0 53.76 ? 124 ARG A CB 1 124 . A ATOM 815 C CG . ARG A 1 124 ? -2.141 -7.779 37.976 1.0 49.72 ? 124 ARG A CG 1 124 . A ATOM 816 C CD . ARG A 1 124 ? -1.044 -8.810 38.138 1.0 56.51 ? 124 ARG A CD 1 124 . A ATOM 817 N NE . ARG A 1 124 ? 0.086 -8.298 38.909 1.0 63.65 ? 124 ARG A NE 1 124 . A ATOM 818 C CZ . ARG A 1 124 ? 1.355 -8.602 38.660 1.0 61.63 ? 124 ARG A CZ 1 124 . A ATOM 819 N NH1 . ARG A 1 124 ? 1.655 -9.402 37.650 1.0 47.53 ? 124 ARG A NH1 1 124 . A ATOM 820 N NH2 . ARG A 1 124 ? 2.322 -8.103 39.421 1.0 66.87 ? 124 ARG A NH2 1 124 . A ATOM 821 N N . LEU A 1 125 ? -3.905 -5.106 38.884 1.0 45.74 ? 125 LEU A N 1 125 . A ATOM 822 C CA . LEU A 1 125 ? -4.154 -4.581 40.224 1.0 54.51 ? 125 LEU A CA 1 125 . A ATOM 823 C C . LEU A 1 125 ? -3.481 -5.478 41.263 1.0 58.9 ? 125 LEU A C 1 125 . A ATOM 824 O O . LEU A 1 125 ? -3.808 -6.664 41.369 1.0 62.09 ? 125 LEU A O 1 125 . A ATOM 825 C CB . LEU A 1 125 ? -5.656 -4.484 40.491 1.0 53.94 ? 125 LEU A CB 1 125 . A ATOM 826 C CG . LEU A 1 125 ? -6.087 -4.245 41.951 1.0 53.75 ? 125 LEU A CG 1 125 . A ATOM 827 C CD1 . LEU A 1 125 ? -5.647 -2.853 42.411 1.0 45.5 ? 125 LEU A CD1 1 125 . A ATOM 828 C CD2 . LEU A 1 125 ? -7.587 -4.408 42.105 1.0 49.39 ? 125 LEU A CD2 1 125 . A ATOM 829 N N . ASP A 1 126 ? -2.539 -4.919 42.022 1.0 56.45 ? 126 ASP A N 1 126 . A ATOM 830 C CA . ASP A 1 126 ? -1.740 -5.681 42.982 1.0 62.37 ? 126 ASP A CA 1 126 . A ATOM 831 C C . ASP A 1 126 ? -2.316 -5.673 44.398 1.0 58.33 ? 126 ASP A C 1 126 . A ATOM 832 O O . ASP A 1 126 ? -2.362 -6.721 45.051 1.0 69.45 ? 126 ASP A O 1 126 . A ATOM 833 C CB . ASP A 1 126 ? -0.302 -5.145 43.025 1.0 58.2 ? 126 ASP A CB 1 126 . A ATOM 834 C CG . ASP A 1 126 ? 0.457 -5.376 41.732 1.0 67.23 ? 126 ASP A CG 1 126 . A ATOM 835 O OD1 . ASP A 1 126 ? 0.191 -6.392 41.037 1.0 68.45 ? 126 ASP A OD1 1 126 . A ATOM 836 O OD2 . ASP A 1 126 ? 1.341 -4.542 41.427 1.0 61.16 ? 126 ASP A OD2 1 126 . A ATOM 837 N N . ILE A 1 127 ? -2.725 -4.513 44.908 1.0 63.08 ? 127 ILE A N 1 127 . A ATOM 838 C CA . ILE A 1 127 ? -3.261 -4.393 46.266 1.0 59.41 ? 127 ILE A CA 1 127 . A ATOM 839 C C . ILE A 1 127 ? -4.605 -3.689 46.181 1.0 54.77 ? 127 ILE A C 1 127 . A ATOM 840 O O . ILE A 1 127 ? -4.780 -2.761 45.385 1.0 56.89 ? 127 ILE A O 1 127 . A ATOM 841 C CB . ILE A 1 127 ? -2.305 -3.618 47.197 1.0 64.72 ? 127 ILE A CB 1 127 . A ATOM 842 C CG1 . ILE A 1 127 ? -0.893 -4.189 47.121 1.0 66.89 ? 127 ILE A CG1 1 127 . A ATOM 843 C CG2 . ILE A 1 127 ? -2.813 -3.627 48.656 1.0 50.73 ? 127 ILE A CG2 1 127 . A ATOM 844 C CD1 . ILE A 1 127 ? 0.156 -3.305 47.777 1.0 64.98 ? 127 ILE A CD1 1 127 . A ATOM 845 N N . LEU A 1 128 ? -5.571 -4.165 46.952 1.0 47.05 ? 128 LEU A N 1 128 . A ATOM 846 C CA . LEU A 1 128 ? -6.808 -3.404 47.143 1.0 61.13 ? 128 LEU A CA 1 128 . A ATOM 847 C C . LEU A 1 128 ? -7.323 -3.776 48.531 1.0 59.89 ? 128 LEU A C 1 128 . A ATOM 848 O O . LEU A 1 128 ? -8.029 -4.774 48.709 1.0 62.26 ? 128 LEU A O 1 128 . A ATOM 849 C CB . LEU A 1 128 ? -7.852 -3.660 46.070 1.0 64.95 ? 128 LEU A CB 1 128 . A ATOM 850 C CG . LEU A 1 128 ? -9.175 -2.955 46.391 1.0 66.27 ? 128 LEU A CG 1 128 . A ATOM 851 C CD1 . LEU A 1 128 ? -8.949 -1.486 46.621 1.0 74.56 ? 128 LEU A CD1 1 128 . A ATOM 852 C CD2 . LEU A 1 128 ? -10.178 -3.151 45.269 1.0 72.62 ? 128 LEU A CD2 1 128 . A ATOM 853 N N . ASP A 1 129 ? -6.946 -2.958 49.503 1.0 64.2 ? 129 ASP A N 1 129 . A ATOM 854 C CA . ASP A 1 129 ? -7.164 -3.216 50.919 1.0 58.96 ? 129 ASP A CA 1 129 . A ATOM 855 C C . ASP A 1 129 ? -8.017 -2.072 51.438 1.0 58.67 ? 129 ASP A C 1 129 . A ATOM 856 O O . ASP A 1 129 ? -7.499 -1.043 51.869 1.0 53.85 ? 129 ASP A O 1 129 . A ATOM 857 C CB . ASP A 1 129 ? -5.836 -3.308 51.651 1.0 56.13 ? 129 ASP A CB 1 129 . A ATOM 858 C CG . ASP A 1 129 ? -6.000 -3.611 53.136 1.0 66.01 ? 129 ASP A CG 1 129 . A ATOM 859 O OD1 . ASP A 1 129 ? -7.127 -3.499 53.672 1.0 68.64 ? 129 ASP A OD1 1 129 . A ATOM 860 O OD2 . ASP A 1 129 ? -4.982 -3.960 53.758 1.0 86.94 ? 129 ASP A OD2 1 129 . A ATOM 861 N N . ASP A 1 130 ? -9.336 -2.247 51.383 1.0 65.99 ? 130 ASP A N 1 130 . A ATOM 862 C CA . ASP A 1 130 ? -10.210 -1.220 51.938 1.0 71.07 ? 130 ASP A CA 1 130 . A ATOM 863 C C . ASP A 1 130 ? -9.988 -1.002 53.429 1.0 74.38 ? 130 ASP A C 1 130 . A ATOM 864 O O . ASP A 1 130 ? -10.334 0.071 53.934 1.0 74.77 ? 130 ASP A O 1 130 . A ATOM 865 C CB . ASP A 1 130 ? -11.676 -1.576 51.687 1.0 71.24 ? 130 ASP A CB 1 130 . A ATOM 866 C CG . ASP A 1 130 ? -12.013 -1.629 50.212 1.0 62.42 ? 130 ASP A CG 1 130 . A ATOM 867 O OD1 . ASP A 1 130 ? -12.209 -0.557 49.612 1.0 66.42 ? 130 ASP A OD1 1 130 . A ATOM 868 O OD2 . ASP A 1 130 ? -12.073 -2.739 49.665 1.0 80.8 ? 130 ASP A OD2 1 130 . A ATOM 869 N N . ASP A 1 131 ? -9.406 -1.977 54.136 1.0 62.17 ? 131 ASP A N 1 131 . A ATOM 870 C CA . ASP A 1 131 ? -9.261 -1.846 55.583 1.0 70.64 ? 131 ASP A CA 1 131 . A ATOM 871 C C . ASP A 1 131 ? -8.131 -0.898 55.962 1.0 62.55 ? 131 ASP A C 1 131 . A ATOM 872 O O . ASP A 1 131 ? -8.240 -0.173 56.955 1.0 64.43 ? 131 ASP A O 1 131 . A ATOM 873 C CB . ASP A 1 131 ? -9.055 -3.221 56.215 1.0 70.92 ? 131 ASP A CB 1 131 . A ATOM 874 C CG . ASP A 1 131 ? -10.298 -4.075 56.136 1.0 69.41 ? 131 ASP A CG 1 131 . A ATOM 875 O OD1 . ASP A 1 131 ? -11.384 -3.500 55.915 1.0 70.74 ? 131 ASP A OD1 1 131 . A ATOM 876 O OD2 . ASP A 1 131 ? -10.196 -5.311 56.292 1.0 71.66 ? 131 ASP A OD2 1 131 . A ATOM 877 N N . ARG A 1 132 ? -7.055 -0.871 55.180 1.0 59.75 ? 132 ARG A N 1 132 . A ATOM 878 C CA . ARG A 1 132 ? -5.954 0.055 55.414 1.0 61.83 ? 132 ARG A CA 1 132 . A ATOM 879 C C . ARG A 1 132 ? -5.962 1.241 54.448 1.0 64.96 ? 132 ARG A C 1 132 . A ATOM 880 O O . ARG A 1 132 ? -5.121 2.134 54.575 1.0 75.1 ? 132 ARG A O 1 132 . A ATOM 881 C CB . ARG A 1 132 ? -4.620 -0.701 55.329 1.0 58.11 ? 132 ARG A CB 1 132 . A ATOM 882 C CG . ARG A 1 132 ? -4.646 -2.082 56.027 1.0 68.36 ? 132 ARG A CG 1 132 . A ATOM 883 C CD . ARG A 1 132 ? -3.502 -2.203 57.002 1.0 67.77 ? 132 ARG A CD 1 132 . A ATOM 884 N NE . ARG A 1 132 ? -3.334 -0.954 57.738 1.0 75.46 ? 132 ARG A NE 1 132 . A ATOM 885 C CZ . ARG A 1 132 ? -2.265 -0.641 58.461 1.0 75.61 ? 132 ARG A CZ 1 132 . A ATOM 886 N NH1 . ARG A 1 132 ? -1.253 -1.493 58.559 1.0 85.23 ? 132 ARG A NH1 1 132 . A ATOM 887 N NH2 . ARG A 1 132 ? -2.212 0.528 59.085 1.0 77.85 ? 132 ARG A NH2 1 132 . A ATOM 888 N N . GLN A 1 133 ? -6.906 1.282 53.509 1.0 59.69 ? 133 GLN A N 1 133 . A ATOM 889 C CA . GLN A 1 133 ? -6.919 2.265 52.423 1.0 57.03 ? 133 GLN A CA 1 133 . A ATOM 890 C C . GLN A 1 133 ? -5.550 2.329 51.730 1.0 46.61 ? 133 GLN A C 1 133 . A ATOM 891 O O . GLN A 1 133 ? -4.841 3.330 51.759 1.0 51.55 ? 133 GLN A O 1 133 . A ATOM 892 C CB . GLN A 1 133 ? -7.386 3.636 52.944 1.0 51.11 ? 133 GLN A CB 1 133 . A ATOM 893 C CG . GLN A 1 133 ? -8.886 3.651 53.307 1.0 54.44 ? 133 GLN A CG 1 133 . A ATOM 894 C CD . GLN A 1 133 ? -9.378 4.991 53.837 1.0 64.63 ? 133 GLN A CD 1 133 . A ATOM 895 O OE1 . GLN A 1 133 ? -8.592 5.821 54.293 1.0 52.14 ? 133 GLN A OE1 1 133 . A ATOM 896 N NE2 . GLN A 1 133 ? -10.693 5.203 53.781 1.0 65.16 ? 133 GLN A NE2 1 133 . A ATOM 897 N N . VAL A 1 134 ? -5.193 1.209 51.101 1.0 50.0 ? 134 VAL A N 1 134 . A ATOM 898 C CA . VAL A 1 134 ? -3.985 1.108 50.284 1.0 50.76 ? 134 VAL A CA 1 134 . A ATOM 899 C C . VAL A 1 134 ? -4.338 0.371 49.002 1.0 50.46 ? 134 VAL A C 1 134 . A ATOM 900 O O . VAL A 1 134 ? -5.106 -0.592 49.023 1.0 50.05 ? 134 VAL A O 1 134 . A ATOM 901 C CB . VAL A 1 134 ? -2.829 0.375 51.001 1.0 64.28 ? 134 VAL A CB 1 134 . A ATOM 902 C CG1 . VAL A 1 134 ? -1.538 0.501 50.164 1.0 51.77 ? 134 VAL A CG1 1 134 . A ATOM 903 C CG2 . VAL A 1 134 ? -2.609 0.934 52.386 1.0 60.26 ? 134 VAL A CG2 1 134 . A ATOM 904 N N . THR A 1 135 ? -3.784 0.829 47.881 1.0 57.18 ? 135 THR A N 1 135 . A ATOM 905 C CA . THR A 1 135 ? -3.967 0.143 46.609 1.0 56.38 ? 135 THR A CA 1 135 . A ATOM 906 C C . THR A 1 135 ? -2.702 0.286 45.775 1.0 49.89 ? 135 THR A C 1 135 . A ATOM 907 O O . THR A 1 135 ? -1.857 1.139 46.044 1.0 54.94 ? 135 THR A O 1 135 . A ATOM 908 C CB . THR A 1 135 ? -5.158 0.687 45.824 1.0 54.53 ? 135 THR A CB 1 135 . A ATOM 909 O OG1 . THR A 1 135 ? -5.419 -0.182 44.716 1.0 46.73 ? 135 THR A OG1 1 135 . A ATOM 910 C CG2 . THR A 1 135 ? -4.831 2.070 45.305 1.0 45.81 ? 135 THR A CG2 1 135 . A ATOM 911 N N . GLY A 1 136 ? -2.571 -0.568 44.761 1.0 49.11 ? 136 GLY A N 1 136 . A ATOM 912 C CA . GLY A 1 136 ? -1.387 -0.527 43.922 1.0 51.9 ? 136 GLY A CA 1 136 . A ATOM 913 C C . GLY A 1 136 ? -1.525 -1.370 42.677 1.0 56.53 ? 136 GLY A C 1 136 . A ATOM 914 O O . GLY A 1 136 ? -2.361 -2.272 42.598 1.0 53.95 ? 136 GLY A O 1 136 . A ATOM 915 N N . PHE A 1 137 ? -0.681 -1.072 41.696 1.0 52.34 ? 137 PHE A N 1 137 . A ATOM 916 C CA . PHE A 1 137 ? -0.721 -1.806 40.448 1.0 48.36 ? 137 PHE A CA 1 137 . A ATOM 917 C C . PHE A 1 137 ? 0.689 -2.021 39.923 1.0 54.4 ? 137 PHE A C 1 137 . A ATOM 918 O O . PHE A 1 137 ? 1.654 -1.401 40.380 1.0 51.3 ? 137 PHE A O 1 137 . A ATOM 919 C CB . PHE A 1 137 ? -1.585 -1.089 39.412 1.0 60.43 ? 137 PHE A CB 1 137 . A ATOM 920 C CG . PHE A 1 137 ? -1.035 0.225 38.963 1.0 60.82 ? 137 PHE A CG 1 137 . A ATOM 921 C CD1 . PHE A 1 137 ? -1.330 1.387 39.658 1.0 52.39 ? 137 PHE A CD1 1 137 . A ATOM 922 C CD2 . PHE A 1 137 ? -0.209 0.300 37.859 1.0 53.57 ? 137 PHE A CD2 1 137 . A ATOM 923 C CE1 . PHE A 1 137 ? -0.825 2.612 39.243 1.0 54.19 ? 137 PHE A CE1 1 137 . A ATOM 924 C CE2 . PHE A 1 137 ? 0.301 1.523 37.443 1.0 66.71 ? 137 PHE A CE2 1 137 . A ATOM 925 C CZ . PHE A 1 137 ? -0.002 2.681 38.143 1.0 47.88 ? 137 PHE A CZ 1 137 . A ATOM 926 N N . SER A 1 138 ? 0.781 -2.951 38.974 1.0 62.46 ? 138 SER A N 1 138 . A ATOM 927 C CA . SER A 1 138 ? 1.983 -3.250 38.214 1.0 60.31 ? 138 SER A CA 1 138 . A ATOM 928 C C . SER A 1 138 ? 1.655 -3.126 36.734 1.0 49.93 ? 138 SER A C 1 138 . A ATOM 929 O O . SER A 1 138 ? 0.628 -3.640 36.280 1.0 54.19 ? 138 SER A O 1 138 . A ATOM 930 C CB . SER A 1 138 ? 2.497 -4.673 38.476 1.0 53.55 ? 138 SER A CB 1 138 . A ATOM 931 O OG . SER A 1 138 ? 3.237 -4.770 39.677 1.0 66.41 ? 138 SER A OG 1 138 . A ATOM 932 N N . ILE A 1 139 ? 2.527 -2.467 35.980 1.0 50.07 ? 139 ILE A N 1 139 . A ATOM 933 C CA . ILE A 1 139 ? 2.383 -2.413 34.525 1.0 50.55 ? 139 ILE A CA 1 139 . A ATOM 934 C C . ILE A 1 139 ? 3.013 -3.660 33.932 1.0 52.87 ? 139 ILE A C 1 139 . A ATOM 935 O O . ILE A 1 139 ? 4.233 -3.843 34.004 1.0 58.68 ? 139 ILE A O 1 139 . A ATOM 936 C CB . ILE A 1 139 ? 3.029 -1.158 33.933 1.0 50.27 ? 139 ILE A CB 1 139 . A ATOM 937 C CG1 . ILE A 1 139 ? 2.301 0.090 34.419 1.0 48.54 ? 139 ILE A CG1 1 139 . A ATOM 938 C CG2 . ILE A 1 139 ? 3.045 -1.257 32.393 1.0 56.75 ? 139 ILE A CG2 1 139 . A ATOM 939 C CD1 . ILE A 1 139 ? 2.943 1.365 33.953 1.0 48.85 ? 139 ILE A CD1 1 139 . A ATOM 940 N N . ILE A 1 140 ? 2.192 -4.499 33.311 1.0 53.92 ? 140 ILE A N 1 140 . A ATOM 941 C CA . ILE A 1 140 ? 2.658 -5.773 32.792 1.0 56.61 ? 140 ILE A CA 1 140 . A ATOM 942 C C . ILE A 1 140 ? 2.724 -5.787 31.265 1.0 60.67 ? 140 ILE A C 1 140 . A ATOM 943 O O . ILE A 1 140 ? 2.864 -6.861 30.671 1.0 72.63 ? 140 ILE A O 1 140 . A ATOM 944 C CB . ILE A 1 140 ? 1.794 -6.928 33.323 1.0 50.24 ? 140 ILE A CB 1 140 . A ATOM 945 C CG1 . ILE A 1 140 ? 0.328 -6.707 32.965 1.0 49.3 ? 140 ILE A CG1 1 140 . A ATOM 946 C CG2 . ILE A 1 140 ? 1.943 -7.047 34.843 1.0 54.06 ? 140 ILE A CG2 1 140 . A ATOM 947 C CD1 . ILE A 1 140 ? -0.553 -7.931 33.182 1.0 50.89 ? 140 ILE A CD1 1 140 . A ATOM 948 N N . GLY A 1 141 ? 2.643 -4.630 30.614 1.0 54.03 ? 141 GLY A N 1 141 . A ATOM 949 C CA . GLY A 1 141 ? 2.715 -4.595 29.166 1.0 60.76 ? 141 GLY A CA 1 141 . A ATOM 950 C C . GLY A 1 141 ? 2.460 -3.209 28.601 1.0 60.92 ? 141 GLY A C 1 141 . A ATOM 951 O O . GLY A 1 141 ? 2.193 -2.240 29.321 1.0 56.03 ? 141 GLY A O 1 141 . A ATOM 952 N N . GLY A 1 142 ? 2.564 -3.133 27.279 1.0 56.34 ? 142 GLY A N 1 142 . A ATOM 953 C CA . GLY A 1 142 ? 2.224 -1.925 26.556 1.0 52.87 ? 142 GLY A CA 1 142 . A ATOM 954 C C . GLY A 1 142 ? 3.395 -1.316 25.812 1.0 60.22 ? 142 GLY A C 1 142 . A ATOM 955 O O . GLY A 1 142 ? 4.541 -1.744 25.991 1.0 63.74 ? 142 GLY A O 1 142 . A ATOM 956 N N . GLU A 1 143 ? 3.114 -0.318 24.970 1.0 52.78 ? 143 GLU A N 1 143 . A ATOM 957 C CA . GLU A 1 143 ? 4.147 0.424 24.250 1.0 55.33 ? 143 GLU A CA 1 143 . A ATOM 958 C C . GLU A 1 143 ? 4.478 1.657 25.068 1.0 45.28 ? 143 GLU A C 1 143 . A ATOM 959 O O . GLU A 1 143 ? 3.718 2.630 25.084 1.0 49.19 ? 143 GLU A O 1 143 . A ATOM 960 C CB . GLU A 1 143 ? 3.691 0.815 22.845 1.0 55.66 ? 143 GLU A CB 1 143 . A ATOM 961 C CG . GLU A 1 143 ? 3.256 -0.333 21.962 1.0 74.51 ? 143 GLU A CG 1 143 . A ATOM 962 C CD . GLU A 1 143 ? 2.785 0.140 20.589 1.0 89.84 ? 143 GLU A CD 1 143 . A ATOM 963 O OE1 . GLU A 1 143 ? 3.367 1.109 20.044 1.0 76.92 ? 143 GLU A OE1 1 143 . A ATOM 964 O OE2 . GLU A 1 143 ? 1.815 -0.448 20.065 1.0 102.05 ? 143 GLU A OE2 1 143 . A ATOM 965 N N . HIS A 1 144 ? 5.620 1.613 25.743 1.0 47.35 ? 144 HIS A N 1 144 . A ATOM 966 C CA . HIS A 1 144 ? 6.040 2.690 26.632 1.0 44.79 ? 144 HIS A CA 1 144 . A ATOM 967 C C . HIS A 1 144 ? 7.401 2.312 27.177 1.0 46.04 ? 144 HIS A C 1 144 . A ATOM 968 O O . HIS A 1 144 ? 7.877 1.190 26.954 1.0 49.85 ? 144 HIS A O 1 144 . A ATOM 969 C CB . HIS A 1 144 ? 5.040 2.902 27.767 1.0 47.04 ? 144 HIS A CB 1 144 . A ATOM 970 C CG . HIS A 1 144 ? 4.826 1.677 28.600 1.0 59.83 ? 144 HIS A CG 1 144 . A ATOM 971 N ND1 . HIS A 1 144 ? 5.752 1.230 29.519 1.0 63.76 ? 144 HIS A ND1 1 144 . A ATOM 972 C CD2 . HIS A 1 144 ? 3.810 0.781 28.625 1.0 57.84 ? 144 HIS A CD2 1 144 . A ATOM 973 C CE1 . HIS A 1 144 ? 5.310 0.117 30.079 1.0 55.23 ? 144 HIS A CE1 1 144 . A ATOM 974 N NE2 . HIS A 1 144 ? 4.134 -0.176 29.553 1.0 52.86 ? 144 HIS A NE2 1 144 . A ATOM 975 N N . ARG A 1 145 ? 8.022 3.217 27.911 1.0 43.34 ? 145 ARG A N 1 145 . A ATOM 976 C CA . ARG A 1 145 ? 9.388 3.017 28.364 1.0 47.97 ? 145 ARG A CA 1 145 . A ATOM 977 C C . ARG A 1 145 ? 9.489 2.949 29.886 1.0 50.9 ? 145 ARG A C 1 145 . A ATOM 978 O O . ARG A 1 145 ? 10.556 3.189 30.445 1.0 58.87 ? 145 ARG A O 1 145 . A ATOM 979 C CB . ARG A 1 145 ? 10.284 4.111 27.790 1.0 52.05 ? 145 ARG A CB 1 145 . A ATOM 980 C CG . ARG A 1 145 ? 9.916 4.386 26.322 1.0 57.16 ? 145 ARG A CG 1 145 . A ATOM 981 C CD . ARG A 1 145 ? 11.107 4.731 25.455 1.0 57.77 ? 145 ARG A CD 1 145 . A ATOM 982 N NE . ARG A 1 145 ? 11.947 5.735 26.084 1.0 68.17 ? 145 ARG A NE 1 145 . A ATOM 983 C CZ . ARG A 1 145 ? 13.196 5.510 26.468 1.0 68.15 ? 145 ARG A CZ 1 145 . A ATOM 984 N NH1 . ARG A 1 145 ? 13.745 4.330 26.253 1.0 64.5 ? 145 ARG A NH1 1 145 . A ATOM 985 N NH2 . ARG A 1 145 ? 13.893 6.468 27.058 1.0 68.24 ? 145 ARG A NH2 1 145 . A ATOM 986 N N . LEU A 1 146 ? 8.392 2.625 30.570 1.0 51.05 ? 146 LEU A N 1 146 . A ATOM 987 C CA . LEU A 1 146 ? 8.459 2.409 32.021 1.0 53.51 ? 146 LEU A CA 1 146 . A ATOM 988 C C . LEU A 1 146 ? 8.260 0.932 32.354 1.0 45.78 ? 146 LEU A C 1 146 . A ATOM 989 O O . LEU A 1 146 ? 7.261 0.551 32.975 1.0 54.88 ? 146 LEU A O 1 146 . A ATOM 990 C CB . LEU A 1 146 ? 7.420 3.261 32.761 1.0 42.7 ? 146 LEU A CB 1 146 . A ATOM 991 C CG . LEU A 1 146 ? 7.557 4.781 32.643 1.0 45.95 ? 146 LEU A CG 1 146 . A ATOM 992 C CD1 . LEU A 1 146 ? 6.566 5.487 33.537 1.0 39.04 ? 146 LEU A CD1 1 146 . A ATOM 993 C CD2 . LEU A 1 146 ? 8.975 5.206 32.975 1.0 43.19 ? 146 LEU A CD2 1 146 . A ATOM 994 N N . ARG A 1 147 ? 9.204 0.089 31.958 1.0 43.83 ? 147 ARG A N 1 147 . A ATOM 995 C CA . ARG A 1 147 ? 8.985 -1.344 32.087 1.0 56.76 ? 147 ARG A CA 1 147 . A ATOM 996 C C . ARG A 1 147 ? 9.093 -1.755 33.550 1.0 59.9 ? 147 ARG A C 1 147 . A ATOM 997 O O . ARG A 1 147 ? 9.939 -1.248 34.291 1.0 68.73 ? 147 ARG A O 1 147 . A ATOM 998 C CB . ARG A 1 147 ? 9.996 -2.123 31.243 1.0 54.74 ? 147 ARG A CB 1 147 . A ATOM 999 C CG . ARG A 1 147 ? 10.408 -1.433 29.947 1.0 72.59 ? 147 ARG A CG 1 147 . A ATOM 1000 C CD . ARG A 1 147 ? 9.218 -1.102 29.058 1.0 73.78 ? 147 ARG A CD 1 147 . A ATOM 1001 N NE . ARG A 1 147 ? 8.341 -2.249 28.846 1.0 79.88 ? 147 ARG A NE 1 147 . A ATOM 1002 C CZ . ARG A 1 147 ? 7.287 -2.237 28.036 1.0 84.28 ? 147 ARG A CZ 1 147 . A ATOM 1003 N NH1 . ARG A 1 147 ? 6.980 -1.138 27.358 1.0 83.57 ? 147 ARG A NH1 1 147 . A ATOM 1004 N NH2 . ARG A 1 147 ? 6.538 -3.321 27.901 1.0 87.9 ? 147 ARG A NH2 1 147 . A ATOM 1005 N N . ASN A 1 148 ? 8.219 -2.672 33.968 1.0 61.39 ? 148 ASN A N 1 148 . A ATOM 1006 C CA . ASN A 1 148 ? 8.192 -3.198 35.333 1.0 67.69 ? 148 ASN A CA 1 148 . A ATOM 1007 C C . ASN A 1 148 ? 7.814 -2.131 36.357 1.0 59.88 ? 148 ASN A C 1 148 . A ATOM 1008 O O . ASN A 1 148 ? 8.182 -2.232 37.532 1.0 55.25 ? 148 ASN A O 1 148 . A ATOM 1009 C CB . ASN A 1 148 ? 9.534 -3.844 35.700 1.0 56.24 ? 148 ASN A CB 1 148 . A ATOM 1010 C CG . ASN A 1 148 ? 9.882 -5.030 34.797 1.0 66.75 ? 148 ASN A CG 1 148 . A ATOM 1011 O OD1 . ASN A 1 148 ? 9.039 -5.882 34.511 1.0 61.08 ? 148 ASN A OD1 1 148 . A ATOM 1012 N ND2 . ASN A 1 148 ? 11.130 -5.085 34.352 1.0 75.22 ? 148 ASN A ND2 1 148 . A ATOM 1013 N N . TYR A 1 149 ? 7.096 -1.101 35.915 1.0 57.36 ? 149 TYR A N 1 149 . A ATOM 1014 C CA . TYR A 1 149 ? 6.587 -0.064 36.802 1.0 59.1 ? 149 TYR A CA 1 149 . A ATOM 1015 C C . TYR A 1 149 ? 5.609 -0.670 37.796 1.0 55.14 ? 149 TYR A C 1 149 . A ATOM 1016 O O . TYR A 1 149 ? 4.620 -1.293 37.395 1.0 48.83 ? 149 TYR A O 1 149 . A ATOM 1017 C CB . TYR A 1 149 ? 5.904 1.024 35.980 1.0 58.77 ? 149 TYR A CB 1 149 . A ATOM 1018 C CG . TYR A 1 149 ? 5.448 2.235 36.762 1.0 50.06 ? 149 TYR A CG 1 149 . A ATOM 1019 C CD1 . TYR A 1 149 ? 6.281 3.339 36.914 1.0 53.05 ? 149 TYR A CD1 1 149 . A ATOM 1020 C CD2 . TYR A 1 149 ? 4.172 2.298 37.301 1.0 47.29 ? 149 TYR A CD2 1 149 . A ATOM 1021 C CE1 . TYR A 1 149 ? 5.866 4.469 37.612 1.0 45.79 ? 149 TYR A CE1 1 149 . A ATOM 1022 C CE2 . TYR A 1 149 ? 3.747 3.418 38.007 1.0 50.44 ? 149 TYR A CE2 1 149 . A ATOM 1023 C CZ . TYR A 1 149 ? 4.599 4.498 38.151 1.0 47.59 ? 149 TYR A CZ 1 149 . A ATOM 1024 O OH . TYR A 1 149 ? 4.189 5.604 38.848 1.0 42.87 ? 149 TYR A OH 1 149 . A ATOM 1025 N N . ARG A 1 150 ? 5.891 -0.501 39.088 1.0 46.41 ? 150 ARG A N 1 150 . A ATOM 1026 C CA . ARG A 1 150 ? 4.999 -0.913 40.161 1.0 52.77 ? 150 ARG A CA 1 150 . A ATOM 1027 C C . ARG A 1 150 ? 4.787 0.280 41.078 1.0 52.1 ? 150 ARG A C 1 150 . A ATOM 1028 O O . ARG A 1 150 ? 5.748 0.957 41.453 1.0 55.91 ? 150 ARG A O 1 150 . A ATOM 1029 C CB . ARG A 1 150 ? 5.559 -2.077 40.999 1.0 58.5 ? 150 ARG A CB 1 150 . A ATOM 1030 C CG . ARG A 1 150 ? 6.137 -3.253 40.230 1.0 84.18 ? 150 ARG A CG 1 150 . A ATOM 1031 C CD . ARG A 1 150 ? 7.228 -3.952 41.057 1.0 80.52 ? 150 ARG A CD 1 150 . A ATOM 1032 N NE . ARG A 1 150 ? 6.853 -4.138 42.457 1.0 73.36 ? 150 ARG A NE 1 150 . A ATOM 1033 C CZ . ARG A 1 150 ? 7.727 -4.352 43.439 1.0 76.98 ? 150 ARG A CZ 1 150 . A ATOM 1034 N NH1 . ARG A 1 150 ? 7.310 -4.518 44.691 1.0 69.39 ? 150 ARG A NH1 1 150 . A ATOM 1035 N NH2 . ARG A 1 150 ? 9.027 -4.383 43.172 1.0 74.53 ? 150 ARG A NH2 1 150 . A ATOM 1036 N N . SER A 1 151 ? 3.538 0.511 41.465 1.0 48.25 ? 151 SER A N 1 151 . A ATOM 1037 C CA . SER A 1 151 ? 3.208 1.688 42.251 1.0 51.57 ? 151 SER A CA 1 151 . A ATOM 1038 C C . SER A 1 151 ? 2.294 1.303 43.405 1.0 48.49 ? 151 SER A C 1 151 . A ATOM 1039 O O . SER A 1 151 ? 1.591 0.291 43.366 1.0 45.37 ? 151 SER A O 1 151 . A ATOM 1040 C CB . SER A 1 151 ? 2.558 2.774 41.377 1.0 42.56 ? 151 SER A CB 1 151 . A ATOM 1041 O OG . SER A 1 151 ? 2.009 3.792 42.175 1.0 67.71 ? 151 SER A OG 1 151 . A ATOM 1042 N N . VAL A 1 152 ? 2.319 2.132 44.440 1.0 54.56 ? 152 VAL A N 1 152 . A ATOM 1043 C CA . VAL A 1 152 ? 1.520 1.937 45.640 1.0 56.45 ? 152 VAL A CA 1 152 . A ATOM 1044 C C . VAL A 1 152 ? 0.981 3.291 46.064 1.0 60.73 ? 152 VAL A C 1 152 . A ATOM 1045 O O . VAL A 1 152 ? 1.727 4.275 46.107 1.0 47.49 ? 152 VAL A O 1 152 . A ATOM 1046 C CB . VAL A 1 152 ? 2.347 1.306 46.776 1.0 60.96 ? 152 VAL A CB 1 152 . A ATOM 1047 C CG1 . VAL A 1 152 ? 1.507 1.175 48.046 1.0 60.18 ? 152 VAL A CG1 1 152 . A ATOM 1048 C CG2 . VAL A 1 152 ? 2.930 -0.027 46.337 1.0 54.42 ? 152 VAL A CG2 1 152 . A ATOM 1049 N N . THR A 1 153 ? -0.308 3.344 46.378 1.0 50.85 ? 153 THR A N 1 153 . A ATOM 1050 C CA . THR A 1 153 ? -0.955 4.569 46.810 1.0 49.18 ? 153 THR A CA 1 153 . A ATOM 1051 C C . THR A 1 153 ? -1.658 4.290 48.129 1.0 57.54 ? 153 THR A C 1 153 . A ATOM 1052 O O . THR A 1 153 ? -2.442 3.342 48.223 1.0 51.74 ? 153 THR A O 1 153 . A ATOM 1053 C CB . THR A 1 153 ? -1.936 5.055 45.745 1.0 50.14 ? 153 THR A CB 1 153 . A ATOM 1054 O OG1 . THR A 1 153 ? -1.245 5.180 44.489 1.0 49.97 ? 153 THR A OG1 1 153 . A ATOM 1055 C CG2 . THR A 1 153 ? -2.526 6.382 46.123 1.0 50.21 ? 153 THR A CG2 1 153 . A ATOM 1056 N N . SER A 1 154 ? -1.363 5.099 49.140 1.0 55.18 ? 154 SER A N 1 154 . A ATOM 1057 C CA . SER A 1 154 ? -1.945 4.964 50.464 1.0 57.99 ? 154 SER A CA 1 154 . A ATOM 1058 C C . SER A 1 154 ? -2.521 6.307 50.913 1.0 62.49 ? 154 SER A C 1 154 . A ATOM 1059 O O . SER A 1 154 ? -1.915 7.367 50.708 1.0 56.22 ? 154 SER A O 1 154 . A ATOM 1060 C CB . SER A 1 154 ? -0.899 4.453 51.467 1.0 58.9 ? 154 SER A CB 1 154 . A ATOM 1061 O OG . SER A 1 154 ? 0.187 5.366 51.603 1.0 58.46 ? 154 SER A OG 1 154 . A ATOM 1062 N N . VAL A 1 155 ? -3.711 6.247 51.515 1.0 62.01 ? 155 VAL A N 1 155 . A ATOM 1063 C CA . VAL A 1 155 ? -4.468 7.420 51.945 1.0 56.54 ? 155 VAL A CA 1 155 . A ATOM 1064 C C . VAL A 1 155 ? -4.394 7.520 53.466 1.0 54.22 ? 155 VAL A C 1 155 . A ATOM 1065 O O . VAL A 1 155 ? -4.505 6.509 54.169 1.0 58.18 ? 155 VAL A O 1 155 . A ATOM 1066 C CB . VAL A 1 155 ? -5.929 7.336 51.457 1.0 47.76 ? 155 VAL A CB 1 155 . A ATOM 1067 C CG1 . VAL A 1 155 ? -6.681 8.619 51.765 1.0 50.38 ? 155 VAL A CG1 1 155 . A ATOM 1068 C CG2 . VAL A 1 155 ? -5.962 7.052 49.959 1.0 45.56 ? 155 VAL A CG2 1 155 . A ATOM 1069 N N . HIS A 1 156 ? -4.203 8.733 53.976 1.0 48.38 ? 156 HIS A N 1 156 . A ATOM 1070 C CA . HIS A 1 156 ? -4.015 8.932 55.412 1.0 54.0 ? 156 HIS A CA 1 156 . A ATOM 1071 C C . HIS A 1 156 ? -4.801 10.160 55.847 1.0 59.04 ? 156 HIS A C 1 156 . A ATOM 1072 O O . HIS A 1 156 ? -4.568 11.265 55.342 1.0 56.57 ? 156 HIS A O 1 156 . A ATOM 1073 C CB . HIS A 1 156 ? -2.534 9.072 55.750 1.0 56.9 ? 156 HIS A CB 1 156 . A ATOM 1074 C CG . HIS A 1 156 ? -1.685 8.002 55.141 1.0 59.05 ? 156 HIS A CG 1 156 . A ATOM 1075 N ND1 . HIS A 1 156 ? -1.294 6.876 55.834 1.0 56.02 ? 156 HIS A ND1 1 156 . A ATOM 1076 C CD2 . HIS A 1 156 ? -1.184 7.867 53.887 1.0 57.16 ? 156 HIS A CD2 1 156 . A ATOM 1077 C CE1 . HIS A 1 156 ? -0.569 6.105 55.043 1.0 65.21 ? 156 HIS A CE1 1 156 . A ATOM 1078 N NE2 . HIS A 1 156 ? -0.487 6.682 53.854 1.0 60.16 ? 156 HIS A NE2 1 156 . A ATOM 1079 N N . GLY A 1 157 ? -5.743 9.961 56.772 1.0 55.65 ? 157 GLY A N 1 157 . A ATOM 1080 C CA . GLY A 1 157 ? -6.526 11.063 57.280 1.0 57.72 ? 157 GLY A CA 1 157 . A ATOM 1081 C C . GLY A 1 157 ? -5.821 11.793 58.405 1.0 57.1 ? 157 GLY A C 1 157 . A ATOM 1082 O O . GLY A 1 157 ? -5.027 11.218 59.150 1.0 56.98 ? 157 GLY A O 1 157 . A ATOM 1083 N N . PHE A 1 158 ? -6.114 13.089 58.506 1.0 54.53 ? 158 PHE A N 1 158 . A ATOM 1084 C CA . PHE A 1 158 ? -5.640 13.920 59.600 1.0 58.71 ? 158 PHE A CA 1 158 . A ATOM 1085 C C . PHE A 1 158 ? -6.763 14.836 60.066 1.0 67.46 ? 158 PHE A C 1 158 . A ATOM 1086 O O . PHE A 1 158 ? -7.583 15.297 59.268 1.0 65.27 ? 158 PHE A O 1 158 . A ATOM 1087 C CB . PHE A 1 158 ? -4.414 14.749 59.200 1.0 50.97 ? 158 PHE A CB 1 158 . A ATOM 1088 C CG . PHE A 1 158 ? -3.160 13.934 59.043 1.0 60.15 ? 158 PHE A CG 1 158 . A ATOM 1089 C CD1 . PHE A 1 158 ? -2.829 13.356 57.819 1.0 57.64 ? 158 PHE A CD1 1 158 . A ATOM 1090 C CD2 . PHE A 1 158 ? -2.318 13.731 60.123 1.0 66.38 ? 158 PHE A CD2 1 158 . A ATOM 1091 C CE1 . PHE A 1 158 ? -1.670 12.599 57.685 1.0 52.82 ? 158 PHE A CE1 1 158 . A ATOM 1092 C CE2 . PHE A 1 158 ? -1.158 12.984 60.000 1.0 64.53 ? 158 PHE A CE2 1 158 . A ATOM 1093 C CZ . PHE A 1 158 ? -0.834 12.411 58.783 1.0 57.06 ? 158 PHE A CZ 1 158 . A ATOM 1094 N N . ASN A 1 159 ? -6.797 15.078 61.378 1.0 73.13 ? 159 ASN A N 1 159 . A ATOM 1095 C CA . ASN A 1 159 ? -7.768 15.969 62.004 1.0 74.78 ? 159 ASN A CA 1 159 . A ATOM 1096 C C . ASN A 1 159 ? -7.016 16.848 62.993 1.0 79.66 ? 159 ASN A C 1 159 . A ATOM 1097 O O . ASN A 1 159 ? -6.511 16.352 64.008 1.0 80.28 ? 159 ASN A O 1 159 . A ATOM 1098 C CB . ASN A 1 159 ? -8.879 15.182 62.701 1.0 84.86 ? 159 ASN A CB 1 159 . A ATOM 1099 C CG . ASN A 1 159 ? -9.813 16.075 63.510 1.0 104.73 ? 159 ASN A CG 1 159 . A ATOM 1100 O OD1 . ASN A 1 159 ? -9.412 16.670 64.513 1.0 107.77 ? 159 ASN A OD1 1 159 . A ATOM 1101 N ND2 . ASN A 1 159 ? -11.069 16.155 63.086 1.0 110.09 ? 159 ASN A ND2 1 159 . A ATOM 1102 N N . ARG A 1 160 ? -6.940 18.142 62.697 1.0 77.41 ? 160 ARG A N 1 160 . A ATOM 1103 C CA . ARG A 1 160 ? -6.250 19.116 63.540 1.0 97.92 ? 160 ARG A CA 1 160 . A ATOM 1104 C C . ARG A 1 160 ? -7.261 20.172 63.979 1.0 111.01 ? 160 ARG A C 1 160 . A ATOM 1105 O O . ARG A 1 160 ? -7.588 21.083 63.211 1.0 112.79 ? 160 ARG A O 1 160 . A ATOM 1106 C CB . ARG A 1 160 ? -5.077 19.751 62.799 1.0 96.28 ? 160 ARG A CB 1 160 . A ATOM 1107 C CG . ARG A 1 160 ? -3.719 19.556 63.462 1.0 94.64 ? 160 ARG A CG 1 160 . A ATOM 1108 C CD . ARG A 1 160 ? -2.633 20.328 62.718 1.0 95.28 ? 160 ARG A CD 1 160 . A ATOM 1109 N NE . ARG A 1 160 ? -2.220 21.534 63.435 1.0 102.04 ? 160 ARG A NE 1 160 . A ATOM 1110 C CZ . ARG A 1 160 ? -1.018 21.702 63.980 1.0 104.68 ? 160 ARG A CZ 1 160 . A ATOM 1111 N NH1 . ARG A 1 160 ? -0.105 20.743 63.878 1.0 110.88 ? 160 ARG A NH1 1 160 . A ATOM 1112 N NH2 . ARG A 1 160 ? -0.723 22.829 64.621 1.0 98.84 ? 160 ARG A NH2 1 160 . A ATOM 1113 N N . ASP A 1 161 ? -7.749 20.049 65.216 1.0 114.6 ? 161 ASP A N 1 161 . A ATOM 1114 C CA . ASP A 1 161 ? -8.678 21.017 65.799 1.0 104.02 ? 161 ASP A CA 1 161 . A ATOM 1115 C C . ASP A 1 161 ? -9.944 21.155 64.955 1.0 102.66 ? 161 ASP A C 1 161 . A ATOM 1116 O O . ASP A 1 161 ? -10.400 22.259 64.649 1.0 100.59 ? 161 ASP A O 1 161 . A ATOM 1117 C CB . ASP A 1 161 ? -7.998 22.371 65.994 1.0 104.35 ? 161 ASP A CB 1 161 . A ATOM 1118 C CG . ASP A 1 161 ? -7.566 22.600 67.429 1.0 114.18 ? 161 ASP A CG 1 161 . A ATOM 1119 O OD1 . ASP A 1 161 ? -7.244 21.608 68.118 1.0 114.42 ? 161 ASP A OD1 1 161 . A ATOM 1120 O OD2 . ASP A 1 161 ? -7.561 23.771 67.870 1.0 120.81 ? 161 ASP A OD2 1 161 . A ATOM 1121 N N . GLY A 1 162 ? -10.515 20.014 64.576 1.0 105.73 ? 162 GLY A N 1 162 . A ATOM 1122 C CA . GLY A 1 162 ? -11.736 19.991 63.802 1.0 102.49 ? 162 GLY A CA 1 162 . A ATOM 1123 C C . GLY A 1 162 ? -11.567 20.134 62.305 1.0 97.79 ? 162 GLY A C 1 162 . A ATOM 1124 O O . GLY A 1 162 ? -12.546 19.941 61.571 1.0 99.25 ? 162 GLY A O 1 162 . A ATOM 1125 N N . ALA A 1 163 ? -10.372 20.468 61.822 1.0 91.35 ? 163 ALA A N 1 163 . A ATOM 1126 C CA . ALA A 1 163 ? -10.116 20.568 60.389 1.0 83.2 ? 163 ALA A CA 1 163 . A ATOM 1127 C C . ALA A 1 163 ? -9.665 19.218 59.838 1.0 74.68 ? 163 ALA A C 1 163 . A ATOM 1128 O O . ALA A 1 163 ? -8.687 18.639 60.321 1.0 78.07 ? 163 ALA A O 1 163 . A ATOM 1129 C CB . ALA A 1 163 ? -9.060 21.636 60.109 1.0 81.75 ? 163 ALA A CB 1 163 . A ATOM 1130 N N . ILE A 1 164 ? -10.365 18.732 58.814 1.0 79.01 ? 164 ILE A N 1 164 . A ATOM 1131 C CA . ILE A 1 164 ? -10.177 17.385 58.278 1.0 73.88 ? 164 ILE A CA 1 164 . A ATOM 1132 C C . ILE A 1 164 ? -9.518 17.474 56.902 1.0 76.47 ? 164 ILE A C 1 164 . A ATOM 1133 O O . ILE A 1 164 ? -10.104 18.021 55.957 1.0 75.15 ? 164 ILE A O 1 164 . A ATOM 1134 C CB . ILE A 1 164 ? -11.511 16.631 58.185 1.0 72.48 ? 164 ILE A CB 1 164 . A ATOM 1135 C CG1 . ILE A 1 164 ? -12.293 16.762 59.491 1.0 78.3 ? 164 ILE A CG1 1 164 . A ATOM 1136 C CG2 . ILE A 1 164 ? -11.266 15.169 57.866 1.0 72.21 ? 164 ILE A CG2 1 164 . A ATOM 1137 C CD1 . ILE A 1 164 ? -12.020 15.655 60.465 1.0 79.62 ? 164 ILE A CD1 1 164 . A ATOM 1138 N N . CYS A 1 165 ? -8.316 16.912 56.783 1.0 64.19 ? 165 CYS A N 1 165 . A ATOM 1139 C CA . CYS A 1 165 ? -7.601 16.821 55.518 1.0 69.33 ? 165 CYS A CA 1 165 . A ATOM 1140 C C . CYS A 1 165 ? -7.103 15.391 55.326 1.0 67.81 ? 165 CYS A C 1 165 . A ATOM 1141 O O . CYS A 1 165 ? -7.286 14.518 56.185 1.0 59.83 ? 165 CYS A O 1 165 . A ATOM 1142 C CB . CYS A 1 165 ? -6.434 17.818 55.457 1.0 75.64 ? 165 CYS A CB 1 165 . A ATOM 1143 S SG . CYS A 1 165 ? -5.015 17.375 56.500 1.0 83.03 ? 165 CYS A SG 1 165 . A ATOM 1144 N N . THR A 1 166 ? -6.461 15.161 54.180 1.0 53.75 ? 166 THR A N 1 166 . A ATOM 1145 C CA . THR A 1 166 ? -5.949 13.858 53.783 1.0 53.92 ? 166 THR A CA 1 166 . A ATOM 1146 C C . THR A 1 166 ? -4.568 14.040 53.168 1.0 67.51 ? 166 THR A C 1 166 . A ATOM 1147 O O . THR A 1 166 ? -4.357 14.966 52.378 1.0 55.27 ? 166 THR A O 1 166 . A ATOM 1148 C CB . THR A 1 166 ? -6.898 13.202 52.768 1.0 64.07 ? 166 THR A CB 1 166 . A ATOM 1149 O OG1 . THR A 1 166 ? -8.168 12.961 53.388 1.0 74.21 ? 166 THR A OG1 1 166 . A ATOM 1150 C CG2 . THR A 1 166 ? -6.327 11.893 52.210 1.0 50.52 ? 166 THR A CG2 1 166 . A ATOM 1151 N N . VAL A 1 167 ? -3.617 13.179 53.535 1.0 56.36 ? 167 VAL A N 1 167 . A ATOM 1152 C CA . VAL A 1 167 ? -2.350 13.098 52.814 1.0 48.89 ? 167 VAL A CA 1 167 . A ATOM 1153 C C . VAL A 1 167 ? -2.328 11.803 52.029 1.0 47.96 ? 167 VAL A C 1 167 . A ATOM 1154 O O . VAL A 1 167 ? -2.497 10.717 52.596 1.0 50.02 ? 167 VAL A O 1 167 . A ATOM 1155 C CB . VAL A 1 167 ? -1.120 13.184 53.729 1.0 50.61 ? 167 VAL A CB 1 167 . A ATOM 1156 C CG1 . VAL A 1 167 ? 0.140 12.979 52.880 1.0 40.56 ? 167 VAL A CG1 1 167 . A ATOM 1157 C CG2 . VAL A 1 167 ? -1.062 14.549 54.414 1.0 50.1 ? 167 VAL A CG2 1 167 . A ATOM 1158 N N . VAL A 1 168 ? -2.117 11.919 50.729 1.0 49.58 ? 168 VAL A N 1 168 . A ATOM 1159 C CA . VAL A 1 168 ? -1.954 10.773 49.856 1.0 47.59 ? 168 VAL A CA 1 168 . A ATOM 1160 C C . VAL A 1 168 ? -0.464 10.580 49.610 1.0 44.87 ? 168 VAL A C 1 168 . A ATOM 1161 O O . VAL A 1 168 ? 0.259 11.543 49.313 1.0 49.04 ? 168 VAL A O 1 168 . A ATOM 1162 C CB . VAL A 1 168 ? -2.726 10.968 48.541 1.0 49.82 ? 168 VAL A CB 1 168 . A ATOM 1163 C CG1 . VAL A 1 168 ? -2.485 9.806 47.606 1.0 38.57 ? 168 VAL A CG1 1 168 . A ATOM 1164 C CG2 . VAL A 1 168 ? -4.209 11.108 48.812 1.0 45.44 ? 168 VAL A CG2 1 168 . A ATOM 1165 N N . LEU A 1 169 ? -0.005 9.343 49.748 1.0 45.9 ? 169 LEU A N 1 169 . A ATOM 1166 C CA . LEU A 1 169 ? 1.356 8.948 49.421 1.0 44.54 ? 169 LEU A CA 1 169 . A ATOM 1167 C C . LEU A 1 169 ? 1.317 8.022 48.217 1.0 48.78 ? 169 LEU A C 1 169 . A ATOM 1168 O O . LEU A 1 169 ? 0.533 7.069 48.183 1.0 48.03 ? 169 LEU A O 1 169 . A ATOM 1169 C CB . LEU A 1 169 ? 2.035 8.228 50.591 1.0 40.97 ? 169 LEU A CB 1 169 . A ATOM 1170 C CG . LEU A 1 169 ? 2.219 8.956 51.934 1.0 43.52 ? 169 LEU A CG 1 169 . A ATOM 1171 C CD1 . LEU A 1 169 ? 2.686 7.944 52.952 1.0 47.22 ? 169 LEU A CD1 1 169 . A ATOM 1172 C CD2 . LEU A 1 169 ? 3.224 10.080 51.812 1.0 46.25 ? 169 LEU A CD2 1 169 . A ATOM 1173 N N . GLU A 1 170 ? 2.145 8.319 47.224 1.0 47.42 ? 170 GLU A N 1 170 . A ATOM 1174 C CA . GLU A 1 170 ? 2.257 7.464 46.055 1.0 50.52 ? 170 GLU A CA 1 170 . A ATOM 1175 C C . GLU A 1 170 ? 3.731 7.292 45.762 1.0 44.45 ? 170 GLU A C 1 170 . A ATOM 1176 O O . GLU A 1 170 ? 4.460 8.280 45.657 1.0 56.77 ? 170 GLU A O 1 170 . A ATOM 1177 C CB . GLU A 1 170 ? 1.521 8.047 44.843 1.0 50.41 ? 170 GLU A CB 1 170 . A ATOM 1178 C CG . GLU A 1 170 ? 1.549 7.097 43.620 1.0 59.43 ? 170 GLU A CG 1 170 . A ATOM 1179 C CD . GLU A 1 170 ? 0.467 7.399 42.592 1.0 79.99 ? 170 GLU A CD 1 170 . A ATOM 1180 O OE1 . GLU A 1 170 ? 0.697 7.137 41.394 1.0 88.17 ? 170 GLU A OE1 1 170 . A ATOM 1181 O OE2 . GLU A 1 170 ? -0.613 7.891 42.975 1.0 94.67 ? 170 GLU A OE2 1 170 . A ATOM 1182 N N . SER A 1 171 ? 4.164 6.049 45.667 1.0 49.44 ? 171 SER A N 1 171 . A ATOM 1183 C CA . SER A 1 171 ? 5.527 5.691 45.332 1.0 51.22 ? 171 SER A CA 1 171 . A ATOM 1184 C C . SER A 1 171 ? 5.477 4.726 44.160 1.0 48.48 ? 171 SER A C 1 171 . A ATOM 1185 O O . SER A 1 171 ? 4.423 4.200 43.811 1.0 53.47 ? 171 SER A O 1 171 . A ATOM 1186 C CB . SER A 1 171 ? 6.244 5.035 46.515 1.0 45.77 ? 171 SER A CB 1 171 . A ATOM 1187 O OG . SER A 1 171 ? 5.571 3.843 46.898 1.0 48.51 ? 171 SER A OG 1 171 . A ATOM 1188 N N . TYR A 1 172 ? 6.640 4.479 43.578 1.0 43.87 ? 172 TYR A N 1 172 . A ATOM 1189 C CA . TYR A 1 172 ? 6.771 3.599 42.435 1.0 43.64 ? 172 TYR A CA 1 172 . A ATOM 1190 C C . TYR A 1 172 ? 8.224 3.180 42.363 1.0 47.66 ? 172 TYR A C 1 172 . A ATOM 1191 O O . TYR A 1 172 ? 9.116 3.913 42.801 1.0 59.41 ? 172 TYR A O 1 172 . A ATOM 1192 C CB . TYR A 1 172 ? 6.362 4.298 41.125 1.0 43.63 ? 172 TYR A CB 1 172 . A ATOM 1193 C CG . TYR A 1 172 ? 7.289 5.432 40.714 1.0 52.0 ? 172 TYR A CG 1 172 . A ATOM 1194 C CD1 . TYR A 1 172 ? 8.524 5.172 40.127 1.0 52.75 ? 172 TYR A CD1 1 172 . A ATOM 1195 C CD2 . TYR A 1 172 ? 6.928 6.763 40.909 1.0 57.65 ? 172 TYR A CD2 1 172 . A ATOM 1196 C CE1 . TYR A 1 172 ? 9.373 6.196 39.754 1.0 46.98 ? 172 TYR A CE1 1 172 . A ATOM 1197 C CE2 . TYR A 1 172 ? 7.779 7.795 40.537 1.0 58.96 ? 172 TYR A CE2 1 172 . A ATOM 1198 C CZ . TYR A 1 172 ? 8.997 7.500 39.952 1.0 54.69 ? 172 TYR A CZ 1 172 . A ATOM 1199 O OH . TYR A 1 172 ? 9.839 8.524 39.578 1.0 62.23 ? 172 TYR A OH 1 172 . A ATOM 1200 N N . VAL A 1 173 ? 8.445 1.996 41.817 1.0 53.47 ? 173 VAL A N 1 173 . A ATOM 1201 C CA . VAL A 1 173 ? 9.748 1.564 41.342 1.0 53.26 ? 173 VAL A CA 1 173 . A ATOM 1202 C C . VAL A 1 173 ? 9.574 1.207 39.875 1.0 51.39 ? 173 VAL A C 1 173 . A ATOM 1203 O O . VAL A 1 173 ? 8.490 0.829 39.423 1.0 64.77 ? 173 VAL A O 1 173 . A ATOM 1204 C CB . VAL A 1 173 ? 10.307 0.367 42.144 1.0 54.46 ? 173 VAL A CB 1 173 . A ATOM 1205 C CG1 . VAL A 1 173 ? 9.314 -0.763 42.138 1.0 53.19 ? 173 VAL A CG1 1 173 . A ATOM 1206 C CG2 . VAL A 1 173 ? 11.639 -0.090 41.568 1.0 56.69 ? 173 VAL A CG2 1 173 . A ATOM 1207 N N . VAL A 1 174 ? 10.652 1.347 39.121 1.0 58.16 ? 174 VAL A N 1 174 . A ATOM 1208 C CA . VAL A 1 174 ? 10.576 1.144 37.681 1.0 47.48 ? 174 VAL A CA 1 174 . A ATOM 1209 C C . VAL A 1 174 ? 11.986 0.924 37.160 1.0 51.72 ? 174 VAL A C 1 174 . A ATOM 1210 O O . VAL A 1 174 ? 12.952 1.422 37.746 1.0 58.88 ? 174 VAL A O 1 174 . A ATOM 1211 C CB . VAL A 1 174 ? 9.909 2.353 36.999 1.0 50.31 ? 174 VAL A CB 1 174 . A ATOM 1212 C CG1 . VAL A 1 174 ? 10.726 3.609 37.273 1.0 60.04 ? 174 VAL A CG1 1 174 . A ATOM 1213 C CG2 . VAL A 1 174 ? 9.757 2.126 35.493 1.0 43.53 ? 174 VAL A CG2 1 174 . A ATOM 1214 N N . ASP A 1 175 ? 12.125 0.207 36.047 1.0 49.87 ? 175 ASP A N 1 175 . A ATOM 1215 C CA . ASP A 1 175 ? 13.444 0.072 35.444 1.0 57.42 ? 175 ASP A CA 1 175 . A ATOM 1216 C C . ASP A 1 175 ? 13.853 1.375 34.772 1.0 48.92 ? 175 ASP A C 1 175 . A ATOM 1217 O O . ASP A 1 175 ? 13.011 2.116 34.264 1.0 57.07 ? 175 ASP A O 1 175 . A ATOM 1218 C CB . ASP A 1 175 ? 13.464 -1.070 34.431 1.0 69.65 ? 175 ASP A CB 1 175 . A ATOM 1219 C CG . ASP A 1 175 ? 13.185 -2.421 35.068 1.0 91.29 ? 175 ASP A CG 1 175 . A ATOM 1220 O OD1 . ASP A 1 175 ? 13.143 -2.503 36.313 1.0 98.99 ? 175 ASP A OD1 1 175 . A ATOM 1221 O OD2 . ASP A 1 175 ? 13.013 -3.405 34.324 1.0 98.22 ? 175 ASP A OD2 1 175 . A ATOM 1222 N N . VAL A 1 176 ? 15.156 1.655 34.790 1.0 54.58 ? 176 VAL A N 1 176 . A ATOM 1223 C CA . VAL A 1 176 ? 15.756 2.788 34.086 1.0 56.85 ? 176 VAL A CA 1 176 . A ATOM 1224 C C . VAL A 1 176 ? 15.958 2.358 32.635 1.0 61.1 ? 176 VAL A C 1 176 . A ATOM 1225 O O . VAL A 1 176 ? 16.829 1.519 32.350 1.0 61.95 ? 176 VAL A O 1 176 . A ATOM 1226 C CB . VAL A 1 176 ? 17.079 3.232 34.740 1.0 60.44 ? 176 VAL A CB 1 176 . A ATOM 1227 C CG1 . VAL A 1 176 ? 17.783 4.264 33.892 1.0 52.05 ? 176 VAL A CG1 1 176 . A ATOM 1228 C CG2 . VAL A 1 176 ? 16.839 3.787 36.150 1.0 67.41 ? 176 VAL A CG2 1 176 . A ATOM 1229 N N . PRO A 1 177 ? 15.171 2.877 31.696 1.0 51.36 ? 177 PRO A N 1 177 . A ATOM 1230 C CA . PRO A 1 177 ? 15.283 2.424 30.308 1.0 60.42 ? 177 PRO A CA 1 177 . A ATOM 1231 C C . PRO A 1 177 ? 16.664 2.700 29.742 1.0 62.32 ? 177 PRO A C 1 177 . A ATOM 1232 O O . PRO A 1 177 ? 17.366 3.624 30.156 1.0 62.61 ? 177 PRO A O 1 177 . A ATOM 1233 C CB . PRO A 1 177 ? 14.220 3.252 29.577 1.0 58.63 ? 177 PRO A CB 1 177 . A ATOM 1234 C CG . PRO A 1 177 ? 14.114 4.492 30.397 1.0 60.37 ? 177 PRO A CG 1 177 . A ATOM 1235 C CD . PRO A 1 177 ? 14.234 4.002 31.827 1.0 50.07 ? 177 PRO A CD 1 177 . A ATOM 1236 N N . GLU A 1 178 ? 17.038 1.885 28.761 1.0 69.89 ? 178 GLU A N 1 178 . A ATOM 1237 C CA . GLU A 1 178 ? 18.331 2.033 28.114 1.0 76.94 ? 178 GLU A CA 1 178 . A ATOM 1238 C C . GLU A 1 178 ? 18.450 3.406 27.456 1.0 78.04 ? 178 GLU A C 1 178 . A ATOM 1239 O O . GLU A 1 178 ? 17.480 3.949 26.917 1.0 81.82 ? 178 GLU A O 1 178 . A ATOM 1240 C CB . GLU A 1 178 ? 18.527 0.913 27.088 1.0 89.69 ? 178 GLU A CB 1 178 . A ATOM 1241 C CG . GLU A 1 178 ? 18.217 -0.485 27.649 1.0 100.72 ? 178 GLU A CG 1 178 . A ATOM 1242 C CD . GLU A 1 178 ? 16.753 -0.896 27.476 1.0 109.15 ? 178 GLU A CD 1 178 . A ATOM 1243 O OE1 . GLU A 1 178 ? 16.488 -1.858 26.720 1.0 119.82 ? 178 GLU A OE1 1 178 . A ATOM 1244 O OE2 . GLU A 1 178 ? 15.865 -0.258 28.084 1.0 102.78 ? 178 GLU A OE2 1 178 . A ATOM 1245 N N . GLY A 1 179 ? 19.653 3.976 27.523 1.0 74.16 ? 179 GLY A N 1 179 . A ATOM 1246 C CA . GLY A 1 179 ? 19.916 5.294 26.990 1.0 74.44 ? 179 GLY A CA 1 179 . A ATOM 1247 C C . GLY A 1 179 ? 19.677 6.441 27.952 1.0 77.38 ? 179 GLY A C 1 179 . A ATOM 1248 O O . GLY A 1 179 ? 20.105 7.568 27.666 1.0 67.08 ? 179 GLY A O 1 179 . A ATOM 1249 N N . ASN A 1 180 ? 19.015 6.195 29.080 1.0 70.87 ? 180 ASN A N 1 180 . A ATOM 1250 C CA . ASN A 1 180 ? 18.597 7.241 29.995 1.0 61.71 ? 180 ASN A CA 1 180 . A ATOM 1251 C C . ASN A 1 180 ? 19.239 7.033 31.359 1.0 71.65 ? 180 ASN A C 1 180 . A ATOM 1252 O O . ASN A 1 180 ? 19.722 5.946 31.692 1.0 70.15 ? 180 ASN A O 1 180 . A ATOM 1253 C CB . ASN A 1 180 ? 17.068 7.271 30.154 1.0 74.25 ? 180 ASN A CB 1 180 . A ATOM 1254 C CG . ASN A 1 180 ? 16.357 7.869 28.952 1.0 77.59 ? 180 ASN A CG 1 180 . A ATOM 1255 O OD1 . ASN A 1 180 ? 15.736 7.154 28.163 1.0 75.73 ? 180 ASN A OD1 1 180 . A ATOM 1256 N ND2 . ASN A 1 180 ? 16.415 9.190 28.828 1.0 70.96 ? 180 ASN A ND2 1 180 . A ATOM 1257 N N . THR A 1 181 ? 19.218 8.091 32.156 1.0 69.06 ? 181 THR A N 1 181 . A ATOM 1258 C CA . THR A 1 181 ? 19.779 8.055 33.492 1.0 65.33 ? 181 THR A CA 1 181 . A ATOM 1259 C C . THR A 1 181 ? 18.675 7.909 34.531 1.0 71.05 ? 181 THR A C 1 181 . A ATOM 1260 O O . THR A 1 181 ? 17.481 8.039 34.250 1.0 72.12 ? 181 THR A O 1 181 . A ATOM 1261 C CB . THR A 1 181 ? 20.611 9.313 33.770 1.0 63.34 ? 181 THR A CB 1 181 . A ATOM 1262 O OG1 . THR A 1 181 ? 19.742 10.434 33.962 1.0 72.39 ? 181 THR A OG1 1 181 . A ATOM 1263 C CG2 . THR A 1 181 ? 21.541 9.597 32.609 1.0 62.55 ? 181 THR A CG2 1 181 . A ATOM 1264 N N . GLU A 1 182 ? 19.104 7.609 35.754 1.0 76.47 ? 182 GLU A N 1 182 . A ATOM 1265 C CA . GLU A 1 182 ? 18.170 7.529 36.869 1.0 76.13 ? 182 GLU A CA 1 182 . A ATOM 1266 C C . GLU A 1 182 ? 17.449 8.856 37.063 1.0 71.99 ? 182 GLU A C 1 182 . A ATOM 1267 O O . GLU A 1 182 ? 16.236 8.883 37.299 1.0 70.51 ? 182 GLU A O 1 182 . A ATOM 1268 C CB . GLU A 1 182 ? 18.923 7.116 38.134 1.0 73.89 ? 182 GLU A CB 1 182 . A ATOM 1269 C CG . GLU A 1 182 ? 18.058 6.545 39.239 1.0 95.96 ? 182 GLU A CG 1 182 . A ATOM 1270 C CD . GLU A 1 182 ? 17.727 7.565 40.312 1.0 112.94 ? 182 GLU A CD 1 182 . A ATOM 1271 O OE1 . GLU A 1 182 ? 17.870 8.778 40.050 1.0 119.3 ? 182 GLU A OE1 1 182 . A ATOM 1272 O OE2 . GLU A 1 182 ? 17.329 7.148 41.422 1.0 114.37 ? 182 GLU A OE2 1 182 . A ATOM 1273 N N . GLU A 1 183 ? 18.179 9.971 36.941 1.0 75.52 ? 183 GLU A N 1 183 . A ATOM 1274 C CA . GLU A 1 183 ? 17.559 11.289 37.073 1.0 72.89 ? 183 GLU A CA 1 183 . A ATOM 1275 C C . GLU A 1 183 ? 16.512 11.519 35.988 1.0 66.2 ? 183 GLU A C 1 183 . A ATOM 1276 O O . GLU A 1 183 ? 15.397 11.970 36.274 1.0 56.55 ? 183 GLU A O 1 183 . A ATOM 1277 C CB . GLU A 1 183 ? 18.625 12.385 37.038 1.0 79.09 ? 183 GLU A CB 1 183 . A ATOM 1278 C CG . GLU A 1 183 ? 19.447 12.515 38.315 1.0 89.75 ? 183 GLU A CG 1 183 . A ATOM 1279 C CD . GLU A 1 183 ? 20.352 11.313 38.565 1.0 101.21 ? 183 GLU A CD 1 183 . A ATOM 1280 O OE1 . GLU A 1 183 ? 20.707 10.605 37.592 1.0 102.17 ? 183 GLU A OE1 1 183 . A ATOM 1281 O OE2 . GLU A 1 183 ? 20.708 11.077 39.741 1.0 104.5 ? 183 GLU A OE2 1 183 . A ATOM 1282 N N . ASP A 1 184 ? 16.850 11.215 34.731 1.0 66.51 ? 184 ASP A N 1 184 . A ATOM 1283 C CA . ASP A 1 184 ? 15.859 11.330 33.664 1.0 65.69 ? 184 ASP A CA 1 184 . A ATOM 1284 C C . ASP A 1 184 ? 14.579 10.589 34.035 1.0 61.92 ? 184 ASP A C 1 184 . A ATOM 1285 O O . ASP A 1 184 ? 13.469 11.114 33.890 1.0 58.14 ? 184 ASP A O 1 184 . A ATOM 1286 C CB . ASP A 1 184 ? 16.420 10.779 32.346 1.0 62.18 ? 184 ASP A CB 1 184 . A ATOM 1287 C CG . ASP A 1 184 ? 17.529 11.638 31.760 1.0 66.09 ? 184 ASP A CG 1 184 . A ATOM 1288 O OD1 . ASP A 1 184 ? 17.641 12.822 32.135 1.0 62.38 ? 184 ASP A OD1 1 184 . A ATOM 1289 O OD2 . ASP A 1 184 ? 18.279 11.122 30.896 1.0 69.44 ? 184 ASP A OD2 1 184 . A ATOM 1290 N N . THR A 1 185 ? 14.726 9.361 34.528 1.0 59.69 ? 185 THR A N 1 185 . A ATOM 1291 C CA . THR A 1 185 ? 13.573 8.515 34.800 1.0 56.09 ? 185 THR A CA 1 185 . A ATOM 1292 C C . THR A 1 185 ? 12.714 9.103 35.914 1.0 61.43 ? 185 THR A C 1 185 . A ATOM 1293 O O . THR A 1 185 ? 11.493 9.246 35.764 1.0 56.94 ? 185 THR A O 1 185 . A ATOM 1294 C CB . THR A 1 185 ? 14.062 7.103 35.141 1.0 56.83 ? 185 THR A CB 1 185 . A ATOM 1295 O OG1 . THR A 1 185 ? 14.840 6.604 34.044 1.0 52.17 ? 185 THR A OG1 1 185 . A ATOM 1296 C CG2 . THR A 1 185 ? 12.889 6.150 35.391 1.0 53.34 ? 185 THR A CG2 1 185 . A ATOM 1297 N N . ARG A 1 186 ? 13.337 9.462 37.041 1.0 65.17 ? 186 ARG A N 1 186 . A ATOM 1298 C CA . ARG A 1 186 ? 12.582 10.062 38.137 1.0 55.86 ? 186 ARG A CA 1 186 . A ATOM 1299 C C . ARG A 1 186 ? 11.859 11.322 37.682 1.0 49.58 ? 186 ARG A C 1 186 . A ATOM 1300 O O . ARG A 1 186 ? 10.687 11.527 38.013 1.0 56.4 ? 186 ARG A O 1 186 . A ATOM 1301 C CB . ARG A 1 186 ? 13.514 10.372 39.311 1.0 53.67 ? 186 ARG A CB 1 186 . A ATOM 1302 C CG . ARG A 1 186 ? 12.911 11.341 40.332 1.0 67.16 ? 186 ARG A CG 1 186 . A ATOM 1303 C CD . ARG A 1 186 ? 13.687 11.369 41.667 1.0 85.33 ? 186 ARG A CD 1 186 . A ATOM 1304 N NE . ARG A 1 186 ? 13.815 10.044 42.284 1.0 97.31 ? 186 ARG A NE 1 186 . A ATOM 1305 C CZ . ARG A 1 186 ? 14.954 9.354 42.365 1.0 100.37 ? 186 ARG A CZ 1 186 . A ATOM 1306 N NH1 . ARG A 1 186 ? 16.085 9.857 41.884 1.0 96.23 ? 186 ARG A NH1 1 186 . A ATOM 1307 N NH2 . ARG A 1 186 ? 14.970 8.158 42.937 1.0 105.4 ? 186 ARG A NH2 1 186 . A ATOM 1308 N N . LEU A 1 187 ? 12.542 12.175 36.915 1.0 48.2 ? 187 LEU A N 1 187 . A ATOM 1309 C CA . LEU A 1 187 ? 11.954 13.436 36.468 1.0 51.66 ? 187 LEU A CA 1 187 . A ATOM 1310 C C . LEU A 1 187 ? 10.713 13.214 35.608 1.0 46.82 ? 187 LEU A C 1 187 . A ATOM 1311 O O . LEU A 1 187 ? 9.711 13.921 35.767 1.0 48.57 ? 187 LEU A O 1 187 . A ATOM 1312 C CB . LEU A 1 187 ? 12.999 14.241 35.704 1.0 62.83 ? 187 LEU A CB 1 187 . A ATOM 1313 C CG . LEU A 1 187 ? 12.596 15.603 35.139 1.0 61.76 ? 187 LEU A CG 1 187 . A ATOM 1314 C CD1 . LEU A 1 187 ? 12.380 16.612 36.254 1.0 50.75 ? 187 LEU A CD1 1 187 . A ATOM 1315 C CD2 . LEU A 1 187 ? 13.656 16.087 34.172 1.0 59.18 ? 187 LEU A CD2 1 187 . A ATOM 1316 N N . PHE A 1 188 ? 10.756 12.239 34.693 1.0 49.7 ? 188 PHE A N 1 188 . A ATOM 1317 C CA . PHE A 1 188 ? 9.594 11.955 33.852 1.0 40.57 ? 188 PHE A CA 1 188 . A ATOM 1318 C C . PHE A 1 188 ? 8.452 11.357 34.667 1.0 37.93 ? 188 PHE A C 1 188 . A ATOM 1319 O O . PHE A 1 188 ? 7.320 11.846 34.616 1.0 49.82 ? 188 PHE A O 1 188 . A ATOM 1320 C CB . PHE A 1 188 ? 10.000 11.020 32.707 1.0 46.62 ? 188 PHE A CB 1 188 . A ATOM 1321 C CG . PHE A 1 188 ? 8.840 10.468 31.902 1.0 47.48 ? 188 PHE A CG 1 188 . A ATOM 1322 C CD1 . PHE A 1 188 ? 8.228 11.219 30.899 1.0 57.0 ? 188 PHE A CD1 1 188 . A ATOM 1323 C CD2 . PHE A 1 188 ? 8.403 9.173 32.108 1.0 45.39 ? 188 PHE A CD2 1 188 . A ATOM 1324 C CE1 . PHE A 1 188 ? 7.182 10.681 30.141 1.0 50.74 ? 188 PHE A CE1 1 188 . A ATOM 1325 C CE2 . PHE A 1 188 ? 7.362 8.640 31.358 1.0 50.8 ? 188 PHE A CE2 1 188 . A ATOM 1326 C CZ . PHE A 1 188 ? 6.755 9.393 30.375 1.0 48.49 ? 188 PHE A CZ 1 188 . A ATOM 1327 N N . ALA A 1 189 ? 8.729 10.303 35.436 1.0 39.96 ? 189 ALA A N 1 189 . A ATOM 1328 C CA . ALA A 1 189 ? 7.662 9.651 36.198 1.0 43.86 ? 189 ALA A CA 1 189 . A ATOM 1329 C C . ALA A 1 189 ? 7.118 10.560 37.296 1.0 40.78 ? 189 ALA A C 1 189 . A ATOM 1330 O O . ALA A 1 189 ? 5.897 10.673 37.473 1.0 42.83 ? 189 ALA A O 1 189 . A ATOM 1331 C CB . ALA A 1 189 ? 8.173 8.339 36.793 1.0 45.86 ? 189 ALA A CB 1 189 . A ATOM 1332 N N . ASP A 1 190 ? 8.007 11.196 38.062 1.0 42.85 ? 190 ASP A N 1 190 . A ATOM 1333 C CA . ASP A 1 190 ? 7.565 12.232 38.989 1.0 43.96 ? 190 ASP A CA 1 190 . A ATOM 1334 C C . ASP A 1 190 ? 6.607 13.206 38.314 1.0 52.94 ? 190 ASP A C 1 190 . A ATOM 1335 O O . ASP A 1 190 ? 5.526 13.485 38.850 1.0 56.52 ? 190 ASP A O 1 190 . A ATOM 1336 C CB . ASP A 1 190 ? 8.768 12.975 39.565 1.0 49.36 ? 190 ASP A CB 1 190 . A ATOM 1337 C CG . ASP A 1 190 ? 9.374 12.261 40.774 1.0 62.16 ? 190 ASP A CG 1 190 . A ATOM 1338 O OD1 . ASP A 1 190 ? 9.034 11.082 41.009 1.0 62.01 ? 190 ASP A OD1 1 190 . A ATOM 1339 O OD2 . ASP A 1 190 ? 10.197 12.881 41.478 1.0 65.14 ? 190 ASP A OD2 1 190 . A ATOM 1340 N N . THR A 1 191 ? 6.973 13.734 37.134 1.0 43.43 ? 191 THR A N 1 191 . A ATOM 1341 C CA . THR A 1 191 ? 6.102 14.728 36.516 1.0 37.66 ? 191 THR A CA 1 191 . A ATOM 1342 C C . THR A 1 191 ? 4.706 14.162 36.296 1.0 41.17 ? 191 THR A C 1 191 . A ATOM 1343 O O . THR A 1 191 ? 3.709 14.840 36.557 1.0 45.29 ? 191 THR A O 1 191 . A ATOM 1344 C CB . THR A 1 191 ? 6.688 15.241 35.198 1.0 47.82 ? 191 THR A CB 1 191 . A ATOM 1345 O OG1 . THR A 1 191 ? 7.930 15.916 35.445 1.0 43.42 ? 191 THR A OG1 1 191 . A ATOM 1346 C CG2 . THR A 1 191 ? 5.710 16.235 34.550 1.0 40.74 ? 191 THR A CG2 1 191 . A ATOM 1347 N N . VAL A 1 192 ? 4.611 12.915 35.828 1.0 44.64 ? 192 VAL A N 1 192 . A ATOM 1348 C CA . VAL A 1 192 ? 3.302 12.315 35.566 1.0 43.04 ? 192 VAL A CA 1 192 . A ATOM 1349 C C . VAL A 1 192 ? 2.547 12.072 36.874 1.0 45.43 ? 192 VAL A C 1 192 . A ATOM 1350 O O . VAL A 1 192 ? 1.354 12.372 36.989 1.0 45.46 ? 192 VAL A O 1 192 . A ATOM 1351 C CB . VAL A 1 192 ? 3.460 11.013 34.760 1.0 38.89 ? 192 VAL A CB 1 192 . A ATOM 1352 C CG1 . VAL A 1 192 ? 2.191 10.189 34.847 1.0 38.21 ? 192 VAL A CG1 1 192 . A ATOM 1353 C CG2 . VAL A 1 192 ? 3.789 11.322 33.288 1.0 37.51 ? 192 VAL A CG2 1 192 . A ATOM 1354 N N . VAL A 1 193 ? 3.224 11.517 37.878 1.0 48.22 ? 193 VAL A N 1 193 . A ATOM 1355 C CA . VAL A 1 193 ? 2.548 11.242 39.153 1.0 44.6 ? 193 VAL A CA 1 193 . A ATOM 1356 C C . VAL A 1 193 ? 2.117 12.542 39.825 1.0 41.6 ? 193 VAL A C 1 193 . A ATOM 1357 O O . VAL A 1 193 ? 0.963 12.686 40.239 1.0 43.58 ? 193 VAL A O 1 193 . A ATOM 1358 C CB . VAL A 1 193 ? 3.443 10.395 40.067 1.0 39.52 ? 193 VAL A CB 1 193 . A ATOM 1359 C CG1 . VAL A 1 193 ? 2.774 10.178 41.441 1.0 41.84 ? 193 VAL A CG1 1 193 . A ATOM 1360 C CG2 . VAL A 1 193 ? 3.737 9.055 39.414 1.0 48.47 ? 193 VAL A CG2 1 193 . A ATOM 1361 N N . LYS A 1 194 ? 3.010 13.532 39.888 1.0 43.68 ? 194 LYS A N 1 194 . A ATOM 1362 C CA . LYS A 1 194 ? 2.624 14.818 40.481 1.0 46.5 ? 194 LYS A CA 1 194 . A ATOM 1363 C C . LYS A 1 194 ? 1.375 15.393 39.807 1.0 43.59 ? 194 LYS A C 1 194 . A ATOM 1364 O O . LYS A 1 194 ? 0.466 15.898 40.481 1.0 41.27 ? 194 LYS A O 1 194 . A ATOM 1365 C CB . LYS A 1 194 ? 3.783 15.821 40.421 1.0 41.47 ? 194 LYS A CB 1 194 . A ATOM 1366 C CG . LYS A 1 194 ? 4.916 15.560 41.439 1.0 43.18 ? 194 LYS A CG 1 194 . A ATOM 1367 C CD . LYS A 1 194 ? 5.481 16.874 42.027 1.0 65.26 ? 194 LYS A CD 1 194 . A ATOM 1368 C CE . LYS A 1 194 ? 6.348 16.676 43.311 1.0 80.57 ? 194 LYS A CE 1 194 . A ATOM 1369 N NZ . LYS A 1 194 ? 5.666 16.838 44.675 1.0 69.88 ? 194 LYS A NZ 1 194 . A ATOM 1370 N N . LEU A 1 195 ? 1.292 15.301 38.474 1.0 43.68 ? 195 LEU A N 1 195 . A ATOM 1371 C CA . LEU A 1 195 ? 0.125 15.855 37.793 1.0 39.91 ? 195 LEU A CA 1 195 . A ATOM 1372 C C . LEU A 1 195 ? -1.134 15.069 38.131 1.0 42.86 ? 195 LEU A C 1 195 . A ATOM 1373 O O . LEU A 1 195 ? -2.193 15.650 38.382 1.0 44.22 ? 195 LEU A O 1 195 . A ATOM 1374 C CB . LEU A 1 195 ? 0.346 15.874 36.285 1.0 46.07 ? 195 LEU A CB 1 195 . A ATOM 1375 C CG . LEU A 1 195 ? 1.253 17.010 35.823 1.0 68.73 ? 195 LEU A CG 1 195 . A ATOM 1376 C CD1 . LEU A 1 195 ? 1.713 16.801 34.387 1.0 71.08 ? 195 LEU A CD1 1 195 . A ATOM 1377 C CD2 . LEU A 1 195 ? 0.523 18.328 35.970 1.0 70.05 ? 195 LEU A CD2 1 195 . A ATOM 1378 N N . ASN A 1 196 ? -1.055 13.739 38.091 1.0 41.72 ? 196 ASN A N 1 196 . A ATOM 1379 C CA . ASN A 1 196 ? -2.222 12.943 38.466 1.0 42.04 ? 196 ASN A CA 1 196 . A ATOM 1380 C C . ASN A 1 196 ? -2.661 13.264 39.891 1.0 45.02 ? 196 ASN A C 1 196 . A ATOM 1381 O O . ASN A 1 196 ? -3.861 13.373 40.170 1.0 42.5 ? 196 ASN A O 1 196 . A ATOM 1382 C CB . ASN A 1 196 ? -1.917 11.452 38.304 1.0 44.7 ? 196 ASN A CB 1 196 . A ATOM 1383 C CG . ASN A 1 196 ? -1.738 11.064 36.832 1.0 46.36 ? 196 ASN A CG 1 196 . A ATOM 1384 O OD1 . ASN A 1 196 ? -2.021 11.851 35.947 1.0 47.58 ? 196 ASN A OD1 1 196 . A ATOM 1385 N ND2 . ASN A 1 196 ? -1.276 9.855 36.586 1.0 41.7 ? 196 ASN A ND2 1 196 . A ATOM 1386 N N . LEU A 1 197 ? -1.704 13.455 40.799 1.0 46.82 ? 197 LEU A N 1 197 . A ATOM 1387 C CA . LEU A 1 197 ? -2.073 13.818 42.168 1.0 49.15 ? 197 LEU A CA 1 197 . A ATOM 1388 C C . LEU A 1 197 ? -2.770 15.173 42.222 1.0 47.18 ? 197 LEU A C 1 197 . A ATOM 1389 O O . LEU A 1 197 ? -3.663 15.372 43.047 1.0 46.07 ? 197 LEU A O 1 197 . A ATOM 1390 C CB . LEU A 1 197 ? -0.845 13.809 43.081 1.0 43.06 ? 197 LEU A CB 1 197 . A ATOM 1391 C CG . LEU A 1 197 ? -0.290 12.414 43.407 1.0 42.52 ? 197 LEU A CG 1 197 . A ATOM 1392 C CD1 . LEU A 1 197 ? 1.026 12.482 44.138 1.0 41.0 ? 197 LEU A CD1 1 197 . A ATOM 1393 C CD2 . LEU A 1 197 ? -1.287 11.580 44.178 1.0 41.14 ? 197 LEU A CD2 1 197 . A ATOM 1394 N N . GLN A 1 198 ? -2.415 16.108 41.331 1.0 48.55 ? 198 GLN A N 1 198 . A ATOM 1395 C CA . GLN A 1 198 ? -3.115 17.389 41.351 1.0 41.98 ? 198 GLN A CA 1 198 . A ATOM 1396 C C . GLN A 1 198 ? -4.541 17.250 40.833 1.0 47.95 ? 198 GLN A C 1 198 . A ATOM 1397 O O . GLN A 1 198 ? -5.453 17.908 41.344 1.0 45.01 ? 198 GLN A O 1 198 . A ATOM 1398 C CB . GLN A 1 198 ? -2.335 18.437 40.559 1.0 46.1 ? 198 GLN A CB 1 198 . A ATOM 1399 C CG . GLN A 1 198 ? -1.232 19.101 41.372 1.0 53.06 ? 198 GLN A CG 1 198 . A ATOM 1400 C CD . GLN A 1 198 ? -0.114 19.661 40.515 1.0 69.25 ? 198 GLN A CD 1 198 . A ATOM 1401 O OE1 . GLN A 1 198 ? -0.123 19.535 39.286 1.0 76.15 ? 198 GLN A OE1 1 198 . A ATOM 1402 N NE2 . GLN A 1 198 ? 0.867 20.277 41.163 1.0 81.53 ? 198 GLN A NE2 1 198 . A ATOM 1403 N N . LYS A 1 199 ? -4.763 16.383 39.842 1.0 53.92 ? 199 LYS A N 1 199 . A ATOM 1404 C CA . LYS A 1 199 ? -6.128 16.130 39.394 1.0 51.88 ? 199 LYS A CA 1 199 . A ATOM 1405 C C . LYS A 1 199 ? -6.960 15.499 40.499 1.0 50.8 ? 199 LYS A C 1 199 . A ATOM 1406 O O . LYS A 1 199 ? -8.140 15.827 40.654 1.0 60.8 ? 199 LYS A O 1 199 . A ATOM 1407 C CB . LYS A 1 199 ? -6.129 15.229 38.163 1.0 43.39 ? 199 LYS A CB 1 199 . A ATOM 1408 C CG . LYS A 1 199 ? -7.524 14.829 37.712 1.0 50.81 ? 199 LYS A CG 1 199 . A ATOM 1409 C CD . LYS A 1 199 ? -7.486 14.147 36.345 1.0 62.45 ? 199 LYS A CD 1 199 . A ATOM 1410 C CE . LYS A 1 199 ? -8.897 13.875 35.834 1.0 60.64 ? 199 LYS A CE 1 199 . A ATOM 1411 N NZ . LYS A 1 199 ? -8.932 13.452 34.392 1.0 64.78 ? 199 LYS A NZ 1 199 . A ATOM 1412 N N . LEU A 1 200 ? -6.370 14.576 41.263 1.0 57.1 ? 200 LEU A N 1 200 . A ATOM 1413 C CA . LEU A 1 200 ? -7.085 13.979 42.389 1.0 58.39 ? 200 LEU A CA 1 200 . A ATOM 1414 C C . LEU A 1 200 ? -7.536 15.049 43.382 1.0 54.48 ? 200 LEU A C 1 200 . A ATOM 1415 O O . LEU A 1 200 ? -8.670 15.015 43.879 1.0 50.6 ? 200 LEU A O 1 200 . A ATOM 1416 C CB . LEU A 1 200 ? -6.198 12.935 43.068 1.0 44.89 ? 200 LEU A CB 1 200 . A ATOM 1417 C CG . LEU A 1 200 ? -6.718 12.206 44.323 1.0 52.72 ? 200 LEU A CG 1 200 . A ATOM 1418 C CD1 . LEU A 1 200 ? -8.018 11.463 44.061 1.0 51.02 ? 200 LEU A CD1 1 200 . A ATOM 1419 C CD2 . LEU A 1 200 ? -5.666 11.236 44.829 1.0 50.02 ? 200 LEU A CD2 1 200 . A ATOM 1420 N N . VAL A 1 201 ? -6.666 16.018 43.672 1.0 42.73 ? 201 VAL A N 1 201 . A ATOM 1421 C CA . VAL A 1 201 ? -7.049 17.119 44.551 1.0 48.36 ? 201 VAL A CA 1 201 . A ATOM 1422 C C . VAL A 1 201 ? -8.327 17.782 44.054 1.0 59.49 ? 201 VAL A C 1 201 . A ATOM 1423 O O . VAL A 1 201 ? -9.277 17.988 44.821 1.0 59.79 ? 201 VAL A O 1 201 . A ATOM 1424 C CB . VAL A 1 201 ? -5.899 18.135 44.670 1.0 47.6 ? 201 VAL A CB 1 201 . A ATOM 1425 C CG1 . VAL A 1 201 ? -6.410 19.438 45.256 1.0 46.98 ? 201 VAL A CG1 1 201 . A ATOM 1426 C CG2 . VAL A 1 201 ? -4.776 17.576 45.529 1.0 47.79 ? 201 VAL A CG2 1 201 . A ATOM 1427 N N . SER A 1 202 ? -8.374 18.123 42.764 1.0 55.45 ? 202 SER A N 1 202 . A ATOM 1428 C CA . SER A 1 202 ? -9.550 18.796 42.224 1.0 59.28 ? 202 SER A CA 1 202 . A ATOM 1429 C C . SER A 1 202 ? -10.782 17.908 42.302 1.0 50.02 ? 202 SER A C 1 202 . A ATOM 1430 O O . SER A 1 202 ? -11.873 18.381 42.637 1.0 62.69 ? 202 SER A O 1 202 . A ATOM 1431 C CB . SER A 1 202 ? -9.301 19.214 40.773 1.0 60.21 ? 202 SER A CB 1 202 . A ATOM 1432 O OG . SER A 1 202 ? -7.997 19.733 40.613 1.0 75.42 ? 202 SER A OG 1 202 . A ATOM 1433 N N . VAL A 1 203 ? -10.642 16.625 41.963 1.0 53.53 ? 203 VAL A N 1 203 . A ATOM 1434 C CA . VAL A 1 203 ? -11.802 15.740 41.990 1.0 61.66 ? 203 VAL A CA 1 203 . A ATOM 1435 C C . VAL A 1 203 ? -12.280 15.525 43.427 1.0 63.2 ? 203 VAL A C 1 203 . A ATOM 1436 O O . VAL A 1 203 ? -13.486 15.526 43.701 1.0 64.66 ? 203 VAL A O 1 203 . A ATOM 1437 C CB . VAL A 1 203 ? -11.484 14.410 41.283 1.0 56.61 ? 203 VAL A CB 1 203 . A ATOM 1438 C CG1 . VAL A 1 203 ? -12.659 13.450 41.403 1.0 59.07 ? 203 VAL A CG1 1 203 . A ATOM 1439 C CG2 . VAL A 1 203 ? -11.154 14.654 39.819 1.0 71.13 ? 203 VAL A CG2 1 203 . A ATOM 1440 N N . ALA A 1 204 ? -11.352 15.367 44.369 1.0 55.74 ? 204 ALA A N 1 204 . A ATOM 1441 C CA . ALA A 1 204 ? -11.758 15.122 45.751 1.0 62.93 ? 204 ALA A CA 1 204 . A ATOM 1442 C C . ALA A 1 204 ? -12.408 16.362 46.360 1.0 71.56 ? 204 ALA A C 1 204 . A ATOM 1443 O O . ALA A 1 204 ? -13.541 16.311 46.856 1.0 72.8 ? 204 ALA A O 1 204 . A ATOM 1444 C CB . ALA A 1 204 ? -10.555 14.672 46.578 1.0 58.96 ? 204 ALA A CB 1 204 . A ATOM 1445 N N . GLU A 1 205 ? -11.706 17.496 46.318 1.0 70.84 ? 205 GLU A N 1 205 . A ATOM 1446 C CA . GLU A 1 205 ? -12.237 18.717 46.912 1.0 66.02 ? 205 GLU A CA 1 205 . A ATOM 1447 C C . GLU A 1 205 ? -13.500 19.194 46.211 1.0 66.6 ? 205 GLU A C 1 205 . A ATOM 1448 O O . GLU A 1 205 ? -14.308 19.891 46.829 1.0 66.8 ? 205 GLU A O 1 205 . A ATOM 1449 C CB . GLU A 1 205 ? -11.160 19.801 46.905 1.0 61.24 ? 205 GLU A CB 1 205 . A ATOM 1450 C CG . GLU A 1 205 ? -9.942 19.411 47.734 1.0 61.1 ? 205 GLU A CG 1 205 . A ATOM 1451 C CD . GLU A 1 205 ? -8.796 20.402 47.634 1.0 68.11 ? 205 GLU A CD 1 205 . A ATOM 1452 O OE1 . GLU A 1 205 ? -8.901 21.377 46.860 1.0 71.02 ? 205 GLU A OE1 1 205 . A ATOM 1453 O OE2 . GLU A 1 205 ? -7.779 20.197 48.336 1.0 57.63 ? 205 GLU A OE2 1 205 . A ATOM 1454 N N . SER A 1 206 ? -13.701 18.821 44.947 1.0 66.87 ? 206 SER A N 1 206 . A ATOM 1455 C CA . SER A 1 206 ? -14.970 19.120 44.298 1.0 69.56 ? 206 SER A CA 1 206 . A ATOM 1456 C C . SER A 1 206 ? -16.115 18.303 44.878 1.0 81.01 ? 206 SER A C 1 206 . A ATOM 1457 O O . SER A 1 206 ? -17.278 18.694 44.725 1.0 86.62 ? 206 SER A O 1 206 . A ATOM 1458 C CB . SER A 1 206 ? -14.873 18.868 42.793 1.0 52.07 ? 206 SER A CB 1 206 . A ATOM 1459 N N . GLN A 1 207 ? -15.815 17.180 45.525 1.0 80.35 ? 207 GLN A N 1 207 . A ATOM 1460 C CA . GLN A 1 207 ? -16.842 16.295 46.064 1.0 68.69 ? 207 GLN A CA 1 207 . A ATOM 1461 C C . GLN A 1 207 ? -16.988 16.492 47.573 1.0 74.88 ? 207 GLN A C 1 207 . A ATOM 1462 O O . GLN A 1 207 ? -17.092 17.627 48.057 1.0 74.16 ? 207 GLN A O 1 207 . A ATOM 1463 C CB . GLN A 1 207 ? -16.513 14.827 45.731 1.0 47.93 ? 207 GLN A CB 1 207 . A ATOM 1464 N N . CYS B 2 8 ? -5.033 40.939 -6.265 1.0 74.99 ? 186 CYS B N 1 8 . B ATOM 1465 C CA . CYS B 2 8 ? -4.558 39.762 -5.533 1.0 84.22 ? 186 CYS B CA 1 8 . B ATOM 1466 C C . CYS B 2 8 ? -5.679 38.737 -5.358 1.0 75.99 ? 186 CYS B C 1 8 . B ATOM 1467 O O . CYS B 2 8 ? -6.379 38.731 -4.344 1.0 80.97 ? 186 CYS B O 1 8 . B ATOM 1468 C CB . CYS B 2 8 ? -3.986 40.165 -4.162 1.0 81.48 ? 186 CYS B CB 1 8 . B ATOM 1469 S SG . CYS B 2 8 ? -3.410 38.782 -3.099 1.0 82.17 ? 186 CYS B SG 1 8 . B ATOM 1470 N N . ILE B 2 9 ? -5.846 37.872 -6.350 1.0 65.95 ? 187 ILE B N 1 9 . B ATOM 1471 C CA . ILE B 2 9 ? -6.853 36.810 -6.274 1.0 62.78 ? 187 ILE B CA 1 9 . B ATOM 1472 C C . ILE B 2 9 ? -6.255 35.620 -5.526 1.0 54.17 ? 187 ILE B C 1 9 . B ATOM 1473 O O . ILE B 2 9 ? -5.123 35.210 -5.827 1.0 49.5 ? 187 ILE B O 1 9 . B ATOM 1474 C CB . ILE B 2 9 ? -7.319 36.414 -7.672 1.0 68.46 ? 187 ILE B CB 1 9 . B ATOM 1475 C CG1 . ILE B 2 9 ? -8.191 37.531 -8.265 1.0 67.85 ? 187 ILE B CG1 1 9 . B ATOM 1476 C CG2 . ILE B 2 9 ? -8.068 35.096 -7.638 1.0 69.61 ? 187 ILE B CG2 1 9 . B ATOM 1477 C CD1 . ILE B 2 9 ? -8.672 37.258 -9.680 1.0 73.72 ? 187 ILE B CD1 1 9 . B ATOM 1478 N N . PRO B 2 10 ? -6.949 35.056 -4.536 1.0 46.92 ? 188 PRO B N 1 10 . B ATOM 1479 C CA . PRO B 2 10 ? -6.310 34.013 -3.719 1.0 41.74 ? 188 PRO B CA 1 10 . B ATOM 1480 C C . PRO B 2 10 ? -6.446 32.649 -4.378 1.0 36.51 ? 188 PRO B C 1 10 . B ATOM 1481 O O . PRO B 2 10 ? -7.558 32.186 -4.640 1.0 33.24 ? 188 PRO B O 1 10 . B ATOM 1482 C CB . PRO B 2 10 ? -7.074 34.086 -2.388 1.0 35.77 ? 188 PRO B CB 1 10 . B ATOM 1483 C CG . PRO B 2 10 ? -8.402 34.659 -2.743 1.0 44.03 ? 188 PRO B CG 1 10 . B ATOM 1484 C CD . PRO B 2 10 ? -8.195 35.562 -3.933 1.0 51.31 ? 188 PRO B CD 1 10 . B ATOM 1485 N N . LEU B 2 11 ? -5.307 32.002 -4.628 1.0 32.55 ? 189 LEU B N 1 11 . B ATOM 1486 C CA . LEU B 2 11 ? -5.248 30.679 -5.248 1.0 40.06 ? 189 LEU B CA 1 11 . B ATOM 1487 C C . LEU B 2 11 ? -4.657 29.674 -4.264 1.0 38.49 ? 189 LEU B C 1 11 . B ATOM 1488 O O . LEU B 2 11 ? -3.472 29.757 -3.919 1.0 35.57 ? 189 LEU B O 1 11 . B ATOM 1489 C CB . LEU B 2 11 ? -4.417 30.715 -6.529 1.0 28.65 ? 189 LEU B CB 1 11 . B ATOM 1490 C CG . LEU B 2 11 ? -4.864 31.744 -7.594 1.0 36.35 ? 189 LEU B CG 1 11 . B ATOM 1491 C CD1 . LEU B 2 11 ? -3.842 31.793 -8.707 1.0 47.19 ? 189 LEU B CD1 1 11 . B ATOM 1492 C CD2 . LEU B 2 11 ? -6.244 31.447 -8.153 1.0 36.19 ? 189 LEU B CD2 1 11 . B ATOM 1493 N N . TRP B 2 12 ? -5.468 28.706 -3.845 1.0 32.9 ? 190 TRP B N 1 12 . B ATOM 1494 C CA . TRP B 2 12 ? -5.037 27.786 -2.801 1.0 41.44 ? 190 TRP B CA 1 12 . B ATOM 1495 C C . TRP B 2 12 ? -5.723 26.440 -2.983 1.0 33.83 ? 190 TRP B C 1 12 . B ATOM 1496 O O . TRP B 2 12 ? -6.796 26.337 -3.583 1.0 34.58 ? 190 TRP B O 1 12 . B ATOM 1497 C CB . TRP B 2 12 ? -5.343 28.339 -1.399 1.0 31.03 ? 190 TRP B CB 1 12 . B ATOM 1498 C CG . TRP B 2 12 ? -6.768 28.089 -0.975 1.0 31.88 ? 190 TRP B CG 1 12 . B ATOM 1499 C CD1 . TRP B 2 12 ? -7.256 27.018 -0.254 1.0 35.23 ? 190 TRP B CD1 1 12 . B ATOM 1500 C CD2 . TRP B 2 12 ? -7.882 28.927 -1.244 1.0 32.58 ? 190 TRP B CD2 1 12 . B ATOM 1501 N NE1 . TRP B 2 12 ? -8.613 27.155 -0.062 1.0 44.17 ? 190 TRP B NE1 1 12 . B ATOM 1502 C CE2 . TRP B 2 12 ? -9.020 28.320 -0.663 1.0 37.15 ? 190 TRP B CE2 1 12 . B ATOM 1503 C CE3 . TRP B 2 12 ? -8.034 30.136 -1.925 1.0 32.44 ? 190 TRP B CE3 1 12 . B ATOM 1504 C CZ2 . TRP B 2 12 ? -10.278 28.878 -0.752 1.0 48.2 ? 190 TRP B CZ2 1 12 . B ATOM 1505 C CZ3 . TRP B 2 12 ? -9.283 30.679 -2.025 1.0 49.71 ? 190 TRP B CZ3 1 12 . B ATOM 1506 C CH2 . TRP B 2 12 ? -10.393 30.063 -1.433 1.0 53.92 ? 190 TRP B CH2 1 12 . B ATOM 1507 N N . GLY B 2 13 ? -5.082 25.407 -2.447 1.0 26.3 ? 191 GLY B N 1 13 . B ATOM 1508 C CA . GLY B 2 13 ? -5.702 24.103 -2.329 1.0 31.06 ? 191 GLY B CA 1 13 . B ATOM 1509 C C . GLY B 2 13 ? -5.303 23.484 -0.999 1.0 35.21 ? 191 GLY B C 1 13 . B ATOM 1510 O O . GLY B 2 13 ? -4.279 23.846 -0.404 1.0 31.29 ? 191 GLY B O 1 13 . B ATOM 1511 N N . VAL B 2 14 ? -6.127 22.541 -0.535 1.0 34.38 ? 192 VAL B N 1 14 . B ATOM 1512 C CA . VAL B 2 14 ? -5.978 21.962 0.799 1.0 38.69 ? 192 VAL B CA 1 14 . B ATOM 1513 C C . VAL B 2 14 ? -6.188 20.453 0.763 1.0 36.85 ? 192 VAL B C 1 14 . B ATOM 1514 O O . VAL B 2 14 ? -7.077 19.952 0.068 1.0 38.65 ? 192 VAL B O 1 14 . B ATOM 1515 C CB . VAL B 2 14 ? -6.978 22.576 1.802 1.0 38.14 ? 192 VAL B CB 1 14 . B ATOM 1516 C CG1 . VAL B 2 14 ? -6.831 24.096 1.879 1.0 33.87 ? 192 VAL B CG1 1 14 . B ATOM 1517 C CG2 . VAL B 2 14 ? -8.381 22.214 1.384 1.0 35.48 ? 192 VAL B CG2 1 14 . B ATOM 1518 N N . VAL B 2 15 ? -5.389 19.729 1.572 1.0 32.55 ? 193 VAL B N 1 15 . B ATOM 1519 C CA . VAL B 2 15 ? -5.670 18.343 1.938 1.0 27.52 ? 193 VAL B CA 1 15 . B ATOM 1520 C C . VAL B 2 15 ? -5.381 18.164 3.428 1.0 29.59 ? 193 VAL B C 1 15 . B ATOM 1521 O O . VAL B 2 15 ? -4.365 18.648 3.944 1.0 36.68 ? 193 VAL B O 1 15 . B ATOM 1522 C CB . VAL B 2 15 ? -4.844 17.335 1.107 1.0 34.56 ? 193 VAL B CB 1 15 . B ATOM 1523 C CG1 . VAL B 2 15 ? -5.128 15.920 1.567 1.0 41.73 ? 193 VAL B CG1 1 15 . B ATOM 1524 C CG2 . VAL B 2 15 ? -5.179 17.441 -0.376 1.0 51.55 ? 193 VAL B CG2 1 15 . B ATOM 1525 N N . SER B 2 16 ? -6.279 17.472 4.121 1.0 29.48 ? 194 SER B N 1 16 . B ATOM 1526 C CA . SER B 2 16 ? -6.128 17.253 5.566 1.0 27.78 ? 194 SER B CA 1 16 . B ATOM 1527 C C . SER B 2 16 ? -6.580 15.821 5.818 1.0 29.63 ? 194 SER B C 1 16 . B ATOM 1528 O O . SER B 2 16 ? -7.783 15.532 5.777 1.0 34.99 ? 194 SER B O 1 16 . B ATOM 1529 C CB . SER B 2 16 ? -6.936 18.256 6.375 1.0 36.89 ? 194 SER B CB 1 16 . B ATOM 1530 O OG . SER B 2 16 ? -6.780 18.052 7.775 1.0 39.76 ? 194 SER B OG 1 16 . B ATOM 1531 N N . ILE B 2 17 ? -5.616 14.923 6.031 1.0 29.16 ? 195 ILE B N 1 17 . B ATOM 1532 C CA . ILE B 2 17 ? -5.941 13.508 6.108 1.0 32.21 ? 195 ILE B CA 1 17 . B ATOM 1533 C C . ILE B 2 17 ? -5.499 12.938 7.452 1.0 35.7 ? 195 ILE B C 1 17 . B ATOM 1534 O O . ILE B 2 17 ? -4.479 13.339 8.028 1.0 33.88 ? 195 ILE B O 1 17 . B ATOM 1535 C CB . ILE B 2 17 ? -5.326 12.696 4.951 1.0 40.94 ? 195 ILE B CB 1 17 . B ATOM 1536 C CG1 . ILE B 2 17 ? -3.818 12.799 4.945 1.0 37.63 ? 195 ILE B CG1 1 17 . B ATOM 1537 C CG2 . ILE B 2 17 ? -5.879 13.121 3.602 1.0 51.52 ? 195 ILE B CG2 1 17 . B ATOM 1538 C CD1 . ILE B 2 17 ? -3.202 11.724 4.108 1.0 47.76 ? 195 ILE B CD1 1 17 . B ATOM 1539 N N . GLN B 2 18 ? -6.289 11.981 7.944 1.0 35.33 ? 196 GLN B N 1 18 . B ATOM 1540 C CA . GLN B 2 18 ? -6.004 11.306 9.210 1.0 32.94 ? 196 GLN B CA 1 18 . B ATOM 1541 C C . GLN B 2 18 ? -4.845 10.330 9.082 1.0 39.06 ? 196 GLN B C 1 18 . B ATOM 1542 O O . GLN B 2 18 ? -4.000 10.231 9.981 1.0 39.04 ? 196 GLN B O 1 18 . B ATOM 1543 C CB . GLN B 2 18 ? -7.251 10.554 9.679 1.0 41.41 ? 196 GLN B CB 1 18 . B ATOM 1544 C CG . GLN B 2 18 ? -7.114 9.883 11.039 1.0 36.31 ? 196 GLN B CG 1 18 . B ATOM 1545 C CD . GLN B 2 18 ? -8.445 9.449 11.549 1.0 36.82 ? 196 GLN B CD 1 18 . B ATOM 1546 O OE1 . GLN B 2 18 ? -9.468 9.934 11.081 1.0 46.81 ? 196 GLN B OE1 1 18 . B ATOM 1547 N NE2 . GLN B 2 18 ? -8.455 8.529 12.503 1.0 44.86 ? 196 GLN B NE2 1 18 . B ATOM 1548 N N . GLY B 2 19 ? -4.807 9.585 7.989 1.0 34.9 ? 197 GLY B N 1 19 . B ATOM 1549 C CA . GLY B 2 19 ? -3.754 8.629 7.775 1.0 27.94 ? 197 GLY B CA 1 19 . B ATOM 1550 C C . GLY B 2 19 ? -3.850 7.477 8.754 1.0 34.89 ? 197 GLY B C 1 19 . B ATOM 1551 O O . GLY B 2 19 ? -4.936 7.028 9.123 1.0 39.1 ? 197 GLY B O 1 19 . B ATOM 1552 N N . ASN B 2 20 ? -2.701 7.024 9.212 1.0 31.85 ? 198 ASN B N 1 20 . B ATOM 1553 C CA . ASN B 2 20 ? -2.628 5.830 10.032 1.0 39.97 ? 198 ASN B CA 1 20 . B ATOM 1554 C C . ASN B 2 20 ? -3.008 6.062 11.491 1.0 45.9 ? 198 ASN B C 1 20 . B ATOM 1555 O O . ASN B 2 20 ? -2.990 5.108 12.273 1.0 48.2 ? 198 ASN B O 1 20 . B ATOM 1556 C CB . ASN B 2 20 ? -1.229 5.248 9.930 1.0 35.78 ? 198 ASN B CB 1 20 . B ATOM 1557 C CG . ASN B 2 20 ? -1.251 3.859 9.393 1.0 65.91 ? 198 ASN B CG 1 20 . B ATOM 1558 O OD1 . ASN B 2 20 ? -1.406 3.647 8.181 1.0 75.32 ? 198 ASN B OD1 1 20 . B ATOM 1559 N ND2 . ASN B 2 20 ? -1.155 2.886 10.292 1.0 54.72 ? 198 ASN B ND2 1 20 . B ATOM 1560 N N . ARG B 2 21 ? -3.383 7.279 11.864 1.0 35.76 ? 199 ARG B N 1 21 . B ATOM 1561 C CA . ARG B 2 21 ? -3.648 7.583 13.257 1.0 42.28 ? 199 ARG B CA 1 21 . B ATOM 1562 C C . ARG B 2 21 ? -5.043 7.138 13.660 1.0 45.4 ? 199 ARG B C 1 21 . B ATOM 1563 O O . ARG B 2 21 ? -5.986 7.165 12.864 1.0 38.65 ? 199 ARG B O 1 21 . B ATOM 1564 C CB . ARG B 2 21 ? -3.494 9.079 13.503 1.0 43.43 ? 199 ARG B CB 1 21 . B ATOM 1565 C CG . ARG B 2 21 ? -2.056 9.509 13.467 1.0 42.75 ? 199 ARG B CG 1 21 . B ATOM 1566 C CD . ARG B 2 21 ? -1.329 8.928 14.665 1.0 44.27 ? 199 ARG B CD 1 21 . B ATOM 1567 N NE . ARG B 2 21 ? 0.086 9.258 14.612 1.0 46.64 ? 199 ARG B NE 1 21 . B ATOM 1568 C CZ . ARG B 2 21 ? 0.618 10.330 15.184 1.0 49.93 ? 199 ARG B CZ 1 21 . B ATOM 1569 N NH1 . ARG B 2 21 ? 1.923 10.550 15.065 1.0 49.69 ? 199 ARG B NH1 1 21 . B ATOM 1570 N NH2 . ARG B 2 21 ? -0.151 11.178 15.874 1.0 41.1 ? 199 ARG B NH2 1 21 . B ATOM 1571 N N . SER B 2 22 ? -5.172 6.738 14.930 1.0 38.3 ? 200 SER B N 1 22 . B ATOM 1572 C CA . SER B 2 22 ? -6.483 6.361 15.432 1.0 34.47 ? 200 SER B CA 1 22 . B ATOM 1573 C C . SER B 2 22 ? -7.394 7.568 15.530 1.0 34.87 ? 200 SER B C 1 22 . B ATOM 1574 O O . SER B 2 22 ? -8.616 7.421 15.498 1.0 47.45 ? 200 SER B O 1 22 . B ATOM 1575 C CB . SER B 2 22 ? -6.344 5.678 16.796 1.0 48.33 ? 200 SER B CB 1 22 . B ATOM 1576 O OG . SER B 2 22 ? -5.867 6.601 17.762 1.0 60.87 ? 200 SER B OG 1 22 . B ATOM 1577 N N . GLU B 2 23 ? -6.823 8.765 15.628 1.0 39.37 ? 201 GLU B N 1 23 . B ATOM 1578 C CA . GLU B 2 23 ? -7.595 9.991 15.762 1.0 40.24 ? 201 GLU B CA 1 23 . B ATOM 1579 C C . GLU B 2 23 ? -7.107 11.033 14.767 1.0 37.42 ? 201 GLU B C 1 23 . B ATOM 1580 O O . GLU B 2 23 ? -5.936 11.046 14.382 1.0 40.96 ? 201 GLU B O 1 23 . B ATOM 1581 C CB . GLU B 2 23 ? -7.484 10.571 17.181 1.0 46.37 ? 201 GLU B CB 1 23 . B ATOM 1582 C CG . GLU B 2 23 ? -7.787 9.557 18.269 1.0 54.16 ? 201 GLU B CG 1 23 . B ATOM 1583 C CD . GLU B 2 23 ? -9.229 9.075 18.242 1.0 68.72 ? 201 GLU B CD 1 23 . B ATOM 1584 O OE1 . GLU B 2 23 ? -9.477 7.921 18.672 1.0 71.85 ? 201 GLU B OE1 1 23 . B ATOM 1585 O OE2 . GLU B 2 23 ? -10.115 9.849 17.804 1.0 73.91 ? 201 GLU B OE2 1 23 . B ATOM 1586 N N . MET B 2 24 ? -8.014 11.910 14.369 1.0 39.27 ? 202 MET B N 1 24 . B ATOM 1587 C CA . MET B 2 24 ? -7.678 13.071 13.560 1.0 40.79 ? 202 MET B CA 1 24 . B ATOM 1588 C C . MET B 2 24 ? -7.604 14.265 14.501 1.0 37.39 ? 202 MET B C 1 24 . B ATOM 1589 O O . MET B 2 24 ? -8.608 14.637 15.119 1.0 39.71 ? 202 MET B O 1 24 . B ATOM 1590 C CB . MET B 2 24 ? -8.717 13.317 12.473 1.0 36.49 ? 202 MET B CB 1 24 . B ATOM 1591 C CG . MET B 2 24 ? -8.452 14.554 11.637 1.0 25.46 ? 202 MET B CG 1 24 . B ATOM 1592 S SD . MET B 2 24 ? -6.842 14.526 10.840 1.0 47.56 ? 202 MET B SD 1 24 . B ATOM 1593 C CE . MET B 2 24 ? -7.078 15.746 9.546 1.0 44.97 ? 202 MET B CE 1 24 . B ATOM 1594 N N . GLU B 2 25 ? -6.419 14.841 14.626 1.0 36.55 ? 203 GLU B N 1 25 . B ATOM 1595 C CA . GLU B 2 25 ? -6.216 16.009 15.461 1.0 34.96 ? 203 GLU B CA 1 25 . B ATOM 1596 C C . GLU B 2 25 ? -5.559 17.160 14.711 1.0 46.86 ? 203 GLU B C 1 25 . B ATOM 1597 O O . GLU B 2 25 ? -5.193 18.157 15.342 1.0 39.21 ? 203 GLU B O 1 25 . B ATOM 1598 C CB . GLU B 2 25 ? -5.400 15.619 16.705 1.0 30.38 ? 203 GLU B CB 1 25 . B ATOM 1599 C CG . GLU B 2 25 ? -6.162 14.568 17.533 1.0 37.11 ? 203 GLU B CG 1 25 . B ATOM 1600 C CD . GLU B 2 25 ? -5.411 14.021 18.746 1.0 45.06 ? 203 GLU B CD 1 25 . B ATOM 1601 O OE1 . GLU B 2 25 ? -4.184 14.227 18.866 1.0 49.01 ? 203 GLU B OE1 1 25 . B ATOM 1602 O OE2 . GLU B 2 25 ? -6.075 13.364 19.583 1.0 47.38 ? 203 GLU B OE2 1 25 . B ATOM 1603 N N . ASP B 2 26 ? -5.396 17.049 13.386 1.0 43.76 ? 204 ASP B N 1 26 . B ATOM 1604 C CA . ASP B 2 26 ? -5.062 18.187 12.545 1.0 39.41 ? 204 ASP B CA 1 26 . B ATOM 1605 C C . ASP B 2 26 ? -6.319 19.003 12.279 1.0 36.29 ? 204 ASP B C 1 26 . B ATOM 1606 O O . ASP B 2 26 ? -7.427 18.469 12.168 1.0 35.87 ? 204 ASP B O 1 26 . B ATOM 1607 C CB . ASP B 2 26 ? -4.479 17.735 11.186 1.0 28.79 ? 204 ASP B CB 1 26 . B ATOM 1608 C CG . ASP B 2 26 ? -2.978 17.632 11.194 1.0 29.32 ? 204 ASP B CG 1 26 . B ATOM 1609 O OD1 . ASP B 2 26 ? -2.376 17.591 12.284 1.0 35.75 ? 204 ASP B OD1 1 26 . B ATOM 1610 O OD2 . ASP B 2 26 ? -2.389 17.593 10.093 1.0 37.14 ? 204 ASP B OD2 1 26 . B ATOM 1611 N N . ALA B 2 27 ? -6.143 20.308 12.157 1.0 33.58 ? 205 ALA B N 1 27 . B ATOM 1612 C CA . ALA B 2 27 ? -7.233 21.132 11.674 1.0 29.24 ? 205 ALA B CA 1 27 . B ATOM 1613 C C . ALA B 2 27 ? -6.613 22.240 10.849 1.0 30.21 ? 205 ALA B C 1 27 . B ATOM 1614 O O . ALA B 2 27 ? -5.410 22.484 10.919 1.0 36.6 ? 205 ALA B O 1 27 . B ATOM 1615 C CB . ALA B 2 27 ? -8.088 21.687 12.822 1.0 29.27 ? 205 ALA B CB 1 27 . B ATOM 1616 N N . PHE B 2 28 ? -7.439 22.900 10.051 1.0 29.58 ? 206 PHE B N 1 28 . B ATOM 1617 C CA . PHE B 2 28 ? -6.954 23.973 9.203 1.0 38.39 ? 206 PHE B CA 1 28 . B ATOM 1618 C C . PHE B 2 28 ? -8.089 24.948 8.968 1.0 35.79 ? 206 PHE B C 1 28 . B ATOM 1619 O O . PHE B 2 28 ? -9.267 24.617 9.121 1.0 36.1 ? 206 PHE B O 1 28 . B ATOM 1620 C CB . PHE B 2 28 ? -6.422 23.450 7.853 1.0 36.63 ? 206 PHE B CB 1 28 . B ATOM 1621 C CG . PHE B 2 28 ? -7.497 23.046 6.914 1.0 35.14 ? 206 PHE B CG 1 28 . B ATOM 1622 C CD1 . PHE B 2 28 ? -8.080 21.797 7.007 1.0 35.9 ? 206 PHE B CD1 1 28 . B ATOM 1623 C CD2 . PHE B 2 28 ? -7.938 23.916 5.922 1.0 37.57 ? 206 PHE B CD2 1 28 . B ATOM 1624 C CE1 . PHE B 2 28 ? -9.081 21.418 6.129 1.0 40.37 ? 206 PHE B CE1 1 28 . B ATOM 1625 C CE2 . PHE B 2 28 ? -8.938 23.536 5.040 1.0 41.13 ? 206 PHE B CE2 1 28 . B ATOM 1626 C CZ . PHE B 2 28 ? -9.516 22.288 5.154 1.0 38.38 ? 206 PHE B CZ 1 28 . B ATOM 1627 N N . ALA B 2 29 ? -7.720 26.157 8.581 1.0 27.14 ? 207 ALA B N 1 29 . B ATOM 1628 C CA . ALA B 2 29 ? -8.695 27.184 8.258 1.0 35.48 ? 207 ALA B CA 1 29 . B ATOM 1629 C C . ALA B 2 29 ? -8.177 28.005 7.093 1.0 38.0 ? 207 ALA B C 1 29 . B ATOM 1630 O O . ALA B 2 29 ? -6.991 28.335 7.040 1.0 35.97 ? 207 ALA B O 1 29 . B ATOM 1631 C CB . ALA B 2 29 ? -8.958 28.108 9.446 1.0 38.93 ? 207 ALA B CB 1 29 . B ATOM 1632 N N . VAL B 2 30 ? -9.073 28.326 6.168 1.0 42.24 ? 208 VAL B N 1 30 . B ATOM 1633 C CA . VAL B 2 30 ? -8.802 29.239 5.065 1.0 41.61 ? 208 VAL B CA 1 30 . B ATOM 1634 C C . VAL B 2 30 ? -9.890 30.302 5.073 1.0 45.37 ? 208 VAL B C 1 30 . B ATOM 1635 O O . VAL B 2 30 ? -11.083 29.972 5.069 1.0 44.02 ? 208 VAL B O 1 30 . B ATOM 1636 C CB . VAL B 2 30 ? -8.756 28.506 3.716 1.0 44.38 ? 208 VAL B CB 1 30 . B ATOM 1637 C CG1 . VAL B 2 30 ? -8.713 29.514 2.549 1.0 52.75 ? 208 VAL B CG1 1 30 . B ATOM 1638 C CG2 . VAL B 2 30 ? -7.542 27.605 3.672 1.0 34.11 ? 208 VAL B CG2 1 30 . B ATOM 1639 N N . SER B 2 31 ? -9.483 31.574 5.099 1.0 37.06 ? 209 SER B N 1 31 . B ATOM 1640 C CA . SER B 2 31 ? -10.409 32.709 5.049 1.0 41.86 ? 209 SER B CA 1 31 . B ATOM 1641 C C . SER B 2 31 ? -9.931 33.686 3.991 1.0 45.71 ? 209 SER B C 1 31 . B ATOM 1642 O O . SER B 2 31 ? -9.095 34.558 4.266 1.0 50.41 ? 209 SER B O 1 31 . B ATOM 1643 C CB . SER B 2 31 ? -10.536 33.418 6.396 1.0 47.0 ? 209 SER B CB 1 31 . B ATOM 1644 O OG . SER B 2 31 ? -11.672 32.954 7.094 1.0 67.59 ? 209 SER B OG 1 31 . B ATOM 1645 N N . PRO B 2 32 ? -10.428 33.566 2.767 1.0 50.28 ? 210 PRO B N 1 32 . B ATOM 1646 C CA . PRO B 2 32 ? -10.041 34.521 1.727 1.0 52.72 ? 210 PRO B CA 1 32 . B ATOM 1647 C C . PRO B 2 32 ? -10.788 35.830 1.901 1.0 52.8 ? 210 PRO B C 1 32 . B ATOM 1648 O O . PRO B 2 32 ? -11.893 35.872 2.450 1.0 63.25 ? 210 PRO B O 1 32 . B ATOM 1649 C CB . PRO B 2 32 ? -10.435 33.814 0.423 1.0 50.39 ? 210 PRO B CB 1 32 . B ATOM 1650 C CG . PRO B 2 32 ? -11.543 32.885 0.817 1.0 60.19 ? 210 PRO B CG 1 32 . B ATOM 1651 C CD . PRO B 2 32 ? -11.351 32.529 2.280 1.0 48.84 ? 210 PRO B CD 1 32 . B ATOM 1652 N N . HIS B 2 33 ? -10.175 36.911 1.420 1.0 49.87 ? 211 HIS B N 1 33 . B ATOM 1653 C CA . HIS B 2 33 ? -10.779 38.239 1.511 1.0 59.39 ? 211 HIS B CA 1 33 . B ATOM 1654 C C . HIS B 2 33 ? -11.234 38.506 2.939 1.0 62.28 ? 211 HIS B C 1 33 . B ATOM 1655 O O . HIS B 2 33 ? -12.393 38.800 3.217 1.0 77.86 ? 211 HIS B O 1 33 . B ATOM 1656 C CB . HIS B 2 33 ? -11.944 38.369 0.538 1.0 55.08 ? 211 HIS B CB 1 33 . B ATOM 1657 C CG . HIS B 2 33 ? -11.572 38.069 -0.875 1.0 59.17 ? 211 HIS B CG 1 33 . B ATOM 1658 N ND1 . HIS B 2 33 ? -10.739 38.885 -1.611 1.0 61.9 ? 211 HIS B ND1 1 33 . B ATOM 1659 C CD2 . HIS B 2 33 ? -11.908 37.040 -1.687 1.0 61.95 ? 211 HIS B CD2 1 33 . B ATOM 1660 C CE1 . HIS B 2 33 ? -10.579 38.372 -2.819 1.0 61.32 ? 211 HIS B CE1 1 33 . B ATOM 1661 N NE2 . HIS B 2 33 ? -11.278 37.254 -2.891 1.0 64.47 ? 211 HIS B NE2 1 33 . B ATOM 1662 N N . PHE B 2 34 ? -10.290 38.389 3.855 1.0 55.72 ? 212 PHE B N 1 34 . B ATOM 1663 C CA . PHE B 2 34 ? -10.623 38.343 5.271 1.0 68.73 ? 212 PHE B CA 1 34 . B ATOM 1664 C C . PHE B 2 34 ? -10.385 39.645 6.008 1.0 55.49 ? 212 PHE B C 1 34 . B ATOM 1665 O O . PHE B 2 34 ? -11.218 40.045 6.815 1.0 56.34 ? 212 PHE B O 1 34 . B ATOM 1666 C CB . PHE B 2 34 ? -9.831 37.229 5.954 1.0 56.59 ? 212 PHE B CB 1 34 . B ATOM 1667 C CG . PHE B 2 34 ? -9.958 37.231 7.436 1.0 57.9 ? 212 PHE B CG 1 34 . B ATOM 1668 C CD1 . PHE B 2 34 ? -11.148 36.835 8.038 1.0 62.51 ? 212 PHE B CD1 1 34 . B ATOM 1669 C CD2 . PHE B 2 34 ? -8.898 37.628 8.229 1.0 64.05 ? 212 PHE B CD2 1 34 . B ATOM 1670 C CE1 . PHE B 2 34 ? -11.273 36.841 9.421 1.0 69.04 ? 212 PHE B CE1 1 34 . B ATOM 1671 C CE2 . PHE B 2 34 ? -9.010 37.640 9.612 1.0 66.47 ? 212 PHE B CE2 1 34 . B ATOM 1672 C CZ . PHE B 2 34 ? -10.202 37.243 10.207 1.0 66.32 ? 212 PHE B CZ 1 34 . B ATOM 1673 N N . LEU B 2 35 ? -9.263 40.300 5.773 1.0 56.92 ? 213 LEU B N 1 35 . B ATOM 1674 C CA . LEU B 2 35 ? -8.951 41.547 6.439 1.0 71.04 ? 213 LEU B CA 1 35 . B ATOM 1675 C C . LEU B 2 35 ? -8.799 42.668 5.421 1.0 73.16 ? 213 LEU B C 1 35 . B ATOM 1676 O O . LEU B 2 35 ? -8.224 42.479 4.342 1.0 66.03 ? 213 LEU B O 1 35 . B ATOM 1677 C CB . LEU B 2 35 ? -7.686 41.410 7.279 1.0 81.45 ? 213 LEU B CB 1 35 . B ATOM 1678 C CG . LEU B 2 35 ? -8.077 40.950 8.684 1.0 83.95 ? 213 LEU B CG 1 35 . B ATOM 1679 C CD1 . LEU B 2 35 ? -6.860 40.561 9.503 1.0 88.48 ? 213 LEU B CD1 1 35 . B ATOM 1680 C CD2 . LEU B 2 35 ? -8.876 42.053 9.380 1.0 81.42 ? 213 LEU B CD2 1 35 . B ATOM 1681 N N . LYS B 2 36 ? -9.343 43.827 5.772 1.0 72.53 ? 214 LYS B N 1 36 . B ATOM 1682 C CA . LYS B 2 36 ? -9.216 45.053 5.001 1.0 82.03 ? 214 LYS B CA 1 36 . B ATOM 1683 C C . LYS B 2 36 ? -8.266 45.976 5.752 1.0 86.79 ? 214 LYS B C 1 36 . B ATOM 1684 O O . LYS B 2 36 ? -8.551 46.373 6.889 1.0 91.95 ? 214 LYS B O 1 36 . B ATOM 1685 C CB . LYS B 2 36 ? -10.582 45.710 4.810 1.0 91.84 ? 214 LYS B CB 1 36 . B ATOM 1686 C CG . LYS B 2 36 ? -11.025 45.828 3.356 1.0 103.23 ? 214 LYS B CG 1 36 . B ATOM 1687 C CD . LYS B 2 36 ? -11.327 44.468 2.728 1.0 111.4 ? 214 LYS B CD 1 36 . B ATOM 1688 C CE . LYS B 2 36 ? -11.105 44.503 1.215 1.0 110.6 ? 214 LYS B CE 1 36 . B ATOM 1689 N NZ . LYS B 2 36 ? -11.860 43.443 0.485 1.0 103.39 ? 214 LYS B NZ 1 36 . B ATOM 1690 N N . LEU B 2 37 ? -7.144 46.308 5.121 1.0 86.75 ? 215 LEU B N 1 37 . B ATOM 1691 C CA . LEU B 2 37 ? -6.035 47.030 5.727 1.0 91.6 ? 215 LEU B CA 1 37 . B ATOM 1692 C C . LEU B 2 37 ? -5.818 48.377 5.055 1.0 98.3 ? 215 LEU B C 1 37 . B ATOM 1693 O O . LEU B 2 37 ? -5.820 48.458 3.826 1.0 96.46 ? 215 LEU B O 1 37 . B ATOM 1694 C CB . LEU B 2 37 ? -4.750 46.199 5.640 1.0 92.21 ? 215 LEU B CB 1 37 . B ATOM 1695 C CG . LEU B 2 37 ? -4.844 44.813 6.270 1.0 94.35 ? 215 LEU B CG 1 37 . B ATOM 1696 C CD1 . LEU B 2 37 ? -3.853 43.856 5.617 1.0 93.86 ? 215 LEU B CD1 1 37 . B ATOM 1697 C CD2 . LEU B 2 37 ? -4.600 44.907 7.765 1.0 89.74 ? 215 LEU B CD2 1 37 . B ATOM 1698 N N . PRO B 2 38 ? -5.619 49.434 5.825 1.0 106.35 ? 216 PRO B N 1 38 . B ATOM 1699 C CA . PRO B 2 38 ? -5.553 50.775 5.232 1.0 113.11 ? 216 PRO B CA 1 38 . B ATOM 1700 C C . PRO B 2 38 ? -4.157 51.375 5.128 1.0 120.72 ? 216 PRO B C 1 38 . B ATOM 1701 O O . PRO B 2 38 ? -3.769 52.189 5.975 1.0 129.73 ? 216 PRO B O 1 38 . B ATOM 1702 C CB . PRO B 2 38 ? -6.426 51.615 6.179 1.0 115.22 ? 216 PRO B CB 1 38 . B ATOM 1703 C CG . PRO B 2 38 ? -6.995 50.643 7.202 1.0 110.5 ? 216 PRO B CG 1 38 . B ATOM 1704 C CD . PRO B 2 38 ? -6.044 49.495 7.226 1.0 111.15 ? 216 PRO B CD 1 38 . B ATOM 1705 N N . ILE B 2 39 ? -3.405 50.997 4.089 1.0 114.31 ? 217 ILE B N 1 39 . B ATOM 1706 C CA . ILE B 2 39 ? -2.172 51.668 3.661 1.0 109.85 ? 217 ILE B CA 1 39 . B ATOM 1707 C C . ILE B 2 39 ? -1.326 52.211 4.810 1.0 114.95 ? 217 ILE B C 1 39 . B ATOM 1708 O O . ILE B 2 39 ? -0.565 53.164 4.628 1.0 112.28 ? 217 ILE B O 1 39 . B ATOM 1709 C CB . ILE B 2 39 ? -2.501 52.807 2.671 1.0 105.99 ? 217 ILE B CB 1 39 . B ATOM 1710 C CG1 . ILE B 2 39 ? -1.226 53.315 1.984 1.0 97.93 ? 217 ILE B CG1 1 39 . B ATOM 1711 C CG2 . ILE B 2 39 ? -3.245 53.955 3.378 1.0 110.87 ? 217 ILE B CG2 1 39 . B ATOM 1712 C CD1 . ILE B 2 39 ? -1.374 54.702 1.353 1.0 92.07 ? 217 ILE B CD1 1 39 . B ATOM 1713 N N . LYS B 2 40 ? -1.432 51.616 5.993 1.0 120.73 ? 218 LYS B N 1 40 . B ATOM 1714 C CA . LYS B 2 40 ? -0.588 52.014 7.114 1.0 111.77 ? 218 LYS B CA 1 40 . B ATOM 1715 C C . LYS B 2 40 ? 0.222 50.839 7.634 1.0 111.84 ? 218 LYS B C 1 40 . B ATOM 1716 O O . LYS B 2 40 ? 1.452 50.899 7.628 1.0 116.35 ? 218 LYS B O 1 40 . B ATOM 1717 C CB . LYS B 2 40 ? -1.425 52.642 8.238 1.0 97.67 ? 218 LYS B CB 1 40 . B ATOM 1718 C CG . LYS B 2 40 ? -2.097 53.936 7.811 1.0 89.29 ? 218 LYS B CG 1 40 . B ATOM 1719 C CD . LYS B 2 40 ? -2.685 54.656 9.018 1.0 85.9 ? 218 LYS B CD 1 40 . B ATOM 1720 C CE . LYS B 2 40 ? -3.573 55.823 8.589 1.0 90.24 ? 218 LYS B CE 1 40 . B ATOM 1721 N NZ . LYS B 2 40 ? -4.252 56.471 9.754 1.0 88.65 ? 218 LYS B NZ 1 40 . B ATOM 1722 N N . MET B 2 41 ? -0.419 49.764 8.069 1.0 106.93 ? 219 MET B N 1 41 . B ATOM 1723 C CA . MET B 2 41 ? 0.385 48.668 8.591 1.0 116.7 ? 219 MET B CA 1 41 . B ATOM 1724 C C . MET B 2 41 ? 0.866 47.731 7.493 1.0 116.65 ? 219 MET B C 1 41 . B ATOM 1725 O O . MET B 2 41 ? 0.787 46.511 7.633 1.0 119.45 ? 219 MET B O 1 41 . B ATOM 1726 C CB . MET B 2 41 ? -0.370 47.890 9.679 1.0 121.47 ? 219 MET B CB 1 41 . B ATOM 1727 C CG . MET B 2 41 ? -1.596 47.180 9.195 1.0 127.07 ? 219 MET B CG 1 41 . B ATOM 1728 S SD . MET B 2 41 ? -2.539 46.502 10.577 1.0 124.57 ? 219 MET B SD 1 41 . B ATOM 1729 C CE . MET B 2 41 ? -3.541 47.934 10.985 1.0 115.05 ? 219 MET B CE 1 41 . B ATOM 1730 N N . LEU B 2 42 ? 1.380 48.297 6.406 1.0 113.18 ? 220 LEU B N 1 42 . B ATOM 1731 C CA . LEU B 2 42 ? 2.128 47.533 5.413 1.0 107.89 ? 220 LEU B CA 1 42 . B ATOM 1732 C C . LEU B 2 42 ? 3.333 48.338 4.924 1.0 109.85 ? 220 LEU B C 1 42 . B ATOM 1733 O O . LEU B 2 42 ? 4.480 48.007 5.246 1.0 104.11 ? 220 LEU B O 1 42 . B ATOM 1734 C CB . LEU B 2 42 ? 1.235 47.126 4.236 1.0 104.09 ? 220 LEU B CB 1 42 . B ATOM 1735 C CG . LEU B 2 42 ? 0.247 45.970 4.436 1.0 100.56 ? 220 LEU B CG 1 42 . B ATOM 1736 C CD1 . LEU B 2 42 ? 0.873 44.762 5.162 1.0 92.42 ? 220 LEU B CD1 1 42 . B ATOM 1737 C CD2 . LEU B 2 42 ? -1.025 46.447 5.128 1.0 103.83 ? 220 LEU B CD2 1 42 . B ATOM 1738 N N . MET B 2 43 ? 3.087 49.412 4.176 1.0 110.47 ? 221 MET B N 1 43 . B ATOM 1739 C CA . MET B 2 43 ? 4.174 50.220 3.631 1.0 107.87 ? 221 MET B CA 1 43 . B ATOM 1740 C C . MET B 2 43 ? 4.341 51.534 4.388 1.0 109.8 ? 221 MET B C 1 43 . B ATOM 1741 O O . MET B 2 43 ? 4.155 52.612 3.821 1.0 111.47 ? 221 MET B O 1 43 . B ATOM 1742 C CB . MET B 2 43 ? 3.942 50.513 2.144 1.0 108.47 ? 221 MET B CB 1 43 . B ATOM 1743 C CG . MET B 2 43 ? 2.980 49.565 1.436 1.0 110.61 ? 221 MET B CG 1 43 . B ATOM 1744 S SD . MET B 2 43 ? 1.604 50.444 0.658 1.0 119.91 ? 221 MET B SD 1 43 . B ATOM 1745 C CE . MET B 2 43 ? 1.887 50.090 -1.077 1.0 116.48 ? 221 MET B CE 1 43 . B ATOM 1746 N N . HIS B 2 55 ? -6.770 50.735 0.629 1.0 105.75 ? 233 HIS B N 1 55 . B ATOM 1747 C CA . HIS B 2 55 ? -6.823 49.571 1.509 1.0 103.14 ? 233 HIS B CA 1 55 . B ATOM 1748 C C . HIS B 2 55 ? -6.191 48.336 0.868 1.0 91.36 ? 233 HIS B C 1 55 . B ATOM 1749 O O . HIS B 2 55 ? -6.077 48.235 -0.350 1.0 86.35 ? 233 HIS B O 1 55 . B ATOM 1750 C CB . HIS B 2 55 ? -8.264 49.258 1.912 1.0 112.23 ? 233 HIS B CB 1 55 . B ATOM 1751 C CG . HIS B 2 55 ? -9.117 48.779 0.778 1.0 123.45 ? 233 HIS B CG 1 55 . B ATOM 1752 N ND1 . HIS B 2 55 ? -9.202 49.454 -0.420 1.0 132.9 ? 233 HIS B ND1 1 55 . B ATOM 1753 C CD2 . HIS B 2 55 ? -9.923 47.697 0.659 1.0 125.36 ? 233 HIS B CD2 1 55 . B ATOM 1754 C CE1 . HIS B 2 55 ? -10.021 48.808 -1.231 1.0 133.78 ? 233 HIS B CE1 1 55 . B ATOM 1755 N NE2 . HIS B 2 55 ? -10.474 47.739 -0.600 1.0 130.67 ? 233 HIS B NE2 1 55 . B ATOM 1756 N N . LEU B 2 56 ? -5.782 47.394 1.708 1.0 88.85 ? 234 LEU B N 1 56 . B ATOM 1757 C CA . LEU B 2 56 ? -5.153 46.164 1.262 1.0 89.48 ? 234 LEU B CA 1 56 . B ATOM 1758 C C . LEU B 2 56 ? -5.994 44.994 1.739 1.0 82.3 ? 234 LEU B C 1 56 . B ATOM 1759 O O . LEU B 2 56 ? -6.401 44.952 2.905 1.0 88.74 ? 234 LEU B O 1 56 . B ATOM 1760 C CB . LEU B 2 56 ? -3.724 46.052 1.786 1.0 94.07 ? 234 LEU B CB 1 56 . B ATOM 1761 C CG . LEU B 2 56 ? -2.706 45.895 0.662 1.0 98.65 ? 234 LEU B CG 1 56 . B ATOM 1762 C CD1 . LEU B 2 56 ? -3.395 46.127 -0.672 1.0 100.63 ? 234 LEU B CD1 1 56 . B ATOM 1763 C CD2 . LEU B 2 56 ? -1.542 46.855 0.847 1.0 101.69 ? 234 LEU B CD2 1 56 . B ATOM 1764 N N . THR B 2 57 ? -6.264 44.055 0.839 1.0 80.58 ? 235 THR B N 1 57 . B ATOM 1765 C CA . THR B 2 57 ? -7.023 42.865 1.195 1.0 83.0 ? 235 THR B CA 1 57 . B ATOM 1766 C C . THR B 2 57 ? -6.057 41.768 1.623 1.0 78.17 ? 235 THR B C 1 57 . B ATOM 1767 O O . THR B 2 57 ? -5.063 41.498 0.929 1.0 69.21 ? 235 THR B O 1 57 . B ATOM 1768 C CB . THR B 2 57 ? -7.883 42.384 0.028 1.0 78.82 ? 235 THR B CB 1 57 . B ATOM 1769 O OG1 . THR B 2 57 ? -8.649 41.249 0.441 1.0 76.08 ? 235 THR B OG1 1 57 . B ATOM 1770 C CG2 . THR B 2 57 ? -7.016 42.002 -1.180 1.0 75.48 ? 235 THR B CG2 1 57 . B ATOM 1771 N N . GLY B 2 58 ? -6.344 41.146 2.763 1.0 80.01 ? 236 GLY B N 1 58 . B ATOM 1772 C CA . GLY B 2 58 ? -5.511 40.081 3.304 1.0 63.36 ? 236 GLY B CA 1 58 . B ATOM 1773 C C . GLY B 2 58 ? -6.239 38.755 3.288 1.0 52.86 ? 236 GLY B C 1 58 . B ATOM 1774 O O . GLY B 2 58 ? -7.454 38.700 3.500 1.0 54.07 ? 236 GLY B O 1 58 . B ATOM 1775 N N . HIS B 2 59 ? -5.490 37.680 3.046 1.0 44.23 ? 237 HIS B N 1 59 . B ATOM 1776 C CA . HIS B 2 59 ? -6.025 36.327 3.080 1.0 37.24 ? 237 HIS B CA 1 59 . B ATOM 1777 C C . HIS B 2 59 ? -5.389 35.534 4.216 1.0 35.38 ? 237 HIS B C 1 59 . B ATOM 1778 O O . HIS B 2 59 ? -4.162 35.545 4.384 1.0 38.77 ? 237 HIS B O 1 59 . B ATOM 1779 C CB . HIS B 2 59 ? -5.795 35.629 1.739 1.0 37.44 ? 237 HIS B CB 1 59 . B ATOM 1780 C CG . HIS B 2 59 ? -6.239 36.454 0.577 1.0 41.36 ? 237 HIS B CG 1 59 . B ATOM 1781 N ND1 . HIS B 2 59 ? -7.567 36.667 0.287 1.0 47.5 ? 237 HIS B ND1 1 59 . B ATOM 1782 C CD2 . HIS B 2 59 ? -5.534 37.159 -0.339 1.0 44.74 ? 237 HIS B CD2 1 59 . B ATOM 1783 C CE1 . HIS B 2 59 ? -7.662 37.450 -0.772 1.0 52.34 ? 237 HIS B CE1 1 59 . B ATOM 1784 N NE2 . HIS B 2 59 ? -6.444 37.764 -1.171 1.0 50.64 ? 237 HIS B NE2 1 59 . B ATOM 1785 N N . PHE B 2 60 ? -6.227 34.832 4.976 1.0 37.6 ? 238 PHE B N 1 60 . B ATOM 1786 C CA . PHE B 2 60 ? -5.800 34.101 6.164 1.0 36.22 ? 238 PHE B CA 1 60 . B ATOM 1787 C C . PHE B 2 60 ? -5.741 32.618 5.866 1.0 30.53 ? 238 PHE B C 1 60 . B ATOM 1788 O O . PHE B 2 60 ? -6.710 32.042 5.372 1.0 34.74 ? 238 PHE B O 1 60 . B ATOM 1789 C CB . PHE B 2 60 ? -6.748 34.329 7.342 1.0 35.56 ? 238 PHE B CB 1 60 . B ATOM 1790 C CG . PHE B 2 60 ? -6.391 33.525 8.572 1.0 39.87 ? 238 PHE B CG 1 60 . B ATOM 1791 C CD1 . PHE B 2 60 ? -6.792 32.201 8.702 1.0 39.48 ? 238 PHE B CD1 1 60 . B ATOM 1792 C CD2 . PHE B 2 60 ? -5.658 34.097 9.595 1.0 50.72 ? 238 PHE B CD2 1 60 . B ATOM 1793 C CE1 . PHE B 2 60 ? -6.458 31.450 9.828 1.0 34.84 ? 238 PHE B CE1 1 60 . B ATOM 1794 C CE2 . PHE B 2 60 ? -5.327 33.361 10.735 1.0 55.62 ? 238 PHE B CE2 1 60 . B ATOM 1795 C CZ . PHE B 2 60 ? -5.724 32.034 10.846 1.0 41.44 ? 238 PHE B CZ 1 60 . B ATOM 1796 N N . PHE B 2 61 ? -4.622 32.003 6.226 1.0 41.44 ? 239 PHE B N 1 61 . B ATOM 1797 C CA . PHE B 2 61 ? -4.418 30.566 6.140 1.0 29.87 ? 239 PHE B CA 1 61 . B ATOM 1798 C C . PHE B 2 61 ? -3.834 30.060 7.449 1.0 27.9 ? 239 PHE B C 1 61 . B ATOM 1799 O O . PHE B 2 61 ? -2.876 30.642 7.969 1.0 32.0 ? 239 PHE B O 1 61 . B ATOM 1800 C CB . PHE B 2 61 ? -3.466 30.221 5.007 1.0 30.69 ? 239 PHE B CB 1 61 . B ATOM 1801 C CG . PHE B 2 61 ? -3.906 30.753 3.671 1.0 33.88 ? 239 PHE B CG 1 61 . B ATOM 1802 C CD1 . PHE B 2 61 ? -4.757 30.014 2.870 1.0 36.0 ? 239 PHE B CD1 1 61 . B ATOM 1803 C CD2 . PHE B 2 61 ? -3.461 31.985 3.224 1.0 45.0 ? 239 PHE B CD2 1 61 . B ATOM 1804 C CE1 . PHE B 2 61 ? -5.157 30.488 1.627 1.0 36.16 ? 239 PHE B CE1 1 61 . B ATOM 1805 C CE2 . PHE B 2 61 ? -3.851 32.466 1.991 1.0 41.63 ? 239 PHE B CE2 1 61 . B ATOM 1806 C CZ . PHE B 2 61 ? -4.700 31.707 1.193 1.0 33.79 ? 239 PHE B CZ 1 61 . B ATOM 1807 N N . GLY B 2 62 ? -4.376 28.959 7.945 1.0 27.4 ? 240 GLY B N 1 62 . B ATOM 1808 C CA . GLY B 2 62 ? -3.924 28.398 9.212 1.0 46.74 ? 240 GLY B CA 1 62 . B ATOM 1809 C C . GLY B 2 62 ? -3.945 26.885 9.218 1.0 37.51 ? 240 GLY B C 1 62 . B ATOM 1810 O O . GLY B 2 62 ? -4.870 26.273 8.671 1.0 35.29 ? 240 GLY B O 1 62 . B ATOM 1811 N N . VAL B 2 63 ? -2.924 26.272 9.817 1.0 29.79 ? 241 VAL B N 1 63 . B ATOM 1812 C CA . VAL B 2 63 ? -2.882 24.836 10.057 1.0 27.83 ? 241 VAL B CA 1 63 . B ATOM 1813 C C . VAL B 2 63 ? -2.564 24.621 11.531 1.0 34.53 ? 241 VAL B C 1 63 . B ATOM 1814 O O . VAL B 2 63 ? -1.692 25.296 12.083 1.0 36.54 ? 241 VAL B O 1 63 . B ATOM 1815 C CB . VAL B 2 63 ? -1.831 24.130 9.171 1.0 29.84 ? 241 VAL B CB 1 63 . B ATOM 1816 C CG1 . VAL B 2 63 ? -1.697 22.674 9.571 1.0 35.31 ? 241 VAL B CG1 1 63 . B ATOM 1817 C CG2 . VAL B 2 63 ? -2.230 24.201 7.717 1.0 32.43 ? 241 VAL B CG2 1 63 . B ATOM 1818 N N . TYR B 2 64 ? -3.248 23.670 12.160 1.0 32.02 ? 242 TYR B N 1 64 . B ATOM 1819 C CA . TYR B 2 64 ? -3.167 23.463 13.606 1.0 33.7 ? 242 TYR B CA 1 64 . B ATOM 1820 C C . TYR B 2 64 ? -2.969 21.974 13.881 1.0 31.99 ? 242 TYR B C 1 64 . B ATOM 1821 O O . TYR B 2 64 ? -3.882 21.175 13.666 1.0 41.36 ? 242 TYR B O 1 64 . B ATOM 1822 C CB . TYR B 2 64 ? -4.441 23.974 14.274 1.0 25.76 ? 242 TYR B CB 1 64 . B ATOM 1823 C CG . TYR B 2 64 ? -4.813 25.353 13.793 1.0 32.89 ? 242 TYR B CG 1 64 . B ATOM 1824 C CD1 . TYR B 2 64 ? -4.038 26.433 14.137 1.0 43.4 ? 242 TYR B CD1 1 64 . B ATOM 1825 C CD2 . TYR B 2 64 ? -5.915 25.570 12.958 1.0 37.01 ? 242 TYR B CD2 1 64 . B ATOM 1826 C CE1 . TYR B 2 64 ? -4.343 27.695 13.697 1.0 45.63 ? 242 TYR B CE1 1 64 . B ATOM 1827 C CE2 . TYR B 2 64 ? -6.225 26.850 12.502 1.0 37.48 ? 242 TYR B CE2 1 64 . B ATOM 1828 C CZ . TYR B 2 64 ? -5.423 27.903 12.897 1.0 36.98 ? 242 TYR B CZ 1 64 . B ATOM 1829 O OH . TYR B 2 64 ? -5.660 29.201 12.523 1.0 46.09 ? 242 TYR B OH 1 64 . B ATOM 1830 N N . ASP B 2 65 ? -1.782 21.594 14.321 1.0 30.55 ? 243 ASP B N 1 65 . B ATOM 1831 C CA . ASP B 2 65 ? -1.511 20.196 14.634 1.0 28.09 ? 243 ASP B CA 1 65 . B ATOM 1832 C C . ASP B 2 65 ? -1.833 19.977 16.113 1.0 30.76 ? 243 ASP B C 1 65 . B ATOM 1833 O O . ASP B 2 65 ? -1.030 20.303 16.988 1.0 42.76 ? 243 ASP B O 1 65 . B ATOM 1834 C CB . ASP B 2 65 ? -0.069 19.825 14.315 1.0 32.7 ? 243 ASP B CB 1 65 . B ATOM 1835 C CG . ASP B 2 65 ? 0.211 18.347 14.544 1.0 39.23 ? 243 ASP B CG 1 65 . B ATOM 1836 O OD1 . ASP B 2 65 ? -0.630 17.721 15.212 1.0 37.35 ? 243 ASP B OD1 1 65 . B ATOM 1837 O OD2 . ASP B 2 65 ? 1.252 17.830 14.062 1.0 34.97 ? 243 ASP B OD2 1 65 . B ATOM 1838 N N . GLY B 2 66 ? -3.000 19.408 16.380 1.0 34.76 ? 244 GLY B N 1 66 . B ATOM 1839 C CA . GLY B 2 66 ? -3.381 19.111 17.749 1.0 35.62 ? 244 GLY B CA 1 66 . B ATOM 1840 C C . GLY B 2 66 ? -2.609 17.942 18.339 1.0 46.25 ? 244 GLY B C 1 66 . B ATOM 1841 O O . GLY B 2 66 ? -2.102 17.069 17.635 1.0 36.08 ? 244 GLY B O 1 66 . B ATOM 1842 N N . HIS B 2 67 ? -2.530 17.928 19.669 1.0 38.61 ? 245 HIS B N 1 67 . B ATOM 1843 C CA . HIS B 2 67 ? -1.953 16.803 20.393 1.0 43.6 ? 245 HIS B CA 1 67 . B ATOM 1844 C C . HIS B 2 67 ? -2.664 16.669 21.729 1.0 52.05 ? 245 HIS B C 1 67 . B ATOM 1845 O O . HIS B 2 67 ? -3.148 17.658 22.287 1.0 36.04 ? 245 HIS B O 1 67 . B ATOM 1846 C CB . HIS B 2 67 ? -0.443 16.963 20.611 1.0 33.7 ? 245 HIS B CB 1 67 . B ATOM 1847 C CG . HIS B 2 67 ? -0.066 18.266 21.230 1.0 45.82 ? 245 HIS B CG 1 67 . B ATOM 1848 N ND1 . HIS B 2 67 ? 0.436 19.318 20.494 1.0 52.82 ? 245 HIS B ND1 1 67 . B ATOM 1849 C CD2 . HIS B 2 67 ? -0.144 18.703 22.512 1.0 43.93 ? 245 HIS B CD2 1 67 . B ATOM 1850 C CE1 . HIS B 2 67 ? 0.662 20.343 21.297 1.0 54.48 ? 245 HIS B CE1 1 67 . B ATOM 1851 N NE2 . HIS B 2 67 ? 0.320 19.995 22.525 1.0 42.34 ? 245 HIS B NE2 1 67 . B ATOM 1852 N N . GLY B 2 68 ? -2.742 15.428 22.224 1.0 48.36 ? 246 GLY B N 1 68 . B ATOM 1853 C CA . GLY B 2 68 ? -3.450 15.139 23.456 1.0 47.51 ? 246 GLY B CA 1 68 . B ATOM 1854 C C . GLY B 2 68 ? -4.955 15.174 23.331 1.0 48.7 ? 246 GLY B C 1 68 . B ATOM 1855 O O . GLY B 2 68 ? -5.660 15.064 24.340 1.0 38.39 ? 246 GLY B O 1 68 . B ATOM 1856 N N . GLY B 2 69 ? -5.461 15.292 22.125 1.0 32.29 ? 247 GLY B N 1 69 . B ATOM 1857 C CA . GLY B 2 69 ? -6.876 15.491 21.884 1.0 46.14 ? 247 GLY B CA 1 69 . B ATOM 1858 C C . GLY B 2 69 ? -7.028 16.395 20.677 1.0 37.72 ? 247 GLY B C 1 69 . B ATOM 1859 O O . GLY B 2 69 ? -6.053 16.846 20.083 1.0 37.05 ? 247 GLY B O 1 69 . B ATOM 1860 N N . HIS B 2 70 ? -8.284 16.691 20.346 1.0 44.32 ? 248 HIS B N 1 70 . B ATOM 1861 C CA . HIS B 2 70 ? -8.592 17.469 19.151 1.0 44.06 ? 248 HIS B CA 1 70 . B ATOM 1862 C C . HIS B 2 70 ? -9.200 18.836 19.441 1.0 50.15 ? 248 HIS B C 1 70 . B ATOM 1863 O O . HIS B 2 70 ? -9.193 19.697 18.556 1.0 37.43 ? 248 HIS B O 1 70 . B ATOM 1864 C CB . HIS B 2 70 ? -9.560 16.684 18.248 1.0 39.37 ? 248 HIS B CB 1 70 . B ATOM 1865 C CG . HIS B 2 70 ? -10.858 16.343 18.910 1.0 56.14 ? 248 HIS B CG 1 70 . B ATOM 1866 N ND1 . HIS B 2 70 ? -12.004 17.089 18.733 1.0 54.18 ? 248 HIS B ND1 1 70 . B ATOM 1867 C CD2 . HIS B 2 70 ? -11.187 15.344 19.763 1.0 58.68 ? 248 HIS B CD2 1 70 . B ATOM 1868 C CE1 . HIS B 2 70 ? -12.985 16.556 19.439 1.0 55.69 ? 248 HIS B CE1 1 70 . B ATOM 1869 N NE2 . HIS B 2 70 ? -12.515 15.498 20.075 1.0 57.95 ? 248 HIS B NE2 1 70 . B ATOM 1870 N N . LYS B 2 71 ? -9.699 19.065 20.654 1.0 45.88 ? 249 LYS B N 1 71 . B ATOM 1871 C CA . LYS B 2 71 ? -10.526 20.243 20.897 1.0 47.68 ? 249 LYS B CA 1 71 . B ATOM 1872 C C . LYS B 2 71 ? -9.738 21.537 20.745 1.0 47.63 ? 249 LYS B C 1 71 . B ATOM 1873 O O . LYS B 2 71 ? -10.299 22.572 20.369 1.0 50.79 ? 249 LYS B O 1 71 . B ATOM 1874 C CB . LYS B 2 71 ? -11.148 20.173 22.284 1.0 43.44 ? 249 LYS B CB 1 71 . B ATOM 1875 C CG . LYS B 2 71 ? -12.182 19.094 22.424 1.0 52.63 ? 249 LYS B CG 1 71 . B ATOM 1876 C CD . LYS B 2 71 ? -12.477 18.865 23.901 1.0 59.82 ? 249 LYS B CD 1 71 . B ATOM 1877 C CE . LYS B 2 71 ? -13.952 19.056 24.185 1.0 65.12 ? 249 LYS B CE 1 71 . B ATOM 1878 N NZ . LYS B 2 71 ? -14.770 18.083 23.416 1.0 66.92 ? 249 LYS B NZ 1 71 . B ATOM 1879 N N . VAL B 2 72 ? -8.447 21.520 21.052 1.0 31.41 ? 250 VAL B N 1 72 . B ATOM 1880 C CA . VAL B 2 72 ? -7.693 22.755 20.916 1.0 31.11 ? 250 VAL B CA 1 72 . B ATOM 1881 C C . VAL B 2 72 ? -7.482 23.096 19.443 1.0 30.49 ? 250 VAL B C 1 72 . B ATOM 1882 O O . VAL B 2 72 ? -7.761 24.221 19.010 1.0 41.81 ? 250 VAL B O 1 72 . B ATOM 1883 C CB . VAL B 2 72 ? -6.375 22.673 21.692 1.0 41.0 ? 250 VAL B CB 1 72 . B ATOM 1884 C CG1 . VAL B 2 72 ? -5.578 23.928 21.426 1.0 33.4 ? 250 VAL B CG1 1 72 . B ATOM 1885 C CG2 . VAL B 2 72 ? -6.682 22.582 23.213 1.0 45.9 ? 250 VAL B CG2 1 72 . B ATOM 1886 N N . ALA B 2 73 ? -7.037 22.122 18.636 1.0 32.49 ? 251 ALA B N 1 73 . B ATOM 1887 C CA . ALA B 2 73 ? -6.881 22.390 17.205 1.0 32.87 ? 251 ALA B CA 1 73 . B ATOM 1888 C C . ALA B 2 73 ? -8.200 22.815 16.574 1.0 32.97 ? 251 ALA B C 1 73 . B ATOM 1889 O O . ALA B 2 73 ? -8.239 23.742 15.759 1.0 37.4 ? 251 ALA B O 1 73 . B ATOM 1890 C CB . ALA B 2 73 ? -6.313 21.169 16.482 1.0 32.27 ? 251 ALA B CB 1 73 . B ATOM 1891 N N . ASP B 2 74 ? -9.298 22.159 16.938 1.0 33.66 ? 252 ASP B N 1 74 . B ATOM 1892 C CA . ASP B 2 74 ? -10.588 22.613 16.439 1.0 37.06 ? 252 ASP B CA 1 74 . B ATOM 1893 C C . ASP B 2 74 ? -10.892 24.030 16.914 1.0 43.91 ? 252 ASP B C 1 74 . B ATOM 1894 O O . ASP B 2 74 ? -11.423 24.853 16.151 1.0 41.72 ? 252 ASP B O 1 74 . B ATOM 1895 C CB . ASP B 2 74 ? -11.689 21.658 16.882 1.0 48.55 ? 252 ASP B CB 1 74 . B ATOM 1896 C CG . ASP B 2 74 ? -11.503 20.257 16.341 1.0 57.89 ? 252 ASP B CG 1 74 . B ATOM 1897 O OD1 . ASP B 2 74 ? -10.588 20.039 15.512 1.0 54.73 ? 252 ASP B OD1 1 74 . B ATOM 1898 O OD2 . ASP B 2 74 ? -12.296 19.380 16.741 1.0 66.94 ? 252 ASP B OD2 1 74 . B ATOM 1899 N N . TYR B 2 75 ? -10.583 24.339 18.175 1.0 40.01 ? 253 TYR B N 1 75 . B ATOM 1900 C CA . TYR B 2 75 ? -10.835 25.696 18.649 1.0 39.22 ? 253 TYR B CA 1 75 . B ATOM 1901 C C . TYR B 2 75 ? -10.072 26.699 17.800 1.0 40.47 ? 253 TYR B C 1 75 . B ATOM 1902 O O . TYR B 2 75 ? -10.654 27.650 17.268 1.0 39.74 ? 253 TYR B O 1 75 . B ATOM 1903 C CB . TYR B 2 75 ? -10.461 25.853 20.127 1.0 34.73 ? 253 TYR B CB 1 75 . B ATOM 1904 C CG . TYR B 2 75 ? -10.931 27.174 20.712 1.0 47.07 ? 253 TYR B CG 1 75 . B ATOM 1905 C CD1 . TYR B 2 75 ? -12.277 27.395 20.969 1.0 48.37 ? 253 TYR B CD1 1 75 . B ATOM 1906 C CD2 . TYR B 2 75 ? -10.030 28.191 21.041 1.0 42.24 ? 253 TYR B CD2 1 75 . B ATOM 1907 C CE1 . TYR B 2 75 ? -12.723 28.592 21.515 1.0 53.01 ? 253 TYR B CE1 1 75 . B ATOM 1908 C CE2 . TYR B 2 75 ? -10.470 29.397 21.582 1.0 36.49 ? 253 TYR B CE2 1 75 . B ATOM 1909 C CZ . TYR B 2 75 ? -11.823 29.591 21.818 1.0 44.94 ? 253 TYR B CZ 1 75 . B ATOM 1910 O OH . TYR B 2 75 ? -12.293 30.778 22.357 1.0 48.25 ? 253 TYR B OH 1 75 . B ATOM 1911 N N . CYS B 2 76 ? -8.760 26.497 17.657 1.0 35.27 ? 254 CYS B N 1 76 . B ATOM 1912 C CA . CYS B 2 76 ? -7.972 27.376 16.805 1.0 49.05 ? 254 CYS B CA 1 76 . B ATOM 1913 C C . CYS B 2 76 ? -8.615 27.521 15.430 1.0 49.82 ? 254 CYS B C 1 76 . B ATOM 1914 O O . CYS B 2 76 ? -8.694 28.628 14.878 1.0 43.64 ? 254 CYS B O 1 76 . B ATOM 1915 C CB . CYS B 2 76 ? -6.547 26.840 16.670 1.0 45.34 ? 254 CYS B CB 1 76 . B ATOM 1916 S SG . CYS B 2 76 ? -5.556 26.888 18.201 1.0 47.88 ? 254 CYS B SG 1 76 . B ATOM 1917 N N . ARG B 2 77 ? -9.083 26.411 14.862 1.0 46.06 ? 255 ARG B N 1 77 . B ATOM 1918 C CA . ARG B 2 77 ? -9.722 26.476 13.555 1.0 49.12 ? 255 ARG B CA 1 77 . B ATOM 1919 C C . ARG B 2 77 ? -10.886 27.451 13.570 1.0 54.69 ? 255 ARG B C 1 77 . B ATOM 1920 O O . ARG B 2 77 ? -10.995 28.317 12.695 1.0 40.68 ? 255 ARG B O 1 77 . B ATOM 1921 C CB . ARG B 2 77 ? -10.210 25.097 13.120 1.0 28.25 ? 255 ARG B CB 1 77 . B ATOM 1922 C CG . ARG B 2 77 ? -11.053 25.180 11.831 1.0 39.94 ? 255 ARG B CG 1 77 . B ATOM 1923 C CD . ARG B 2 77 ? -11.596 23.812 11.434 1.0 44.6 ? 255 ARG B CD 1 77 . B ATOM 1924 N NE . ARG B 2 77 ? -12.378 23.256 12.530 1.0 48.69 ? 255 ARG B NE 1 77 . B ATOM 1925 C CZ . ARG B 2 77 ? -12.492 21.958 12.782 1.0 58.19 ? 255 ARG B CZ 1 77 . B ATOM 1926 N NH1 . ARG B 2 77 ? -11.872 21.071 12.007 1.0 52.15 ? 255 ARG B NH1 1 77 . B ATOM 1927 N NH2 . ARG B 2 77 ? -13.219 21.547 13.816 1.0 56.69 ? 255 ARG B NH2 1 77 . B ATOM 1928 N N . ASP B 2 78 ? -11.775 27.315 14.563 1.0 40.67 ? 256 ASP B N 1 78 . B ATOM 1929 C CA . ASP B 2 78 ? -13.015 28.076 14.578 1.0 42.32 ? 256 ASP B CA 1 78 . B ATOM 1930 C C . ASP B 2 78 ? -12.838 29.493 15.120 1.0 45.32 ? 256 ASP B C 1 78 . B ATOM 1931 O O . ASP B 2 78 ? -13.704 30.343 14.893 1.0 47.82 ? 256 ASP B O 1 78 . B ATOM 1932 C CB . ASP B 2 78 ? -14.069 27.345 15.412 1.0 54.07 ? 256 ASP B CB 1 78 . B ATOM 1933 C CG . ASP B 2 78 ? -14.322 25.937 14.937 1.0 62.99 ? 256 ASP B CG 1 78 . B ATOM 1934 O OD1 . ASP B 2 78 ? -14.057 25.640 13.757 1.0 71.79 ? 256 ASP B OD1 1 78 . B ATOM 1935 O OD2 . ASP B 2 78 ? -14.803 25.117 15.743 1.0 67.19 ? 256 ASP B OD2 1 78 . B ATOM 1936 N N . ARG B 2 79 ? -11.739 29.780 15.814 1.0 42.68 ? 257 ARG B N 1 79 . B ATOM 1937 C CA . ARG B 2 79 ? -11.629 31.027 16.565 1.0 49.38 ? 257 ARG B CA 1 79 . B ATOM 1938 C C . ARG B 2 79 ? -10.417 31.881 16.221 1.0 43.44 ? 257 ARG B C 1 79 . B ATOM 1939 O O . ARG B 2 79 ? -10.499 33.111 16.298 1.0 43.85 ? 257 ARG B O 1 79 . B ATOM 1940 C CB . ARG B 2 79 ? -11.609 30.724 18.071 1.0 56.57 ? 257 ARG B CB 1 79 . B ATOM 1941 C CG . ARG B 2 79 ? -11.114 31.871 18.939 1.0 56.35 ? 257 ARG B CG 1 79 . B ATOM 1942 C CD . ARG B 2 79 ? -12.083 33.032 18.938 1.0 52.21 ? 257 ARG B CD 1 79 . B ATOM 1943 N NE . ARG B 2 79 ? -11.649 34.083 19.851 1.0 59.15 ? 257 ARG B NE 1 79 . B ATOM 1944 C CZ . ARG B 2 79 ? -12.087 35.332 19.805 1.0 61.54 ? 257 ARG B CZ 1 79 . B ATOM 1945 N NH1 . ARG B 2 79 ? -12.970 35.685 18.878 1.0 56.19 ? 257 ARG B NH1 1 79 . B ATOM 1946 N NH2 . ARG B 2 79 ? -11.638 36.227 20.679 1.0 62.13 ? 257 ARG B NH2 1 79 . B ATOM 1947 N N . LEU B 2 80 ? -9.276 31.286 15.868 1.0 38.58 ? 258 LEU B N 1 80 . B ATOM 1948 C CA . LEU B 2 80 ? -8.041 32.063 15.910 1.0 48.43 ? 258 LEU B CA 1 80 . B ATOM 1949 C C . LEU B 2 80 ? -8.076 33.242 14.940 1.0 58.38 ? 258 LEU B C 1 80 . B ATOM 1950 O O . LEU B 2 80 ? -7.615 34.339 15.280 1.0 47.09 ? 258 LEU B O 1 80 . B ATOM 1951 C CB . LEU B 2 80 ? -6.831 31.171 15.648 1.0 48.89 ? 258 LEU B CB 1 80 . B ATOM 1952 C CG . LEU B 2 80 ? -5.495 31.801 16.046 1.0 48.82 ? 258 LEU B CG 1 80 . B ATOM 1953 C CD1 . LEU B 2 80 ? -4.531 30.718 16.501 1.0 50.97 ? 258 LEU B CD1 1 80 . B ATOM 1954 C CD2 . LEU B 2 80 ? -4.906 32.554 14.885 1.0 53.79 ? 258 LEU B CD2 1 80 . B ATOM 1955 N N . HIS B 2 81 ? -8.631 33.063 13.737 1.0 47.34 ? 259 HIS B N 1 81 . B ATOM 1956 C CA . HIS B 2 81 ? -8.609 34.206 12.824 1.0 46.56 ? 259 HIS B CA 1 81 . B ATOM 1957 C C . HIS B 2 81 ? -9.545 35.322 13.285 1.0 45.15 ? 259 HIS B C 1 81 . B ATOM 1958 O O . HIS B 2 81 ? -9.255 36.498 13.046 1.0 52.54 ? 259 HIS B O 1 81 . B ATOM 1959 C CB . HIS B 2 81 ? -8.926 33.786 11.385 1.0 48.34 ? 259 HIS B CB 1 81 . B ATOM 1960 C CG . HIS B 2 81 ? -10.205 33.033 11.231 1.0 43.21 ? 259 HIS B CG 1 81 . B ATOM 1961 N ND1 . HIS B 2 81 ? -10.433 31.817 11.839 1.0 50.49 ? 259 HIS B ND1 1 81 . B ATOM 1962 C CD2 . HIS B 2 81 ? -11.313 33.305 10.505 1.0 52.79 ? 259 HIS B CD2 1 81 . B ATOM 1963 C CE1 . HIS B 2 81 ? -11.640 31.387 11.518 1.0 46.56 ? 259 HIS B CE1 1 81 . B ATOM 1964 N NE2 . HIS B 2 81 ? -12.196 32.273 10.711 1.0 51.96 ? 259 HIS B NE2 1 81 . B ATOM 1965 N N . PHE B 2 82 ? -10.652 34.987 13.955 1.0 49.08 ? 260 PHE B N 1 82 . B ATOM 1966 C CA . PHE B 2 82 ? -11.516 36.025 14.514 1.0 52.43 ? 260 PHE B CA 1 82 . B ATOM 1967 C C . PHE B 2 82 ? -10.823 36.782 15.637 1.0 57.09 ? 260 PHE B C 1 82 . B ATOM 1968 O O . PHE B 2 82 ? -10.955 38.007 15.742 1.0 56.74 ? 260 PHE B O 1 82 . B ATOM 1969 C CB . PHE B 2 82 ? -12.818 35.418 15.016 1.0 62.24 ? 260 PHE B CB 1 82 . B ATOM 1970 C CG . PHE B 2 82 ? -13.700 34.919 13.922 1.0 61.66 ? 260 PHE B CG 1 82 . B ATOM 1971 C CD1 . PHE B 2 82 ? -14.169 35.788 12.951 1.0 60.95 ? 260 PHE B CD1 1 82 . B ATOM 1972 C CD2 . PHE B 2 82 ? -14.070 33.589 13.866 1.0 52.29 ? 260 PHE B CD2 1 82 . B ATOM 1973 C CE1 . PHE B 2 82 ? -14.982 35.336 11.929 1.0 61.0 ? 260 PHE B CE1 1 82 . B ATOM 1974 C CE2 . PHE B 2 82 ? -14.888 33.128 12.843 1.0 60.32 ? 260 PHE B CE2 1 82 . B ATOM 1975 C CZ . PHE B 2 82 ? -15.342 34.003 11.874 1.0 49.52 ? 260 PHE B CZ 1 82 . B ATOM 1976 N N . ALA B 2 83 ? -10.093 36.070 16.495 1.0 57.71 ? 261 ALA B N 1 83 . B ATOM 1977 C CA . ALA B 2 83 ? -9.274 36.751 17.488 1.0 58.01 ? 261 ALA B CA 1 83 . B ATOM 1978 C C . ALA B 2 83 ? -8.293 37.710 16.827 1.0 56.62 ? 261 ALA B C 1 83 . B ATOM 1979 O O . ALA B 2 83 ? -8.048 38.805 17.351 1.0 53.26 ? 261 ALA B O 1 83 . B ATOM 1980 C CB . ALA B 2 83 ? -8.540 35.728 18.357 1.0 52.71 ? 261 ALA B CB 1 83 . B ATOM 1981 N N . LEU B 2 84 ? -7.733 37.327 15.674 1.0 52.26 ? 262 LEU B N 1 84 . B ATOM 1982 C CA . LEU B 2 84 ? -6.825 38.216 14.950 1.0 45.57 ? 262 LEU B CA 1 84 . B ATOM 1983 C C . LEU B 2 84 ? -7.572 39.411 14.378 1.0 45.97 ? 262 LEU B C 1 84 . B ATOM 1984 O O . LEU B 2 84 ? -7.068 40.537 14.403 1.0 53.78 ? 262 LEU B O 1 84 . B ATOM 1985 C CB . LEU B 2 84 ? -6.109 37.457 13.832 1.0 41.94 ? 262 LEU B CB 1 84 . B ATOM 1986 C CG . LEU B 2 84 ? -5.226 38.269 12.876 1.0 47.89 ? 262 LEU B CG 1 84 . B ATOM 1987 C CD1 . LEU B 2 84 ? -4.074 38.923 13.618 1.0 52.57 ? 262 LEU B CD1 1 84 . B ATOM 1988 C CD2 . LEU B 2 84 ? -4.695 37.394 11.726 1.0 46.6 ? 262 LEU B CD2 1 84 . B ATOM 1989 N N . ALA B 2 85 ? -8.782 39.185 13.861 1.0 47.07 ? 263 ALA B N 1 85 . B ATOM 1990 C CA . ALA B 2 85 ? -9.578 40.292 13.338 1.0 45.77 ? 263 ALA B CA 1 85 . B ATOM 1991 C C . ALA B 2 85 ? -9.901 41.310 14.427 1.0 62.83 ? 263 ALA B C 1 85 . B ATOM 1992 O O . ALA B 2 85 ? -9.965 42.517 14.164 1.0 66.26 ? 263 ALA B O 1 85 . B ATOM 1993 C CB . ALA B 2 85 ? -10.866 39.761 12.712 1.0 41.83 ? 263 ALA B CB 1 85 . B ATOM 1994 N N . GLU B 2 86 ? -10.115 40.840 15.658 1.0 63.23 ? 264 GLU B N 1 86 . B ATOM 1995 C CA . GLU B 2 86 ? -10.409 41.751 16.759 1.0 62.6 ? 264 GLU B CA 1 86 . B ATOM 1996 C C . GLU B 2 86 ? -9.181 42.573 17.134 1.0 63.68 ? 264 GLU B C 1 86 . B ATOM 1997 O O . GLU B 2 86 ? -9.260 43.797 17.269 1.0 68.8 ? 264 GLU B O 1 86 . B ATOM 1998 C CB . GLU B 2 86 ? -10.937 40.962 17.956 1.0 61.23 ? 264 GLU B CB 1 86 . B ATOM 1999 C CG . GLU B 2 86 ? -12.338 40.430 17.714 1.0 57.92 ? 264 GLU B CG 1 86 . B ATOM 2000 C CD . GLU B 2 86 ? -12.721 39.307 18.648 1.0 65.22 ? 264 GLU B CD 1 86 . B ATOM 2001 O OE1 . GLU B 2 86 ? -12.036 39.131 19.679 1.0 75.25 ? 264 GLU B OE1 1 86 . B ATOM 2002 O OE2 . GLU B 2 86 ? -13.715 38.600 18.357 1.0 65.8 ? 264 GLU B OE2 1 86 . B ATOM 2003 N N . GLU B 2 87 ? -8.034 41.915 17.301 1.0 62.09 ? 265 GLU B N 1 87 . B ATOM 2004 C CA . GLU B 2 87 ? -6.797 42.643 17.548 1.0 63.16 ? 265 GLU B CA 1 87 . B ATOM 2005 C C . GLU B 2 87 ? -6.571 43.687 16.466 1.0 68.26 ? 265 GLU B C 1 87 . B ATOM 2006 O O . GLU B 2 87 ? -6.153 44.812 16.752 1.0 70.7 ? 265 GLU B O 1 87 . B ATOM 2007 C CB . GLU B 2 87 ? -5.622 41.667 17.615 1.0 59.25 ? 265 GLU B CB 1 87 . B ATOM 2008 C CG . GLU B 2 87 ? -4.522 42.082 18.571 1.0 77.57 ? 265 GLU B CG 1 87 . B ATOM 2009 C CD . GLU B 2 87 ? -5.005 42.187 20.008 1.0 90.15 ? 265 GLU B CD 1 87 . B ATOM 2010 O OE1 . GLU B 2 87 ? -5.399 41.152 20.590 1.0 94.72 ? 265 GLU B OE1 1 87 . B ATOM 2011 O OE2 . GLU B 2 87 ? -4.994 43.310 20.554 1.0 89.85 ? 265 GLU B OE2 1 87 . B ATOM 2012 N N . ILE B 2 88 ? -6.856 43.334 15.211 1.0 71.68 ? 266 ILE B N 1 88 . B ATOM 2013 C CA . ILE B 2 88 ? -6.742 44.297 14.120 1.0 74.58 ? 266 ILE B CA 1 88 . B ATOM 2014 C C . ILE B 2 88 ? -7.762 45.413 14.289 1.0 79.52 ? 266 ILE B C 1 88 . B ATOM 2015 O O . ILE B 2 88 ? -7.460 46.588 14.066 1.0 79.21 ? 266 ILE B O 1 88 . B ATOM 2016 C CB . ILE B 2 88 ? -6.913 43.589 12.764 1.0 68.09 ? 266 ILE B CB 1 88 . B ATOM 2017 C CG1 . ILE B 2 88 ? -5.732 42.662 12.488 1.0 67.32 ? 266 ILE B CG1 1 88 . B ATOM 2018 C CG2 . ILE B 2 88 ? -7.057 44.611 11.643 1.0 63.63 ? 266 ILE B CG2 1 88 . B ATOM 2019 C CD1 . ILE B 2 88 ? -4.590 43.352 11.795 1.0 79.57 ? 266 ILE B CD1 1 88 . B ATOM 2020 N N . GLU B 2 89 ? -8.986 45.066 14.683 1.0 77.88 ? 267 GLU B N 1 89 . B ATOM 2021 C CA . GLU B 2 89 ? -10.026 46.074 14.839 1.0 81.21 ? 267 GLU B CA 1 89 . B ATOM 2022 C C . GLU B 2 89 ? -9.682 47.060 15.946 1.0 84.29 ? 267 GLU B C 1 89 . B ATOM 2023 O O . GLU B 2 89 ? -9.908 48.263 15.805 1.0 84.71 ? 267 GLU B O 1 89 . B ATOM 2024 C CB . GLU B 2 89 ? -11.364 45.391 15.106 1.0 90.93 ? 267 GLU B CB 1 89 . B ATOM 2025 C CG . GLU B 2 89 ? -12.497 46.355 15.331 1.0 106.38 ? 267 GLU B CG 1 89 . B ATOM 2026 C CD . GLU B 2 89 ? -12.504 47.460 14.306 1.0 111.69 ? 267 GLU B CD 1 89 . B ATOM 2027 O OE1 . GLU B 2 89 ? -12.908 48.590 14.652 1.0 111.74 ? 267 GLU B OE1 1 89 . B ATOM 2028 O OE2 . GLU B 2 89 ? -12.093 47.194 13.155 1.0 110.37 ? 267 GLU B OE2 1 89 . B ATOM 2029 N N . ARG B 2 90 ? -9.138 46.563 17.053 1.0 82.87 ? 268 ARG B N 1 90 . B ATOM 2030 C CA . ARG B 2 90 ? -8.694 47.421 18.144 1.0 81.34 ? 268 ARG B CA 1 90 . B ATOM 2031 C C . ARG B 2 90 ? -7.719 48.481 17.650 1.0 90.88 ? 268 ARG B C 1 90 . B ATOM 2032 O O . ARG B 2 90 ? -7.938 49.684 17.826 1.0 99.05 ? 268 ARG B O 1 90 . B ATOM 2033 C CB . ARG B 2 90 ? -8.033 46.575 19.234 1.0 80.58 ? 268 ARG B CB 1 90 . B ATOM 2034 C CG . ARG B 2 90 ? -8.732 46.617 20.571 1.0 84.78 ? 268 ARG B CG 1 90 . B ATOM 2035 C CD . ARG B 2 90 ? -9.937 45.694 20.611 1.0 92.49 ? 268 ARG B CD 1 90 . B ATOM 2036 N NE . ARG B 2 90 ? -9.575 44.277 20.578 1.0 93.55 ? 268 ARG B NE 1 90 . B ATOM 2037 C CZ . ARG B 2 90 ? -8.737 43.697 21.430 1.0 89.09 ? 268 ARG B CZ 1 90 . B ATOM 2038 N NH1 . ARG B 2 90 ? -8.145 44.415 22.374 1.0 86.93 ? 268 ARG B NH1 1 90 . B ATOM 2039 N NH2 . ARG B 2 90 ? -8.476 42.400 21.323 1.0 87.85 ? 268 ARG B NH2 1 90 . B ATOM 2040 N N . ILE B 2 91 ? -6.623 48.046 17.025 1.0 88.55 ? 269 ILE B N 1 91 . B ATOM 2041 C CA . ILE B 2 91 ? -5.605 48.991 16.586 1.0 92.68 ? 269 ILE B CA 1 91 . B ATOM 2042 C C . ILE B 2 91 ? -6.100 49.873 15.447 1.0 98.14 ? 269 ILE B C 1 91 . B ATOM 2043 O O . ILE B 2 91 ? -5.557 50.962 15.229 1.0 98.04 ? 269 ILE B O 1 91 . B ATOM 2044 C CB . ILE B 2 91 ? -4.324 48.230 16.200 1.0 92.18 ? 269 ILE B CB 1 91 . B ATOM 2045 C CG1 . ILE B 2 91 ? -4.331 47.873 14.715 1.0 96.36 ? 269 ILE B CG1 1 91 . B ATOM 2046 C CG2 . ILE B 2 91 ? -4.181 46.971 17.040 1.0 88.09 ? 269 ILE B CG2 1 91 . B ATOM 2047 C CD1 . ILE B 2 91 ? -3.753 48.962 13.829 1.0 97.05 ? 269 ILE B CD1 1 91 . B ATOM 2048 N N . LYS B 2 92 ? -7.103 49.416 14.697 1.0 103.89 ? 270 LYS B N 1 92 . B ATOM 2049 C CA . LYS B 2 92 ? -7.736 50.276 13.705 1.0 103.78 ? 270 LYS B CA 1 92 . B ATOM 2050 C C . LYS B 2 92 ? -8.422 51.457 14.386 1.0 113.86 ? 270 LYS B C 1 92 . B ATOM 2051 O O . LYS B 2 92 ? -8.316 52.599 13.927 1.0 117.83 ? 270 LYS B O 1 92 . B ATOM 2052 C CB . LYS B 2 92 ? -8.739 49.467 12.876 1.0 102.13 ? 270 LYS B CB 1 92 . B ATOM 2053 C CG . LYS B 2 92 ? -8.733 49.791 11.381 1.0 100.26 ? 270 LYS B CG 1 92 . B ATOM 2054 C CD . LYS B 2 92 ? -9.897 49.120 10.652 1.0 102.78 ? 270 LYS B CD 1 92 . B ATOM 2055 C CE . LYS B 2 92 ? -9.667 47.628 10.457 1.0 105.67 ? 270 LYS B CE 1 92 . B ATOM 2056 N NZ . LYS B 2 92 ? -9.580 47.262 9.016 1.0 106.69 ? 270 LYS B NZ 1 92 . B ATOM 2057 N N . ASP B 2 93 ? -9.116 51.201 15.494 1.0 106.58 ? 271 ASP B N 1 93 . B ATOM 2058 C CA . ASP B 2 93 ? -9.744 52.253 16.283 1.0 93.76 ? 271 ASP B CA 1 93 . B ATOM 2059 C C . ASP B 2 93 ? -8.741 53.316 16.711 1.0 96.52 ? 271 ASP B C 1 93 . B ATOM 2060 O O . ASP B 2 93 ? -8.893 54.493 16.367 1.0 101.76 ? 271 ASP B O 1 93 . B ATOM 2061 C CB . ASP B 2 93 ? -10.411 51.656 17.517 1.0 84.66 ? 271 ASP B CB 1 93 . B ATOM 2062 C CG . ASP B 2 93 ? -11.849 51.236 17.266 1.0 88.87 ? 271 ASP B CG 1 93 . B ATOM 2063 O OD1 . ASP B 2 93 ? -12.739 52.110 17.287 1.0 94.72 ? 271 ASP B OD1 1 93 . B ATOM 2064 O OD2 . ASP B 2 93 ? -12.101 50.033 17.074 1.0 86.45 ? 271 ASP B OD2 1 93 . B ATOM 2065 N N . GLU B 2 94 ? -7.720 52.902 17.470 1.0 92.58 ? 272 GLU B N 1 94 . B ATOM 2066 C CA . GLU B 2 94 ? -6.678 53.817 17.929 1.0 86.6 ? 272 GLU B CA 1 94 . B ATOM 2067 C C . GLU B 2 94 ? -6.196 54.728 16.799 1.0 86.05 ? 272 GLU B C 1 94 . B ATOM 2068 O O . GLU B 2 94 ? -6.307 55.958 16.878 1.0 94.08 ? 272 GLU B O 1 94 . B ATOM 2069 C CB . GLU B 2 94 ? -5.518 53.007 18.519 1.0 79.65 ? 272 GLU B CB 1 94 . B ATOM 2070 N N . LEU B 2 95 ? -5.691 54.129 15.721 1.0 82.68 ? 273 LEU B N 1 95 . B ATOM 2071 C CA . LEU B 2 95 ? -5.236 54.873 14.546 1.0 75.46 ? 273 LEU B CA 1 95 . B ATOM 2072 C C . LEU B 2 95 ? -6.388 55.621 13.889 1.0 77.37 ? 273 LEU B C 1 95 . B ATOM 2073 O O . LEU B 2 95 ? -6.525 56.837 14.052 1.0 81.31 ? 273 LEU B O 1 95 . B ATOM 2074 C CB . LEU B 2 95 ? -4.570 53.930 13.541 1.0 69.17 ? 273 LEU B CB 1 95 . B ATOM 2075 N N . GLN B 2 105 ? 7.288 45.404 11.265 1.0 97.05 ? 283 GLN B N 1 105 . B ATOM 2076 C CA . GLN B 2 105 ? 7.498 44.083 11.841 1.0 102.56 ? 283 GLN B CA 1 105 . B ATOM 2077 C C . GLN B 2 105 ? 7.308 44.109 13.353 1.0 111.32 ? 283 GLN B C 1 105 . B ATOM 2078 O O . GLN B 2 105 ? 7.008 43.079 13.956 1.0 112.64 ? 283 GLN B O 1 105 . B ATOM 2079 C CB . GLN B 2 105 ? 8.888 43.541 11.496 1.0 101.15 ? 283 GLN B CB 1 105 . B ATOM 2080 C CG . GLN B 2 105 ? 8.931 42.035 11.249 1.0 94.21 ? 283 GLN B CG 1 105 . B ATOM 2081 C CD . GLN B 2 105 ? 8.251 41.231 12.346 1.0 87.56 ? 283 GLN B CD 1 105 . B ATOM 2082 O OE1 . GLN B 2 105 ? 8.903 40.496 13.093 1.0 92.88 ? 283 GLN B OE1 1 105 . B ATOM 2083 N NE2 . GLN B 2 105 ? 6.934 41.362 12.443 1.0 71.59 ? 283 GLN B NE2 1 105 . B ATOM 2084 N N . VAL B 2 106 ? 7.494 45.280 13.967 1.0 117.91 ? 284 VAL B N 1 106 . B ATOM 2085 C CA . VAL B 2 106 ? 7.154 45.445 15.380 1.0 112.48 ? 284 VAL B CA 1 106 . B ATOM 2086 C C . VAL B 2 106 ? 5.666 45.746 15.571 1.0 111.62 ? 284 VAL B C 1 106 . B ATOM 2087 O O . VAL B 2 106 ? 5.173 45.704 16.710 1.0 112.08 ? 284 VAL B O 1 106 . B ATOM 2088 C CB . VAL B 2 106 ? 8.018 46.537 16.042 1.0 97.93 ? 284 VAL B CB 1 106 . B ATOM 2089 C CG1 . VAL B 2 106 ? 8.291 46.184 17.498 1.0 89.27 ? 284 VAL B CG1 1 106 . B ATOM 2090 C CG2 . VAL B 2 106 ? 9.329 46.731 15.279 1.0 95.32 ? 284 VAL B CG2 1 106 . B ATOM 2091 N N . GLN B 2 107 ? 4.949 46.070 14.490 1.0 103.65 ? 285 GLN B N 1 107 . B ATOM 2092 C CA . GLN B 2 107 ? 3.490 46.032 14.483 1.0 81.0 ? 285 GLN B CA 1 107 . B ATOM 2093 C C . GLN B 2 107 ? 2.997 44.587 14.507 1.0 70.32 ? 285 GLN B C 1 107 . B ATOM 2094 O O . GLN B 2 107 ? 2.308 44.159 15.442 1.0 59.27 ? 285 GLN B O 1 107 . B ATOM 2095 C CB . GLN B 2 107 ? 2.976 46.761 13.231 1.0 73.68 ? 285 GLN B CB 1 107 . B ATOM 2096 C CG . GLN B 2 107 ? 1.533 47.243 13.265 1.0 81.24 ? 285 GLN B CG 1 107 . B ATOM 2097 C CD . GLN B 2 107 ? 1.381 48.682 12.773 1.0 96.41 ? 285 GLN B CD 1 107 . B ATOM 2098 O OE1 . GLN B 2 107 ? 0.552 48.965 11.912 1.0 96.72 ? 285 GLN B OE1 1 107 . B ATOM 2099 N NE2 . GLN B 2 107 ? 2.183 49.594 13.321 1.0 89.68 ? 285 GLN B NE2 1 107 . B ATOM 2100 N N . TRP B 2 108 ? 3.392 43.802 13.500 1.0 58.99 ? 286 TRP B N 1 108 . B ATOM 2101 C CA . TRP B 2 108 ? 2.799 42.481 13.303 1.0 60.86 ? 286 TRP B CA 1 108 . B ATOM 2102 C C . TRP B 2 108 ? 3.176 41.488 14.396 1.0 53.22 ? 286 TRP B C 1 108 . B ATOM 2103 O O . TRP B 2 108 ? 2.316 40.732 14.858 1.0 56.36 ? 286 TRP B O 1 108 . B ATOM 2104 C CB . TRP B 2 108 ? 3.168 41.955 11.923 1.0 55.14 ? 286 TRP B CB 1 108 . B ATOM 2105 C CG . TRP B 2 108 ? 2.317 42.518 10.836 1.0 62.24 ? 286 TRP B CG 1 108 . B ATOM 2106 C CD1 . TRP B 2 108 ? 2.722 43.302 9.796 1.0 60.31 ? 286 TRP B CD1 1 108 . B ATOM 2107 C CD2 . TRP B 2 108 ? 0.903 42.353 10.686 1.0 54.07 ? 286 TRP B CD2 1 108 . B ATOM 2108 N NE1 . TRP B 2 108 ? 1.650 43.622 9.005 1.0 54.36 ? 286 TRP B NE1 1 108 . B ATOM 2109 C CE2 . TRP B 2 108 ? 0.520 43.058 9.532 1.0 52.05 ? 286 TRP B CE2 1 108 . B ATOM 2110 C CE3 . TRP B 2 108 ? -0.077 41.685 11.423 1.0 57.56 ? 286 TRP B CE3 1 108 . B ATOM 2111 C CZ2 . TRP B 2 108 ? -0.797 43.108 9.091 1.0 58.31 ? 286 TRP B CZ2 1 108 . B ATOM 2112 C CZ3 . TRP B 2 108 ? -1.389 41.737 10.982 1.0 57.05 ? 286 TRP B CZ3 1 108 . B ATOM 2113 C CH2 . TRP B 2 108 ? -1.735 42.437 9.825 1.0 51.51 ? 286 TRP B CH2 1 108 . B ATOM 2114 N N . ASP B 2 109 ? 4.436 41.463 14.827 1.0 60.48 ? 287 ASP B N 1 109 . B ATOM 2115 C CA . ASP B 2 109 ? 4.786 40.501 15.867 1.0 64.16 ? 287 ASP B CA 1 109 . B ATOM 2116 C C . ASP B 2 109 ? 4.000 40.756 17.152 1.0 56.81 ? 287 ASP B C 1 109 . B ATOM 2117 O O . ASP B 2 109 ? 3.627 39.799 17.844 1.0 52.5 ? 287 ASP B O 1 109 . B ATOM 2118 C CB . ASP B 2 109 ? 6.303 40.477 16.139 1.0 65.29 ? 287 ASP B CB 1 109 . B ATOM 2119 C CG . ASP B 2 109 ? 6.869 41.825 16.562 1.0 87.15 ? 287 ASP B CG 1 109 . B ATOM 2120 O OD1 . ASP B 2 109 ? 6.093 42.777 16.791 1.0 87.19 ? 287 ASP B OD1 1 109 . B ATOM 2121 O OD2 . ASP B 2 109 ? 8.108 41.928 16.676 1.0 100.14 ? 287 ASP B OD2 1 109 . B ATOM 2122 N N . LYS B 2 110 ? 3.696 42.025 17.458 1.0 58.75 ? 288 LYS B N 1 110 . B ATOM 2123 C CA . LYS B 2 110 ? 2.862 42.341 18.615 1.0 51.47 ? 288 LYS B CA 1 110 . B ATOM 2124 C C . LYS B 2 110 ? 1.424 41.907 18.384 1.0 50.61 ? 288 LYS B C 1 110 . B ATOM 2125 O O . LYS B 2 110 ? 0.791 41.321 19.270 1.0 51.2 ? 288 LYS B O 1 110 . B ATOM 2126 C CB . LYS B 2 110 ? 2.913 43.842 18.924 1.0 58.39 ? 288 LYS B CB 1 110 . B ATOM 2127 C CG . LYS B 2 110 ? 4.253 44.342 19.427 1.0 67.26 ? 288 LYS B CG 1 110 . B ATOM 2128 C CD . LYS B 2 110 ? 4.151 45.782 19.911 1.0 74.12 ? 288 LYS B CD 1 110 . B ATOM 2129 C CE . LYS B 2 110 ? 5.460 46.241 20.529 1.0 83.81 ? 288 LYS B CE 1 110 . B ATOM 2130 N NZ . LYS B 2 110 ? 5.358 47.585 21.166 1.0 88.47 ? 288 LYS B NZ 1 110 . B ATOM 2131 N N . VAL B 2 111 ? 0.884 42.197 17.201 1.0 51.05 ? 289 VAL B N 1 111 . B ATOM 2132 C CA . VAL B 2 111 ? -0.485 41.789 16.908 1.0 48.49 ? 289 VAL B CA 1 111 . B ATOM 2133 C C . VAL B 2 111 ? -0.629 40.275 17.039 1.0 51.91 ? 289 VAL B C 1 111 . B ATOM 2134 O O . VAL B 2 111 ? -1.533 39.778 17.720 1.0 48.51 ? 289 VAL B O 1 111 . B ATOM 2135 C CB . VAL B 2 111 ? -0.908 42.285 15.516 1.0 44.22 ? 289 VAL B CB 1 111 . B ATOM 2136 C CG1 . VAL B 2 111 ? -2.213 41.639 15.113 1.0 52.66 ? 289 VAL B CG1 1 111 . B ATOM 2137 C CG2 . VAL B 2 111 ? -1.049 43.775 15.513 1.0 52.89 ? 289 VAL B CG2 1 111 . B ATOM 2138 N N . PHE B 2 112 ? 0.262 39.515 16.409 1.0 45.42 ? 290 PHE B N 1 112 . B ATOM 2139 C CA . PHE B 2 112 ? 0.111 38.069 16.485 1.0 48.79 ? 290 PHE B CA 1 112 . B ATOM 2140 C C . PHE B 2 112 ? 0.407 37.528 17.877 1.0 49.37 ? 290 PHE B C 1 112 . B ATOM 2141 O O . PHE B 2 112 ? -0.231 36.561 18.306 1.0 58.94 ? 290 PHE B O 1 112 . B ATOM 2142 C CB . PHE B 2 112 ? 0.997 37.386 15.451 1.0 44.26 ? 290 PHE B CB 1 112 . B ATOM 2143 C CG . PHE B 2 112 ? 0.334 37.232 14.122 1.0 43.04 ? 290 PHE B CG 1 112 . B ATOM 2144 C CD1 . PHE B 2 112 ? -0.630 36.265 13.933 1.0 44.97 ? 290 PHE B CD1 1 112 . B ATOM 2145 C CD2 . PHE B 2 112 ? 0.644 38.077 13.084 1.0 39.35 ? 290 PHE B CD2 1 112 . B ATOM 2146 C CE1 . PHE B 2 112 ? -1.246 36.101 12.703 1.0 55.19 ? 290 PHE B CE1 1 112 . B ATOM 2147 C CE2 . PHE B 2 112 ? 0.022 37.935 11.863 1.0 45.77 ? 290 PHE B CE2 1 112 . B ATOM 2148 C CZ . PHE B 2 112 ? -0.925 36.945 11.668 1.0 40.75 ? 290 PHE B CZ 1 112 . B ATOM 2149 N N . THR B 2 113 ? 1.366 38.112 18.592 1.0 43.46 ? 291 THR B N 1 113 . B ATOM 2150 C CA . THR B 2 113 ? 1.608 37.646 19.952 1.0 55.17 ? 291 THR B CA 1 113 . B ATOM 2151 C C . THR B 2 113 ? 0.372 37.846 20.824 1.0 52.63 ? 291 THR B C 1 113 . B ATOM 2152 O O . THR B 2 113 ? 0.006 36.957 21.601 1.0 58.28 ? 291 THR B O 1 113 . B ATOM 2153 C CB . THR B 2 113 ? 2.829 38.347 20.540 1.0 70.92 ? 291 THR B CB 1 113 . B ATOM 2154 O OG1 . THR B 2 113 ? 3.967 38.061 19.719 1.0 65.7 ? 291 THR B OG1 1 113 . B ATOM 2155 C CG2 . THR B 2 113 ? 3.104 37.854 21.968 1.0 66.46 ? 291 THR B CG2 1 113 . B ATOM 2156 N N . SER B 2 114 ? -0.311 38.984 20.678 1.0 48.74 ? 292 SER B N 1 114 . B ATOM 2157 C CA . SER B 2 114 ? -1.542 39.197 21.437 1.0 61.3 ? 292 SER B CA 1 114 . B ATOM 2158 C C . SER B 2 114 ? -2.635 38.231 20.999 1.0 52.14 ? 292 SER B C 1 114 . B ATOM 2159 O O . SER B 2 114 ? -3.363 37.687 21.833 1.0 57.67 ? 292 SER B O 1 114 . B ATOM 2160 C CB . SER B 2 114 ? -2.018 40.642 21.288 1.0 59.82 ? 292 SER B CB 1 114 . B ATOM 2161 O OG . SER B 2 114 ? -0.945 41.553 21.456 1.0 75.63 ? 292 SER B OG 1 114 . B ATOM 2162 N N . CYS B 2 115 ? -2.760 37.998 19.696 1.0 56.59 ? 293 CYS B N 1 115 . B ATOM 2163 C CA . CYS B 2 115 ? -3.799 37.097 19.205 1.0 50.23 ? 293 CYS B CA 1 115 . B ATOM 2164 C C . CYS B 2 115 ? -3.577 35.673 19.710 1.0 42.79 ? 293 CYS B C 1 115 . B ATOM 2165 O O . CYS B 2 115 ? -4.520 34.998 20.136 1.0 46.3 ? 293 CYS B O 1 115 . B ATOM 2166 C CB . CYS B 2 115 ? -3.840 37.145 17.679 1.0 56.55 ? 293 CYS B CB 1 115 . B ATOM 2167 S SG . CYS B 2 115 ? -4.711 35.775 16.946 1.0 69.83 ? 293 CYS B SG 1 115 . B ATOM 2168 N N . PHE B 2 116 ? -2.330 35.199 19.676 1.0 47.52 ? 294 PHE B N 1 116 . B ATOM 2169 C CA . PHE B 2 116 ? -2.042 33.837 20.114 1.0 42.98 ? 294 PHE B CA 1 116 . B ATOM 2170 C C . PHE B 2 116 ? -2.225 33.697 21.622 1.0 49.63 ? 294 PHE B C 1 116 . B ATOM 2171 O O . PHE B 2 116 ? -2.789 32.705 22.107 1.0 46.21 ? 294 PHE B O 1 116 . B ATOM 2172 C CB . PHE B 2 116 ? -0.627 33.445 19.694 1.0 44.27 ? 294 PHE B CB 1 116 . B ATOM 2173 C CG . PHE B 2 116 ? -0.528 32.885 18.270 1.0 44.45 ? 294 PHE B CG 1 116 . B ATOM 2174 C CD1 . PHE B 2 116 ? -1.207 33.470 17.219 1.0 40.19 ? 294 PHE B CD1 1 116 . B ATOM 2175 C CD2 . PHE B 2 116 ? 0.268 31.784 18.008 1.0 39.48 ? 294 PHE B CD2 1 116 . B ATOM 2176 C CE1 . PHE B 2 116 ? -1.093 32.962 15.920 1.0 46.2 ? 294 PHE B CE1 1 116 . B ATOM 2177 C CE2 . PHE B 2 116 ? 0.395 31.269 16.726 1.0 42.22 ? 294 PHE B CE2 1 116 . B ATOM 2178 C CZ . PHE B 2 116 ? -0.289 31.859 15.676 1.0 40.65 ? 294 PHE B CZ 1 116 . B ATOM 2179 N N . LEU B 2 117 ? -1.760 34.689 22.389 1.0 44.99 ? 295 LEU B N 1 117 . B ATOM 2180 C CA . LEU B 2 117 ? -1.942 34.623 23.835 1.0 52.99 ? 295 LEU B CA 1 117 . B ATOM 2181 C C . LEU B 2 117 ? -3.413 34.729 24.218 1.0 57.23 ? 295 LEU B C 1 117 . B ATOM 2182 O O . LEU B 2 117 ? -3.836 34.147 25.225 1.0 61.6 ? 295 LEU B O 1 117 . B ATOM 2183 C CB . LEU B 2 117 ? -1.124 35.718 24.536 1.0 49.23 ? 295 LEU B CB 1 117 . B ATOM 2184 C CG . LEU B 2 117 ? 0.349 35.364 24.764 1.0 56.36 ? 295 LEU B CG 1 117 . B ATOM 2185 C CD1 . LEU B 2 117 ? 1.019 34.966 23.434 1.0 66.83 ? 295 LEU B CD1 1 117 . B ATOM 2186 C CD2 . LEU B 2 117 ? 1.108 36.504 25.410 1.0 55.55 ? 295 LEU B CD2 1 117 . B ATOM 2187 N N . THR B 2 118 ? -4.207 35.461 23.441 1.0 53.0 ? 296 THR B N 1 118 . B ATOM 2188 C CA . THR B 2 118 ? -5.627 35.563 23.756 1.0 50.26 ? 296 THR B CA 1 118 . B ATOM 2189 C C . THR B 2 118 ? -6.321 34.221 23.576 1.0 57.75 ? 296 THR B C 1 118 . B ATOM 2190 O O . THR B 2 118 ? -7.078 33.776 24.444 1.0 52.02 ? 296 THR B O 1 118 . B ATOM 2191 C CB . THR B 2 118 ? -6.290 36.625 22.881 1.0 56.25 ? 296 THR B CB 1 118 . B ATOM 2192 O OG1 . THR B 2 118 ? -5.793 37.920 23.234 1.0 59.52 ? 296 THR B OG1 1 118 . B ATOM 2193 C CG2 . THR B 2 118 ? -7.783 36.591 23.082 1.0 53.48 ? 296 THR B CG2 1 118 . B ATOM 2194 N N . VAL B 2 119 ? -6.092 33.567 22.436 1.0 51.62 ? 297 VAL B N 1 119 . B ATOM 2195 C CA . VAL B 2 119 ? -6.738 32.287 22.194 1.0 44.37 ? 297 VAL B CA 1 119 . B ATOM 2196 C C . VAL B 2 119 ? -6.266 31.264 23.214 1.0 45.62 ? 297 VAL B C 1 119 . B ATOM 2197 O O . VAL B 2 119 ? -7.059 30.470 23.730 1.0 42.89 ? 297 VAL B O 1 119 . B ATOM 2198 C CB . VAL B 2 119 ? -6.479 31.832 20.739 1.0 44.69 ? 297 VAL B CB 1 119 . B ATOM 2199 C CG1 . VAL B 2 119 ? -6.742 30.348 20.582 1.0 39.02 ? 297 VAL B CG1 1 119 . B ATOM 2200 C CG2 . VAL B 2 119 ? -7.360 32.631 19.777 1.0 46.43 ? 297 VAL B CG2 1 119 . B ATOM 2201 N N . ASP B 2 120 ? -4.973 31.290 23.548 1.0 55.35 ? 298 ASP B N 1 120 . B ATOM 2202 C CA . ASP B 2 120 ? -4.439 30.364 24.547 1.0 41.76 ? 298 ASP B CA 1 120 . B ATOM 2203 C C . ASP B 2 120 ? -5.103 30.565 25.904 1.0 55.5 ? 298 ASP B C 1 120 . B ATOM 2204 O O . ASP B 2 120 ? -5.415 29.593 26.601 1.0 57.15 ? 298 ASP B O 1 120 . B ATOM 2205 C CB . ASP B 2 120 ? -2.923 30.542 24.656 1.0 51.58 ? 298 ASP B CB 1 120 . B ATOM 2206 C CG . ASP B 2 120 ? -2.299 29.682 25.743 1.0 61.9 ? 298 ASP B CG 1 120 . B ATOM 2207 O OD1 . ASP B 2 120 ? -2.116 28.469 25.529 1.0 68.35 ? 298 ASP B OD1 1 120 . B ATOM 2208 O OD2 . ASP B 2 120 ? -1.968 30.228 26.809 1.0 75.94 ? 298 ASP B OD2 1 120 . B ATOM 2209 N N . GLY B 2 121 ? -5.333 31.822 26.290 1.0 57.84 ? 299 GLY B N 1 121 . B ATOM 2210 C CA . GLY B 2 121 ? -5.989 32.101 27.555 1.0 60.83 ? 299 GLY B CA 1 121 . B ATOM 2211 C C . GLY B 2 121 ? -7.455 31.732 27.566 1.0 63.53 ? 299 GLY B C 1 121 . B ATOM 2212 O O . GLY B 2 121 ? -7.958 31.231 28.578 1.0 57.92 ? 299 GLY B O 1 121 . B ATOM 2213 N N . GLU B 2 122 ? -8.160 31.962 26.456 1.0 47.92 ? 300 GLU B N 1 122 . B ATOM 2214 C CA . GLU B 2 122 ? -9.526 31.462 26.347 1.0 48.23 ? 300 GLU B CA 1 122 . B ATOM 2215 C C . GLU B 2 122 ? -9.574 29.956 26.592 1.0 48.35 ? 300 GLU B C 1 122 . B ATOM 2216 O O . GLU B 2 122 ? -10.398 29.468 27.371 1.0 50.71 ? 300 GLU B O 1 122 . B ATOM 2217 C CB . GLU B 2 122 ? -10.105 31.815 24.977 1.0 44.32 ? 300 GLU B CB 1 122 . B ATOM 2218 C CG . GLU B 2 122 ? -10.234 33.300 24.748 1.0 47.14 ? 300 GLU B CG 1 122 . B ATOM 2219 C CD . GLU B 2 122 ? -10.622 33.669 23.330 1.0 66.21 ? 300 GLU B CD 1 122 . B ATOM 2220 O OE1 . GLU B 2 122 ? -10.680 32.779 22.443 1.0 62.21 ? 300 GLU B OE1 1 122 . B ATOM 2221 O OE2 . GLU B 2 122 ? -10.864 34.872 23.101 1.0 66.35 ? 300 GLU B OE2 1 122 . B ATOM 2222 N N . ILE B 2 123 ? -8.680 29.203 25.944 1.0 50.36 ? 301 ILE B N 1 123 . B ATOM 2223 C CA . ILE B 2 123 ? -8.663 27.748 26.098 1.0 44.32 ? 301 ILE B CA 1 123 . B ATOM 2224 C C . ILE B 2 123 ? -8.442 27.365 27.550 1.0 58.0 ? 301 ILE B C 1 123 . B ATOM 2225 O O . ILE B 2 123 ? -9.090 26.450 28.068 1.0 56.7 ? 301 ILE B O 1 123 . B ATOM 2226 C CB . ILE B 2 123 ? -7.566 27.118 25.231 1.0 40.81 ? 301 ILE B CB 1 123 . B ATOM 2227 C CG1 . ILE B 2 123 ? -7.918 27.163 23.735 1.0 44.33 ? 301 ILE B CG1 1 123 . B ATOM 2228 C CG2 . ILE B 2 123 ? -7.320 25.698 25.692 1.0 40.88 ? 301 ILE B CG2 1 123 . B ATOM 2229 C CD1 . ILE B 2 123 ? -6.741 26.818 22.868 1.0 44.78 ? 301 ILE B CD1 1 123 . B ATOM 2230 N N . GLU B 2 124 ? -7.443 27.992 28.188 1.0 71.64 ? 302 GLU B N 1 124 . B ATOM 2231 C CA . GLU B 2 124 ? -7.069 27.747 29.574 1.0 73.6 ? 302 GLU B CA 1 124 . B ATOM 2232 C C . GLU B 2 124 ? -8.156 28.175 30.544 1.0 75.3 ? 302 GLU B C 1 124 . B ATOM 2233 O O . GLU B 2 124 ? -8.083 27.834 31.732 1.0 79.95 ? 302 GLU B O 1 124 . B ATOM 2234 C CB . GLU B 2 124 ? -5.753 28.478 29.907 1.0 81.82 ? 302 GLU B CB 1 124 . B ATOM 2235 C CG . GLU B 2 124 ? -4.522 27.998 29.103 1.0 97.79 ? 302 GLU B CG 1 124 . B ATOM 2236 C CD . GLU B 2 124 ? -3.188 28.445 29.712 1.0 105.87 ? 302 GLU B CD 1 124 . B ATOM 2237 O OE1 . GLU B 2 124 ? -3.202 29.218 30.698 1.0 113.64 ? 302 GLU B OE1 1 124 . B ATOM 2238 O OE2 . GLU B 2 124 ? -2.124 28.016 29.208 1.0 97.69 ? 302 GLU B OE2 1 124 . B ATOM 2239 N N . GLY B 2 125 ? -9.157 28.909 30.069 1.0 59.14 ? 303 GLY B N 1 125 . B ATOM 2240 C CA . GLY B 2 125 ? -10.196 29.433 30.926 1.0 59.28 ? 303 GLY B CA 1 125 . B ATOM 2241 C C . GLY B 2 125 ? -9.813 30.661 31.723 1.0 63.46 ? 303 GLY B C 1 125 . B ATOM 2242 O O . GLY B 2 125 ? -10.517 30.996 32.683 1.0 70.22 ? 303 GLY B O 1 125 . B ATOM 2243 N N . LYS B 2 126 ? -8.713 31.333 31.369 1.0 64.93 ? 304 LYS B N 1 126 . B ATOM 2244 C CA . LYS B 2 126 ? -8.270 32.530 32.072 1.0 75.68 ? 304 LYS B CA 1 126 . B ATOM 2245 C C . LYS B 2 126 ? -8.739 33.814 31.400 1.0 75.3 ? 304 LYS B C 1 126 . B ATOM 2246 O O . LYS B 2 126 ? -8.792 34.860 32.058 1.0 69.14 ? 304 LYS B O 1 126 . B ATOM 2247 C CB . LYS B 2 126 ? -6.741 32.535 32.188 1.0 83.04 ? 304 LYS B CB 1 126 . B ATOM 2248 C CG . LYS B 2 126 ? -6.197 31.432 33.083 1.0 89.36 ? 304 LYS B CG 1 126 . B ATOM 2249 C CD . LYS B 2 126 ? -4.841 30.911 32.615 1.0 100.57 ? 304 LYS B CD 1 126 . B ATOM 2250 C CE . LYS B 2 126 ? -4.480 29.611 33.347 1.0 103.34 ? 304 LYS B CE 1 126 . B ATOM 2251 N NZ . LYS B 2 126 ? -3.238 28.953 32.835 1.0 92.12 ? 304 LYS B NZ 1 126 . B ATOM 2252 N N . ILE B 2 127 ? -9.065 33.763 30.111 1.0 74.06 ? 305 ILE B N 1 127 . B ATOM 2253 C CA . ILE B 2 127 ? -9.642 34.885 29.386 1.0 70.34 ? 305 ILE B CA 1 127 . B ATOM 2254 C C . ILE B 2 127 ? -11.080 34.523 29.053 1.0 71.82 ? 305 ILE B C 1 127 . B ATOM 2255 O O . ILE B 2 127 ? -11.365 33.380 28.677 1.0 70.15 ? 305 ILE B O 1 127 . B ATOM 2256 C CB . ILE B 2 127 ? -8.843 35.214 28.112 1.0 63.02 ? 305 ILE B CB 1 127 . B ATOM 2257 C CG1 . ILE B 2 127 ? -7.441 35.705 28.478 1.0 69.39 ? 305 ILE B CG1 1 127 . B ATOM 2258 C CG2 . ILE B 2 127 ? -9.579 36.242 27.253 1.0 55.69 ? 305 ILE B CG2 1 127 . B ATOM 2259 C CD1 . ILE B 2 127 ? -6.501 35.852 27.294 1.0 62.07 ? 305 ILE B CD1 1 127 . B ATOM 2260 N N . GLY B 2 128 ? -11.982 35.489 29.192 1.0 71.3 ? 306 GLY B N 1 128 . B ATOM 2261 C CA . GLY B 2 128 ? -13.391 35.219 28.957 1.0 67.94 ? 306 GLY B CA 1 128 . B ATOM 2262 C C . GLY B 2 128 ? -13.713 35.197 27.473 1.0 71.2 ? 306 GLY B C 1 128 . B ATOM 2263 O O . GLY B 2 128 ? -13.269 36.065 26.713 1.0 60.68 ? 306 GLY B O 1 128 . B ATOM 2264 N N . ARG B 2 129 ? -14.486 34.199 27.053 1.0 73.11 ? 307 ARG B N 1 129 . B ATOM 2265 C CA . ARG B 2 129 ? -14.987 34.124 25.687 1.0 85.85 ? 307 ARG B CA 1 129 . B ATOM 2266 C C . ARG B 2 129 ? -16.506 34.247 25.682 1.0 87.04 ? 307 ARG B C 1 129 . B ATOM 2267 O O . ARG B 2 129 ? -17.188 33.813 26.615 1.0 85.28 ? 307 ARG B O 1 129 . B ATOM 2268 C CB . ARG B 2 129 ? -14.555 32.819 24.999 1.0 77.28 ? 307 ARG B CB 1 129 . B ATOM 2269 C CG . ARG B 2 129 ? -14.905 31.573 25.771 1.0 78.24 ? 307 ARG B CG 1 129 . B ATOM 2270 C CD . ARG B 2 129 ? -14.036 30.413 25.359 1.0 79.74 ? 307 ARG B CD 1 129 . B ATOM 2271 N NE . ARG B 2 129 ? -14.197 29.287 26.269 1.0 88.09 ? 307 ARG B NE 1 129 . B ATOM 2272 C CZ . ARG B 2 129 ? -15.108 28.332 26.121 1.0 92.93 ? 307 ARG B CZ 1 129 . B ATOM 2273 N NH1 . ARG B 2 129 ? -15.941 28.367 25.091 1.0 89.5 ? 307 ARG B NH1 1 129 . B ATOM 2274 N NH2 . ARG B 2 129 ? -15.182 27.339 27.000 1.0 97.73 ? 307 ARG B NH2 1 129 . B ATOM 2275 N N . ALA B 2 130 ? -17.026 34.854 24.620 1.0 79.75 ? 308 ALA B N 1 130 . B ATOM 2276 C CA . ALA B 2 130 ? -18.456 35.113 24.504 1.0 84.41 ? 308 ALA B CA 1 130 . B ATOM 2277 C C . ALA B 2 130 ? -19.154 34.024 23.705 1.0 85.83 ? 308 ALA B C 1 130 . B ATOM 2278 O O . ALA B 2 130 ? -18.706 32.880 23.679 1.0 92.36 ? 308 ALA B O 1 130 . B ATOM 2279 C CB . ALA B 2 130 ? -18.698 36.465 23.869 1.0 88.05 ? 308 ALA B CB 1 130 . B ATOM 2280 N N . ASP B 2 136 ? -22.596 38.657 27.819 1.0 115.5 ? 314 ASP B N 1 136 . B ATOM 2281 C CA . ASP B 2 136 ? -21.760 38.058 28.852 1.0 116.52 ? 314 ASP B CA 1 136 . B ATOM 2282 C C . ASP B 2 136 ? -20.743 37.069 28.276 1.0 117.48 ? 314 ASP B C 1 136 . B ATOM 2283 O O . ASP B 2 136 ? -20.928 36.518 27.186 1.0 116.28 ? 314 ASP B O 1 136 . B ATOM 2284 C CB . ASP B 2 136 ? -22.630 37.364 29.899 1.0 119.42 ? 314 ASP B CB 1 136 . B ATOM 2285 C CG . ASP B 2 136 ? -22.498 37.990 31.276 1.0 122.02 ? 314 ASP B CG 1 136 . B ATOM 2286 O OD1 . ASP B 2 136 ? -21.394 38.467 31.616 1.0 125.83 ? 314 ASP B OD1 1 136 . B ATOM 2287 O OD2 . ASP B 2 136 ? -23.500 38.004 32.019 1.0 120.77 ? 314 ASP B OD2 1 136 . B ATOM 2288 N N . LYS B 2 137 ? -19.668 36.849 29.025 1.0 114.66 ? 315 LYS B N 1 137 . B ATOM 2289 C CA . LYS B 2 137 ? -18.571 35.996 28.599 1.0 108.34 ? 315 LYS B CA 1 137 . B ATOM 2290 C C . LYS B 2 137 ? -18.326 34.924 29.648 1.0 105.86 ? 315 LYS B C 1 137 . B ATOM 2291 O O . LYS B 2 137 ? -18.463 35.175 30.849 1.0 112.61 ? 315 LYS B O 1 137 . B ATOM 2292 C CB . LYS B 2 137 ? -17.309 36.826 28.350 1.0 103.65 ? 315 LYS B CB 1 137 . B ATOM 2293 C CG . LYS B 2 137 ? -17.433 37.691 27.106 1.0 104.48 ? 315 LYS B CG 1 137 . B ATOM 2294 C CD . LYS B 2 137 ? -16.234 38.587 26.889 1.0 102.72 ? 315 LYS B CD 1 137 . B ATOM 2295 C CE . LYS B 2 137 ? -16.507 39.520 25.723 1.0 105.37 ? 315 LYS B CE 1 137 . B ATOM 2296 N NZ . LYS B 2 137 ? -17.882 40.100 25.821 1.0 104.51 ? 315 LYS B NZ 1 137 . B ATOM 2297 N N . VAL B 2 138 ? -17.974 33.726 29.187 1.0 98.84 ? 316 VAL B N 1 138 . B ATOM 2298 C CA . VAL B 2 138 ? -17.802 32.561 30.046 1.0 89.32 ? 316 VAL B CA 1 138 . B ATOM 2299 C C . VAL B 2 138 ? -16.316 32.272 30.188 1.0 85.67 ? 316 VAL B C 1 138 . B ATOM 2300 O O . VAL B 2 138 ? -15.576 32.259 29.195 1.0 81.61 ? 316 VAL B O 1 138 . B ATOM 2301 C CB . VAL B 2 138 ? -18.555 31.342 29.491 1.0 78.21 ? 316 VAL B CB 1 138 . B ATOM 2302 C CG1 . VAL B 2 138 ? -20.038 31.645 29.409 1.0 82.81 ? 316 VAL B CG1 1 138 . B ATOM 2303 C CG2 . VAL B 2 138 ? -18.017 30.968 28.129 1.0 75.3 ? 316 VAL B CG2 1 138 . B ATOM 2304 N N . LEU B 2 139 ? -15.887 32.038 31.425 1.0 77.94 ? 317 LEU B N 1 139 . B ATOM 2305 C CA . LEU B 2 139 ? -14.488 31.795 31.770 1.0 85.87 ? 317 LEU B CA 1 139 . B ATOM 2306 C C . LEU B 2 139 ? -14.375 30.309 32.086 1.0 93.79 ? 317 LEU B C 1 139 . B ATOM 2307 O O . LEU B 2 139 ? -14.607 29.874 33.215 1.0 93.77 ? 317 LEU B O 1 139 . B ATOM 2308 C CB . LEU B 2 139 ? -14.071 32.663 32.953 1.0 89.36 ? 317 LEU B CB 1 139 . B ATOM 2309 C CG . LEU B 2 139 ? -12.605 33.037 33.172 1.0 86.45 ? 317 LEU B CG 1 139 . B ATOM 2310 C CD1 . LEU B 2 139 ? -12.069 33.929 32.040 1.0 74.04 ? 317 LEU B CD1 1 139 . B ATOM 2311 C CD2 . LEU B 2 139 ? -12.479 33.714 34.536 1.0 88.18 ? 317 LEU B CD2 1 139 . B ATOM 2312 N N . GLU B 2 140 ? -14.029 29.521 31.074 1.0 88.81 ? 318 GLU B N 1 140 . B ATOM 2313 C CA . GLU B 2 140 ? -14.063 28.076 31.223 1.0 88.91 ? 318 GLU B CA 1 140 . B ATOM 2314 C C . GLU B 2 140 ? -13.105 27.431 30.237 1.0 75.29 ? 318 GLU B C 1 140 . B ATOM 2315 O O . GLU B 2 140 ? -12.989 27.876 29.094 1.0 69.17 ? 318 GLU B O 1 140 . B ATOM 2316 C CB . GLU B 2 140 ? -15.480 27.541 31.005 1.0 98.71 ? 318 GLU B CB 1 140 . B ATOM 2317 C CG . GLU B 2 140 ? -15.625 26.066 31.314 1.0 103.19 ? 318 GLU B CG 1 140 . B ATOM 2318 C CD . GLU B 2 140 ? -16.791 25.434 30.585 1.0 109.07 ? 318 GLU B CD 1 140 . B ATOM 2319 O OE1 . GLU B 2 140 ? -17.211 25.978 29.538 1.0 114.12 ? 318 GLU B OE1 1 140 . B ATOM 2320 O OE2 . GLU B 2 140 ? -17.284 24.390 31.062 1.0 107.22 ? 318 GLU B OE2 1 140 . B ATOM 2321 N N . ALA B 2 141 ? -12.431 26.376 30.687 1.0 56.36 ? 319 ALA B N 1 141 . B ATOM 2322 C CA . ALA B 2 141 ? -11.499 25.668 29.829 1.0 61.35 ? 319 ALA B CA 1 141 . B ATOM 2323 C C . ALA B 2 141 ? -12.232 25.072 28.634 1.0 64.56 ? 319 ALA B C 1 141 . B ATOM 2324 O O . ALA B 2 141 ? -13.312 24.490 28.774 1.0 57.96 ? 319 ALA B O 1 141 . B ATOM 2325 C CB . ALA B 2 141 ? -10.781 24.577 30.625 1.0 49.61 ? 319 ALA B CB 1 141 . B ATOM 2326 N N . VAL B 2 142 ? -11.652 25.254 27.448 1.0 52.19 ? 320 VAL B N 1 142 . B ATOM 2327 C CA . VAL B 2 142 ? -12.207 24.623 26.258 1.0 54.25 ? 320 VAL B CA 1 142 . B ATOM 2328 C C . VAL B 2 142 ? -11.849 23.157 26.233 1.0 51.06 ? 320 VAL B C 1 142 . B ATOM 2329 O O . VAL B 2 142 ? -12.567 22.348 25.635 1.0 58.73 ? 320 VAL B O 1 142 . B ATOM 2330 C CB . VAL B 2 142 ? -11.707 25.323 24.984 1.0 53.7 ? 320 VAL B CB 1 142 . B ATOM 2331 C CG1 . VAL B 2 142 ? -11.904 24.429 23.776 1.0 57.33 ? 320 VAL B CG1 1 142 . B ATOM 2332 C CG2 . VAL B 2 142 ? -12.427 26.633 24.791 1.0 67.57 ? 320 VAL B CG2 1 142 . B ATOM 2333 N N . ALA B 2 143 ? -10.743 22.792 26.872 1.0 53.54 ? 321 ALA B N 1 143 . B ATOM 2334 C CA . ALA B 2 143 ? -10.225 21.438 26.789 1.0 62.13 ? 321 ALA B CA 1 143 . B ATOM 2335 C C . ALA B 2 143 ? -9.470 21.105 28.067 1.0 60.53 ? 321 ALA B C 1 143 . B ATOM 2336 O O . ALA B 2 143 ? -9.084 21.985 28.841 1.0 57.75 ? 321 ALA B O 1 143 . B ATOM 2337 C CB . ALA B 2 143 ? -9.309 21.263 25.574 1.0 56.64 ? 321 ALA B CB 1 143 . B ATOM 2338 N N . SER B 2 144 ? -9.260 19.809 28.260 1.0 61.74 ? 322 SER B N 1 144 . B ATOM 2339 C CA . SER B 2 144 ? -8.448 19.296 29.344 1.0 55.61 ? 322 SER B CA 1 144 . B ATOM 2340 C C . SER B 2 144 ? -7.090 19.989 29.386 1.0 56.19 ? 322 SER B C 1 144 . B ATOM 2341 O O . SER B 2 144 ? -6.614 20.560 28.396 1.0 60.82 ? 322 SER B O 1 144 . B ATOM 2342 C CB . SER B 2 144 ? -8.273 17.786 29.182 1.0 63.1 ? 322 SER B CB 1 144 . B ATOM 2343 O OG . SER B 2 144 ? -7.289 17.291 30.067 1.0 76.73 ? 322 SER B OG 1 144 . B ATOM 2344 N N . GLU B 2 145 ? -6.456 19.903 30.558 1.0 49.83 ? 323 GLU B N 1 145 . B ATOM 2345 C CA . GLU B 2 145 ? -5.151 20.514 30.792 1.0 49.35 ? 323 GLU B CA 1 145 . B ATOM 2346 C C . GLU B 2 145 ? -4.096 19.997 29.832 1.0 42.3 ? 323 GLU B C 1 145 . B ATOM 2347 O O . GLU B 2 145 ? -3.123 20.698 29.535 1.0 50.06 ? 323 GLU B O 1 145 . B ATOM 2348 C CB . GLU B 2 145 ? -4.684 20.232 32.226 1.0 68.18 ? 323 GLU B CB 1 145 . B ATOM 2349 C CG . GLU B 2 145 ? -5.645 20.641 33.348 1.0 88.1 ? 323 GLU B CG 1 145 . B ATOM 2350 C CD . GLU B 2 145 ? -6.962 19.870 33.350 1.0 102.8 ? 323 GLU B CD 1 145 . B ATOM 2351 O OE1 . GLU B 2 145 ? -6.941 18.620 33.369 1.0 108.38 ? 323 GLU B OE1 1 145 . B ATOM 2352 O OE2 . GLU B 2 145 ? -8.026 20.523 33.330 1.0 111.29 ? 323 GLU B OE2 1 145 . B ATOM 2353 N N . THR B 2 146 ? -4.238 18.762 29.373 1.0 36.2 ? 324 THR B N 1 146 . B ATOM 2354 C CA . THR B 2 146 ? -3.190 18.114 28.605 1.0 41.87 ? 324 THR B CA 1 146 . B ATOM 2355 C C . THR B 2 146 ? -3.414 18.210 27.090 1.0 44.33 ? 324 THR B C 1 146 . B ATOM 2356 O O . THR B 2 146 ? -2.705 17.538 26.334 1.0 47.01 ? 324 THR B O 1 146 . B ATOM 2357 C CB . THR B 2 146 ? -3.070 16.652 29.032 1.0 36.1 ? 324 THR B CB 1 146 . B ATOM 2358 O OG1 . THR B 2 146 ? -4.378 16.087 29.102 1.0 47.3 ? 324 THR B OG1 1 146 . B ATOM 2359 C CG2 . THR B 2 146 ? -2.403 16.536 30.399 1.0 50.83 ? 324 THR B CG2 1 146 . B ATOM 2360 N N . VAL B 2 147 ? -4.380 19.014 26.638 1.0 40.14 ? 325 VAL B N 1 147 . B ATOM 2361 C CA . VAL B 2 147 ? -4.697 19.166 25.218 1.0 39.36 ? 325 VAL B CA 1 147 . B ATOM 2362 C C . VAL B 2 147 ? -4.052 20.451 24.724 1.0 39.22 ? 325 VAL B C 1 147 . B ATOM 2363 O O . VAL B 2 147 ? -4.131 21.490 25.386 1.0 37.41 ? 325 VAL B O 1 147 . B ATOM 2364 C CB . VAL B 2 147 ? -6.215 19.176 24.950 1.0 37.04 ? 325 VAL B CB 1 147 . B ATOM 2365 C CG1 . VAL B 2 147 ? -6.509 19.153 23.407 1.0 27.78 ? 325 VAL B CG1 1 147 . B ATOM 2366 C CG2 . VAL B 2 147 ? -6.894 18.003 25.640 1.0 38.48 ? 325 VAL B CG2 1 147 . B ATOM 2367 N N . GLY B 2 148 ? -3.402 20.379 23.569 1.0 39.45 ? 326 GLY B N 1 148 . B ATOM 2368 C CA . GLY B 2 148 ? -2.750 21.547 23.007 1.0 32.07 ? 326 GLY B CA 1 148 . B ATOM 2369 C C . GLY B 2 148 ? -2.740 21.484 21.484 1.0 33.93 ? 326 GLY B C 1 148 . B ATOM 2370 O O . GLY B 2 148 ? -3.338 20.579 20.901 1.0 38.47 ? 326 GLY B O 1 148 . B ATOM 2371 N N . SER B 2 149 ? -2.070 22.427 20.826 1.0 39.56 ? 327 SER B N 1 149 . B ATOM 2372 C CA . SER B 2 149 ? -1.927 22.367 19.374 1.0 36.42 ? 327 SER B CA 1 149 . B ATOM 2373 C C . SER B 2 149 ? -0.785 23.253 18.909 1.0 40.65 ? 327 SER B C 1 149 . B ATOM 2374 O O . SER B 2 149 ? -0.502 24.272 19.545 1.0 34.68 ? 327 SER B O 1 149 . B ATOM 2375 C CB . SER B 2 149 ? -3.230 22.791 18.678 1.0 45.74 ? 327 SER B CB 1 149 . B ATOM 2376 O OG . SER B 2 149 ? -3.088 22.840 17.249 1.0 48.6 ? 327 SER B OG 1 149 . B ATOM 2377 N N . THR B 2 150 ? -0.111 22.871 17.819 1.0 30.19 ? 328 THR B N 1 150 . B ATOM 2378 C CA . THR B 2 150 ? 0.698 23.848 17.110 1.0 33.26 ? 328 THR B CA 1 150 . B ATOM 2379 C C . THR B 2 150 ? -0.224 24.814 16.387 1.0 27.96 ? 328 THR B C 1 150 . B ATOM 2380 O O . THR B 2 150 ? -1.415 24.566 16.223 1.0 33.21 ? 328 THR B O 1 150 . B ATOM 2381 C CB . THR B 2 150 ? 1.624 23.176 16.099 1.0 42.46 ? 328 THR B CB 1 150 . B ATOM 2382 O OG1 . THR B 2 150 ? 0.852 22.778 14.948 1.0 38.47 ? 328 THR B OG1 1 150 . B ATOM 2383 C CG2 . THR B 2 150 ? 2.289 21.953 16.730 1.0 35.84 ? 328 THR B CG2 1 150 . B ATOM 2384 N N . ALA B 2 151 ? 0.332 25.944 15.970 1.0 32.65 ? 329 ALA B N 1 151 . B ATOM 2385 C CA . ALA B 2 151 ? -0.406 26.848 15.098 1.0 37.54 ? 329 ALA B CA 1 151 . B ATOM 2386 C C . ALA B 2 151 ? 0.576 27.545 14.171 1.0 41.31 ? 329 ALA B C 1 151 . B ATOM 2387 O O . ALA B 2 151 ? 1.461 28.267 14.635 1.0 40.08 ? 329 ALA B O 1 151 . B ATOM 2388 C CB . ALA B 2 151 ? -1.206 27.857 15.919 1.0 35.64 ? 329 ALA B CB 1 151 . B ATOM 2389 N N . VAL B 2 152 ? 0.435 27.320 12.867 1.0 43.24 ? 330 VAL B N 1 152 . B ATOM 2390 C CA . VAL B 2 152 ? 1.204 28.050 11.868 1.0 33.4 ? 330 VAL B CA 1 152 . B ATOM 2391 C C . VAL B 2 152 ? 0.205 28.809 11.007 1.0 37.27 ? 330 VAL B C 1 152 . B ATOM 2392 O O . VAL B 2 152 ? -0.739 28.218 10.465 1.0 40.94 ? 330 VAL B O 1 152 . B ATOM 2393 C CB . VAL B 2 152 ? 2.114 27.121 11.044 1.0 30.32 ? 330 VAL B CB 1 152 . B ATOM 2394 C CG1 . VAL B 2 152 ? 1.317 26.254 10.080 1.0 31.37 ? 330 VAL B CG1 1 152 . B ATOM 2395 C CG2 . VAL B 2 152 ? 3.199 27.906 10.323 1.0 29.1 ? 330 VAL B CG2 1 152 . B ATOM 2396 N N . VAL B 2 153 ? 0.388 30.123 10.918 1.0 33.78 ? 331 VAL B N 1 153 . B ATOM 2397 C CA . VAL B 2 153 ? -0.600 31.015 10.334 1.0 32.36 ? 331 VAL B CA 1 153 . B ATOM 2398 C C . VAL B 2 153 ? 0.088 31.960 9.365 1.0 36.56 ? 331 VAL B C 1 153 . B ATOM 2399 O O . VAL B 2 153 ? 1.171 32.478 9.649 1.0 35.31 ? 331 VAL B O 1 153 . B ATOM 2400 C CB . VAL B 2 153 ? -1.319 31.818 11.422 1.0 41.31 ? 331 VAL B CB 1 153 . B ATOM 2401 C CG1 . VAL B 2 153 ? -2.151 32.882 10.785 1.0 42.73 ? 331 VAL B CG1 1 153 . B ATOM 2402 C CG2 . VAL B 2 153 ? -2.167 30.893 12.292 1.0 34.03 ? 331 VAL B CG2 1 153 . B ATOM 2403 N N . ALA B 2 154 ? -0.557 32.201 8.225 1.0 33.42 ? 332 ALA B N 1 154 . B ATOM 2404 C CA . ALA B 2 154 ? -0.021 33.101 7.215 1.0 36.4 ? 332 ALA B CA 1 154 . B ATOM 2405 C C . ALA B 2 154 ? -1.080 34.105 6.792 1.0 38.79 ? 332 ALA B C 1 154 . B ATOM 2406 O O . ALA B 2 154 ? -2.223 33.736 6.513 1.0 40.03 ? 332 ALA B O 1 154 . B ATOM 2407 C CB . ALA B 2 154 ? 0.470 32.339 5.986 1.0 37.67 ? 332 ALA B CB 1 154 . B ATOM 2408 N N . LEU B 2 155 ? -0.688 35.373 6.748 1.0 44.97 ? 333 LEU B N 1 155 . B ATOM 2409 C CA . LEU B 2 155 ? -1.486 36.434 6.150 1.0 40.12 ? 333 LEU B CA 1 155 . B ATOM 2410 C C . LEU B 2 155 ? -0.831 36.794 4.833 1.0 42.69 ? 333 LEU B C 1 155 . B ATOM 2411 O O . LEU B 2 155 ? 0.339 37.190 4.813 1.0 43.53 ? 333 LEU B O 1 155 . B ATOM 2412 C CB . LEU B 2 155 ? -1.536 37.666 7.054 1.0 49.97 ? 333 LEU B CB 1 155 . B ATOM 2413 C CG . LEU B 2 155 ? -2.765 37.942 7.906 1.0 63.26 ? 333 LEU B CG 1 155 . B ATOM 2414 C CD1 . LEU B 2 155 ? -2.497 39.159 8.780 1.0 61.46 ? 333 LEU B CD1 1 155 . B ATOM 2415 C CD2 . LEU B 2 155 ? -3.973 38.175 7.012 1.0 56.55 ? 333 LEU B CD2 1 155 . B ATOM 2416 N N . VAL B 2 156 ? -1.566 36.652 3.741 1.0 37.04 ? 334 VAL B N 1 156 . B ATOM 2417 C CA . VAL B 2 156 ? -1.042 36.969 2.420 1.0 39.81 ? 334 VAL B CA 1 156 . B ATOM 2418 C C . VAL B 2 156 ? -1.838 38.142 1.865 1.0 43.65 ? 334 VAL B C 1 156 . B ATOM 2419 O O . VAL B 2 156 ? -3.070 38.171 1.973 1.0 44.71 ? 334 VAL B O 1 156 . B ATOM 2420 C CB . VAL B 2 156 ? -1.093 35.751 1.483 1.0 39.94 ? 334 VAL B CB 1 156 . B ATOM 2421 C CG1 . VAL B 2 156 ? -0.404 36.064 0.129 1.0 37.97 ? 334 VAL B CG1 1 156 . B ATOM 2422 C CG2 . VAL B 2 156 ? -0.414 34.567 2.154 1.0 43.35 ? 334 VAL B CG2 1 156 . B ATOM 2423 N N . CYS B 2 157 ? -1.130 39.130 1.334 1.0 50.29 ? 335 CYS B N 1 157 . B ATOM 2424 C CA . CYS B 2 157 ? -1.734 40.215 0.577 1.0 63.77 ? 335 CYS B CA 1 157 . B ATOM 2425 C C . CYS B 2 157 ? -0.783 40.572 -0.552 1.0 61.89 ? 335 CYS B C 1 157 . B ATOM 2426 O O . CYS B 2 157 ? 0.343 40.070 -0.626 1.0 47.25 ? 335 CYS B O 1 157 . B ATOM 2427 C CB . CYS B 2 157 ? -2.041 41.437 1.452 1.0 71.49 ? 335 CYS B CB 1 157 . B ATOM 2428 S SG . CYS B 2 157 ? -0.644 41.982 2.411 1.0 80.47 ? 335 CYS B SG 1 157 . B ATOM 2429 N N . SER B 2 158 ? -1.238 41.453 -1.439 1.0 68.87 ? 336 SER B N 1 158 . B ATOM 2430 C CA . SER B 2 158 ? -0.504 41.662 -2.681 1.0 65.33 ? 336 SER B CA 1 158 . B ATOM 2431 C C . SER B 2 158 ? 0.925 42.132 -2.449 1.0 53.29 ? 336 SER B C 1 158 . B ATOM 2432 O O . SER B 2 158 ? 1.760 41.983 -3.344 1.0 64.83 ? 336 SER B O 1 158 . B ATOM 2433 C CB . SER B 2 158 ? -1.257 42.655 -3.567 1.0 69.96 ? 336 SER B CB 1 158 . B ATOM 2434 O OG . SER B 2 158 ? -1.550 43.841 -2.850 1.0 76.27 ? 336 SER B OG 1 158 . B ATOM 2435 N N . SER B 2 159 ? 1.243 42.651 -1.267 1.0 51.84 ? 337 SER B N 1 159 . B ATOM 2436 C CA . SER B 2 159 ? 2.569 43.191 -1.012 1.0 46.07 ? 337 SER B CA 1 159 . B ATOM 2437 C C . SER B 2 159 ? 3.408 42.370 -0.048 1.0 53.71 ? 337 SER B C 1 159 . B ATOM 2438 O O . SER B 2 159 ? 4.636 42.370 -0.177 1.0 48.63 ? 337 SER B O 1 159 . B ATOM 2439 C CB . SER B 2 159 ? 2.462 44.617 -0.463 1.0 50.19 ? 337 SER B CB 1 159 . B ATOM 2440 O OG . SER B 2 159 ? 1.578 44.667 0.644 1.0 61.04 ? 337 SER B OG 1 159 . B ATOM 2441 N N . HIS B 2 160 ? 2.797 41.686 0.922 1.0 42.0 ? 338 HIS B N 1 160 . B ATOM 2442 C CA . HIS B 2 160 ? 3.568 41.024 1.962 1.0 38.66 ? 338 HIS B CA 1 160 . B ATOM 2443 C C . HIS B 2 160 ? 2.974 39.668 2.295 1.0 37.55 ? 338 HIS B C 1 160 . B ATOM 2444 O O . HIS B 2 160 ? 1.823 39.368 1.975 1.0 43.56 ? 338 HIS B O 1 160 . B ATOM 2445 C CB . HIS B 2 160 ? 3.632 41.876 3.235 1.0 42.67 ? 338 HIS B CB 1 160 . B ATOM 2446 C CG . HIS B 2 160 ? 4.418 43.132 3.067 1.0 60.84 ? 338 HIS B CG 1 160 . B ATOM 2447 N ND1 . HIS B 2 160 ? 3.944 44.215 2.358 1.0 79.59 ? 338 HIS B ND1 1 160 . B ATOM 2448 C CD2 . HIS B 2 160 ? 5.662 43.467 3.482 1.0 67.72 ? 338 HIS B CD2 1 160 . B ATOM 2449 C CE1 . HIS B 2 160 ? 4.857 45.170 2.358 1.0 83.56 ? 338 HIS B CE1 1 160 . B ATOM 2450 N NE2 . HIS B 2 160 ? 5.908 44.743 3.035 1.0 79.23 ? 338 HIS B NE2 1 160 . B ATOM 2451 N N . ILE B 2 161 ? 3.789 38.856 2.965 1.0 42.62 ? 339 ILE B N 1 161 . B ATOM 2452 C CA . ILE B 2 161 ? 3.354 37.644 3.653 1.0 36.84 ? 339 ILE B CA 1 161 . B ATOM 2453 C C . ILE B 2 161 ? 3.825 37.756 5.093 1.0 34.51 ? 339 ILE B C 1 161 . B ATOM 2454 O O . ILE B 2 161 ? 5.012 37.995 5.336 1.0 48.47 ? 339 ILE B O 1 161 . B ATOM 2455 C CB . ILE B 2 161 ? 3.935 36.375 3.012 1.0 32.55 ? 339 ILE B CB 1 161 . B ATOM 2456 C CG1 . ILE B 2 161 ? 3.578 36.296 1.545 1.0 36.37 ? 339 ILE B CG1 1 161 . B ATOM 2457 C CG2 . ILE B 2 161 ? 3.455 35.127 3.735 1.0 32.63 ? 339 ILE B CG2 1 161 . B ATOM 2458 C CD1 . ILE B 2 161 ? 4.352 35.212 0.824 1.0 42.71 ? 339 ILE B CD1 1 161 . B ATOM 2459 N N . VAL B 2 162 ? 2.913 37.590 6.038 1.0 31.03 ? 340 VAL B N 1 162 . B ATOM 2460 C CA . VAL B 2 162 ? 3.247 37.530 7.457 1.0 33.27 ? 340 VAL B CA 1 162 . B ATOM 2461 C C . VAL B 2 162 ? 3.011 36.104 7.916 1.0 32.81 ? 340 VAL B C 1 162 . B ATOM 2462 O O . VAL B 2 162 ? 1.932 35.550 7.685 1.0 38.38 ? 340 VAL B O 1 162 . B ATOM 2463 C CB . VAL B 2 162 ? 2.390 38.506 8.282 1.0 39.71 ? 340 VAL B CB 1 162 . B ATOM 2464 C CG1 . VAL B 2 162 ? 2.861 38.516 9.755 1.0 48.3 ? 340 VAL B CG1 1 162 . B ATOM 2465 C CG2 . VAL B 2 162 ? 2.425 39.895 7.699 1.0 43.07 ? 340 VAL B CG2 1 162 . B ATOM 2466 N N . VAL B 2 163 ? 4.013 35.493 8.543 1.0 31.42 ? 341 VAL B N 1 163 . B ATOM 2467 C CA . VAL B 2 163 ? 3.844 34.158 9.097 1.0 33.46 ? 341 VAL B CA 1 163 . B ATOM 2468 C C . VAL B 2 163 ? 4.025 34.243 10.603 1.0 38.34 ? 341 VAL B C 1 163 . B ATOM 2469 O O . VAL B 2 163 ? 5.003 34.821 11.089 1.0 44.84 ? 341 VAL B O 1 163 . B ATOM 2470 C CB . VAL B 2 163 ? 4.798 33.115 8.484 1.0 32.4 ? 341 VAL B CB 1 163 . B ATOM 2471 C CG1 . VAL B 2 163 ? 4.720 31.797 9.258 1.0 34.13 ? 341 VAL B CG1 1 163 . B ATOM 2472 C CG2 . VAL B 2 163 ? 4.412 32.848 7.051 1.0 34.38 ? 341 VAL B CG2 1 163 . B ATOM 2473 N N . SER B 2 164 ? 3.069 33.692 11.333 1.0 29.86 ? 342 SER B N 1 164 . B ATOM 2474 C CA . SER B 2 164 ? 3.138 33.574 12.778 1.0 31.79 ? 342 SER B CA 1 164 . B ATOM 2475 C C . SER B 2 164 ? 3.104 32.093 13.106 1.0 38.07 ? 342 SER B C 1 164 . B ATOM 2476 O O . SER B 2 164 ? 2.169 31.392 12.709 1.0 40.87 ? 342 SER B O 1 164 . B ATOM 2477 C CB . SER B 2 164 ? 1.981 34.305 13.451 1.0 37.51 ? 342 SER B CB 1 164 . B ATOM 2478 O OG . SER B 2 164 ? 2.013 34.107 14.843 1.0 40.37 ? 342 SER B OG 1 164 . B ATOM 2479 N N . ASN B 2 165 ? 4.124 31.619 13.810 1.0 34.31 ? 343 ASN B N 1 165 . B ATOM 2480 C CA . ASN B 2 165 ? 4.321 30.200 14.014 1.0 38.49 ? 343 ASN B CA 1 165 . B ATOM 2481 C C . ASN B 2 165 ? 4.441 29.883 15.494 1.0 35.4 ? 343 ASN B C 1 165 . B ATOM 2482 O O . ASN B 2 165 ? 5.138 30.577 16.241 1.0 38.9 ? 343 ASN B O 1 165 . B ATOM 2483 C CB . ASN B 2 165 ? 5.570 29.687 13.287 1.0 32.0 ? 343 ASN B CB 1 165 . B ATOM 2484 C CG . ASN B 2 165 ? 5.810 28.222 13.532 1.0 43.49 ? 343 ASN B CG 1 165 . B ATOM 2485 O OD1 . ASN B 2 165 ? 5.001 27.395 13.135 1.0 41.98 ? 343 ASN B OD1 1 165 . B ATOM 2486 N ND2 . ASN B 2 165 ? 6.905 27.890 14.221 1.0 52.06 ? 343 ASN B ND2 1 165 . B ATOM 2487 N N . CYS B 2 166 ? 3.773 28.812 15.894 1.0 40.76 ? 344 CYS B N 1 166 . B ATOM 2488 C CA . CYS B 2 166 ? 3.880 28.314 17.261 1.0 38.31 ? 344 CYS B CA 1 166 . B ATOM 2489 C C . CYS B 2 166 ? 3.875 26.792 17.211 1.0 37.72 ? 344 CYS B C 1 166 . B ATOM 2490 O O . CYS B 2 166 ? 2.820 26.181 17.022 1.0 41.5 ? 344 CYS B O 1 166 . B ATOM 2491 C CB . CYS B 2 166 ? 2.739 28.842 18.109 1.0 59.71 ? 344 CYS B CB 1 166 . B ATOM 2492 S SG . CYS B 2 166 ? 2.997 28.576 19.858 1.0 56.91 ? 344 CYS B SG 1 166 . B ATOM 2493 N N . GLY B 2 167 ? 5.051 26.178 17.369 1.0 39.79 ? 345 GLY B N 1 167 . B ATOM 2494 C CA . GLY B 2 167 ? 5.177 24.733 17.385 1.0 34.18 ? 345 GLY B CA 1 167 . B ATOM 2495 C C . GLY B 2 167 ? 6.061 24.225 16.258 1.0 40.15 ? 345 GLY B C 1 167 . B ATOM 2496 O O . GLY B 2 167 ? 6.956 24.941 15.769 1.0 47.54 ? 345 GLY B O 1 167 . B ATOM 2497 N N . ASP B 2 168 ? 5.831 22.980 15.853 1.0 44.8 ? 346 ASP B N 1 168 . B ATOM 2498 C CA . ASP B 2 168 ? 6.654 22.330 14.838 1.0 41.6 ? 346 ASP B CA 1 168 . B ATOM 2499 C C . ASP B 2 168 ? 5.857 22.045 13.568 1.0 31.64 ? 346 ASP B C 1 168 . B ATOM 2500 O O . ASP B 2 168 ? 6.229 21.169 12.775 1.0 31.35 ? 346 ASP B O 1 168 . B ATOM 2501 C CB . ASP B 2 168 ? 7.276 21.047 15.389 1.0 37.81 ? 346 ASP B CB 1 168 . B ATOM 2502 C CG . ASP B 2 168 ? 6.237 20.007 15.734 1.0 52.16 ? 346 ASP B CG 1 168 . B ATOM 2503 O OD1 . ASP B 2 168 ? 5.037 20.320 15.647 1.0 52.05 ? 346 ASP B OD1 1 168 . B ATOM 2504 O OD2 . ASP B 2 168 ? 6.620 18.879 16.097 1.0 66.23 ? 346 ASP B OD2 1 168 . B ATOM 2505 N N . SER B 2 169 ? 4.726 22.728 13.383 1.0 33.91 ? 347 SER B N 1 169 . B ATOM 2506 C CA . SER B 2 169 ? 4.244 22.898 12.013 1.0 36.77 ? 347 SER B CA 1 169 . B ATOM 2507 C C . SER B 2 169 ? 5.092 23.972 11.321 1.0 42.16 ? 347 SER B C 1 169 . B ATOM 2508 O O . SER B 2 169 ? 5.912 24.640 11.963 1.0 40.4 ? 347 SER B O 1 169 . B ATOM 2509 C CB . SER B 2 169 ? 2.763 23.256 12.001 1.0 32.27 ? 347 SER B CB 1 169 . B ATOM 2510 O OG . SER B 2 169 ? 1.975 22.175 12.494 1.0 33.05 ? 347 SER B OG 1 169 . B ATOM 2511 N N . ARG B 2 170 ? 4.912 24.143 9.997 1.0 32.31 ? 348 ARG B N 1 170 . B ATOM 2512 C CA . ARG B 2 170 ? 5.887 24.955 9.276 1.0 33.95 ? 348 ARG B CA 1 170 . B ATOM 2513 C C . ARG B 2 170 ? 5.311 25.539 7.983 1.0 39.44 ? 348 ARG B C 1 170 . B ATOM 2514 O O . ARG B 2 170 ? 4.476 24.919 7.322 1.0 33.01 ? 348 ARG B O 1 170 . B ATOM 2515 C CB . ARG B 2 170 ? 7.142 24.124 8.970 1.0 35.7 ? 348 ARG B CB 1 170 . B ATOM 2516 C CG . ARG B 2 170 ? 8.326 24.875 8.403 1.0 38.17 ? 348 ARG B CG 1 170 . B ATOM 2517 C CD . ARG B 2 170 ? 9.328 23.860 7.825 1.0 49.3 ? 348 ARG B CD 1 170 . B ATOM 2518 N NE . ARG B 2 170 ? 9.775 22.913 8.860 1.0 44.26 ? 348 ARG B NE 1 170 . B ATOM 2519 C CZ . ARG B 2 170 ? 10.443 21.785 8.620 1.0 52.39 ? 348 ARG B CZ 1 170 . B ATOM 2520 N NH1 . ARG B 2 170 ? 10.743 21.435 7.364 1.0 44.39 ? 348 ARG B NH1 1 170 . B ATOM 2521 N NH2 . ARG B 2 170 ? 10.805 21.001 9.643 1.0 40.19 ? 348 ARG B NH2 1 170 . B ATOM 2522 N N . ALA B 2 171 ? 5.762 26.744 7.653 1.0 34.57 ? 349 ALA B N 1 171 . B ATOM 2523 C CA . ALA B 2 171 ? 5.431 27.407 6.394 1.0 38.31 ? 349 ALA B CA 1 171 . B ATOM 2524 C C . ALA B 2 171 ? 6.704 27.566 5.588 1.0 37.18 ? 349 ALA B C 1 171 . B ATOM 2525 O O . ALA B 2 171 ? 7.736 27.972 6.127 1.0 40.22 ? 349 ALA B O 1 171 . B ATOM 2526 C CB . ALA B 2 171 ? 4.797 28.776 6.639 1.0 29.23 ? 349 ALA B CB 1 171 . B ATOM 2527 N N . VAL B 2 172 ? 6.644 27.243 4.299 1.0 34.75 ? 350 VAL B N 1 172 . B ATOM 2528 C CA . VAL B 2 172 ? 7.798 27.376 3.429 1.0 24.29 ? 350 VAL B CA 1 172 . B ATOM 2529 C C . VAL B 2 172 ? 7.378 28.158 2.194 1.0 31.96 ? 350 VAL B C 1 172 . B ATOM 2530 O O . VAL B 2 172 ? 6.345 27.857 1.571 1.0 31.46 ? 350 VAL B O 1 172 . B ATOM 2531 C CB . VAL B 2 172 ? 8.379 26.010 3.042 1.0 31.73 ? 350 VAL B CB 1 172 . B ATOM 2532 C CG1 . VAL B 2 172 ? 9.491 26.182 1.993 1.0 26.94 ? 350 VAL B CG1 1 172 . B ATOM 2533 C CG2 . VAL B 2 172 ? 8.921 25.295 4.284 1.0 27.07 ? 350 VAL B CG2 1 172 . B ATOM 2534 N N . LEU B 2 173 ? 8.183 29.147 1.846 1.0 32.27 ? 351 LEU B N 1 173 . B ATOM 2535 C CA . LEU B 2 173 ? 7.987 29.949 0.648 1.0 29.29 ? 351 LEU B CA 1 173 . B ATOM 2536 C C . LEU B 2 173 ? 8.987 29.494 -0.398 1.0 32.15 ? 351 LEU B C 1 173 . B ATOM 2537 O O . LEU B 2 173 ? 10.177 29.355 -0.096 1.0 30.03 ? 351 LEU B O 1 173 . B ATOM 2538 C CB . LEU B 2 173 ? 8.189 31.435 0.966 1.0 33.52 ? 351 LEU B CB 1 173 . B ATOM 2539 C CG . LEU B 2 173 ? 8.180 32.408 -0.219 1.0 38.21 ? 351 LEU B CG 1 173 . B ATOM 2540 C CD1 . LEU B 2 173 ? 6.740 32.655 -0.675 1.0 31.12 ? 351 LEU B CD1 1 173 . B ATOM 2541 C CD2 . LEU B 2 173 ? 8.901 33.706 0.115 1.0 34.87 ? 351 LEU B CD2 1 173 . B ATOM 2542 N N . PHE B 2 174 ? 8.508 29.260 -1.624 1.0 32.51 ? 352 PHE B N 1 174 . B ATOM 2543 C CA . PHE B 2 174 ? 9.369 28.952 -2.758 1.0 32.0 ? 352 PHE B CA 1 174 . B ATOM 2544 C C . PHE B 2 174 ? 9.545 30.236 -3.571 1.0 34.88 ? 352 PHE B C 1 174 . B ATOM 2545 O O . PHE B 2 174 ? 8.563 30.816 -4.044 1.0 35.61 ? 352 PHE B O 1 174 . B ATOM 2546 C CB . PHE B 2 174 ? 8.764 27.822 -3.596 1.0 37.0 ? 352 PHE B CB 1 174 . B ATOM 2547 C CG . PHE B 2 174 ? 9.742 27.141 -4.514 1.0 35.87 ? 352 PHE B CG 1 174 . B ATOM 2548 C CD1 . PHE B 2 174 ? 11.019 26.824 -4.081 1.0 35.17 ? 352 PHE B CD1 1 174 . B ATOM 2549 C CD2 . PHE B 2 174 ? 9.361 26.771 -5.798 1.0 39.07 ? 352 PHE B CD2 1 174 . B ATOM 2550 C CE1 . PHE B 2 174 ? 11.916 26.185 -4.929 1.0 40.92 ? 352 PHE B CE1 1 174 . B ATOM 2551 C CE2 . PHE B 2 174 ? 10.244 26.125 -6.641 1.0 33.08 ? 352 PHE B CE2 1 174 . B ATOM 2552 C CZ . PHE B 2 174 ? 11.522 25.838 -6.205 1.0 33.81 ? 352 PHE B CZ 1 174 . B ATOM 2553 N N . ARG B 2 175 ? 10.784 30.702 -3.688 1.0 42.81 ? 353 ARG B N 1 175 . B ATOM 2554 C CA . ARG B 2 175 ? 11.088 31.950 -4.384 1.0 46.39 ? 353 ARG B CA 1 175 . B ATOM 2555 C C . ARG B 2 175 ? 12.204 31.692 -5.375 1.0 31.32 ? 353 ARG B C 1 175 . B ATOM 2556 O O . ARG B 2 175 ? 13.301 31.292 -4.981 1.0 41.03 ? 353 ARG B O 1 175 . B ATOM 2557 C CB . ARG B 2 175 ? 11.500 33.044 -3.400 1.0 39.28 ? 353 ARG B CB 1 175 . B ATOM 2558 C CG . ARG B 2 175 ? 12.170 34.255 -4.039 1.0 56.89 ? 353 ARG B CG 1 175 . B ATOM 2559 C CD . ARG B 2 175 ? 12.385 35.367 -3.003 1.0 47.94 ? 353 ARG B CD 1 175 . B ATOM 2560 N NE . ARG B 2 175 ? 11.124 35.987 -2.604 1.0 54.8 ? 353 ARG B NE 1 175 . B ATOM 2561 C CZ . ARG B 2 175 ? 10.980 36.795 -1.554 1.0 60.72 ? 353 ARG B CZ 1 175 . B ATOM 2562 N NH1 . ARG B 2 175 ? 12.028 37.075 -0.790 1.0 61.47 ? 353 ARG B NH1 1 175 . B ATOM 2563 N NH2 . ARG B 2 175 ? 9.790 37.310 -1.265 1.0 57.27 ? 353 ARG B NH2 1 175 . B ATOM 2564 N N . GLY B 2 176 ? 11.939 31.946 -6.641 1.0 36.99 ? 354 GLY B N 1 176 . B ATOM 2565 C CA . GLY B 2 176 ? 12.907 31.581 -7.662 1.0 39.57 ? 354 GLY B CA 1 176 . B ATOM 2566 C C . GLY B 2 176 ? 13.098 30.081 -7.642 1.0 34.95 ? 354 GLY B C 1 176 . B ATOM 2567 O O . GLY B 2 176 ? 12.157 29.314 -7.839 1.0 48.26 ? 354 GLY B O 1 176 . B ATOM 2568 N N . LYS B 2 177 ? 14.327 29.645 -7.384 1.0 31.9 ? 355 LYS B N 1 177 . B ATOM 2569 C CA . LYS B 2 177 ? 14.639 28.228 -7.239 1.0 34.28 ? 355 LYS B CA 1 177 . B ATOM 2570 C C . LYS B 2 177 ? 14.997 27.854 -5.798 1.0 42.65 ? 355 LYS B C 1 177 . B ATOM 2571 O O . LYS B 2 177 ? 15.561 26.782 -5.564 1.0 46.21 ? 355 LYS B O 1 177 . B ATOM 2572 C CB . LYS B 2 177 ? 15.781 27.823 -8.179 1.0 37.18 ? 355 LYS B CB 1 177 . B ATOM 2573 C CG . LYS B 2 177 ? 15.486 27.997 -9.691 1.0 37.93 ? 355 LYS B CG 1 177 . B ATOM 2574 C CD . LYS B 2 177 ? 14.286 27.167 -10.127 1.0 50.63 ? 355 LYS B CD 1 177 . B ATOM 2575 C CE . LYS B 2 177 ? 14.216 27.037 -11.659 1.0 56.12 ? 355 LYS B CE 1 177 . B ATOM 2576 N NZ . LYS B 2 177 ? 12.950 26.397 -12.111 1.0 55.25 ? 355 LYS B NZ 1 177 . B ATOM 2577 N N . GLU B 2 178 ? 14.713 28.713 -4.824 1.0 38.59 ? 356 GLU B N 1 178 . B ATOM 2578 C CA . GLU B 2 178 ? 15.149 28.476 -3.450 1.0 41.11 ? 356 GLU B CA 1 178 . B ATOM 2579 C C . GLU B 2 178 ? 13.943 28.298 -2.535 1.0 33.53 ? 356 GLU B C 1 178 . B ATOM 2580 O O . GLU B 2 178 ? 13.054 29.154 -2.489 1.0 35.67 ? 356 GLU B O 1 178 . B ATOM 2581 C CB . GLU B 2 178 ? 16.038 29.629 -2.968 1.0 60.98 ? 356 GLU B CB 1 178 . B ATOM 2582 C CG . GLU B 2 178 ? 16.478 29.529 -1.506 1.0 61.89 ? 356 GLU B CG 1 178 . B ATOM 2583 C CD . GLU B 2 178 ? 17.589 30.513 -1.148 1.0 74.77 ? 356 GLU B CD 1 178 . B ATOM 2584 O OE1 . GLU B 2 178 ? 18.307 30.979 -2.065 1.0 82.26 ? 356 GLU B OE1 1 178 . B ATOM 2585 O OE2 . GLU B 2 178 ? 17.744 30.824 0.054 1.0 80.85 ? 356 GLU B OE2 1 178 . B ATOM 2586 N N . ALA B 2 179 ? 13.908 27.186 -1.812 1.0 41.98 ? 357 ALA B N 1 179 . B ATOM 2587 C CA . ALA B 2 179 ? 12.957 27.046 -0.721 1.0 38.12 ? 357 ALA B CA 1 179 . B ATOM 2588 C C . ALA B 2 179 ? 13.411 27.915 0.439 1.0 39.8 ? 357 ALA B C 1 179 . B ATOM 2589 O O . ALA B 2 179 ? 14.585 27.890 0.810 1.0 41.53 ? 357 ALA B O 1 179 . B ATOM 2590 C CB . ALA B 2 179 ? 12.855 25.586 -0.280 1.0 40.06 ? 357 ALA B CB 1 179 . B ATOM 2591 N N . MET B 2 180 ? 12.491 28.696 0.994 1.0 36.56 ? 358 MET B N 1 180 . B ATOM 2592 C CA . MET B 2 180 ? 12.801 29.582 2.119 1.0 38.23 ? 358 MET B CA 1 180 . B ATOM 2593 C C . MET B 2 180 ? 11.848 29.306 3.266 1.0 34.99 ? 358 MET B C 1 180 . B ATOM 2594 O O . MET B 2 180 ? 10.677 29.726 3.202 1.0 42.63 ? 358 MET B O 1 180 . B ATOM 2595 C CB . MET B 2 180 ? 12.690 31.050 1.710 1.0 37.24 ? 358 MET B CB 1 180 . B ATOM 2596 C CG . MET B 2 180 ? 13.768 31.530 0.770 1.0 56.34 ? 358 MET B CG 1 180 . B ATOM 2597 S SD . MET B 2 180 ? 13.460 33.240 0.282 1.0 74.53 ? 358 MET B SD 1 180 . B ATOM 2598 C CE . MET B 2 180 ? 13.310 34.072 1.871 1.0 60.99 ? 358 MET B CE 1 180 . B ATOM 2599 N N . PRO B 2 181 ? 12.270 28.626 4.328 1.0 39.67 ? 359 PRO B N 1 181 . B ATOM 2600 C CA . PRO B 2 181 ? 11.369 28.457 5.476 1.0 37.06 ? 359 PRO B CA 1 181 . B ATOM 2601 C C . PRO B 2 181 ? 11.029 29.817 6.064 1.0 35.44 ? 359 PRO B C 1 181 . B ATOM 2602 O O . PRO B 2 181 ? 11.907 30.651 6.279 1.0 43.9 ? 359 PRO B O 1 181 . B ATOM 2603 C CB . PRO B 2 181 ? 12.176 27.592 6.455 1.0 47.49 ? 359 PRO B CB 1 181 . B ATOM 2604 C CG . PRO B 2 181 ? 13.601 27.706 5.998 1.0 54.56 ? 359 PRO B CG 1 181 . B ATOM 2605 C CD . PRO B 2 181 ? 13.581 27.985 4.526 1.0 44.9 ? 359 PRO B CD 1 181 . B ATOM 2606 N N . LEU B 2 182 ? 9.738 30.058 6.279 1.0 34.23 ? 360 LEU B N 1 182 . B ATOM 2607 C CA . LEU B 2 182 ? 9.283 31.277 6.927 1.0 36.32 ? 360 LEU B CA 1 182 . B ATOM 2608 C C . LEU B 2 182 ? 9.055 31.079 8.419 1.0 48.22 ? 360 LEU B C 1 182 . B ATOM 2609 O O . LEU B 2 182 ? 8.671 32.028 9.111 1.0 41.49 ? 360 LEU B O 1 182 . B ATOM 2610 C CB . LEU B 2 182 ? 8.013 31.796 6.252 1.0 35.73 ? 360 LEU B CB 1 182 . B ATOM 2611 C CG . LEU B 2 182 ? 8.243 32.180 4.784 1.0 35.3 ? 360 LEU B CG 1 182 . B ATOM 2612 C CD1 . LEU B 2 182 ? 7.062 32.963 4.250 1.0 35.91 ? 360 LEU B CD1 1 182 . B ATOM 2613 C CD2 . LEU B 2 182 ? 9.515 32.984 4.640 1.0 35.6 ? 360 LEU B CD2 1 182 . B ATOM 2614 N N . SER B 2 183 ? 9.283 29.866 8.925 1.0 47.29 ? 361 SER B N 1 183 . B ATOM 2615 C CA . SER B 2 183 ? 9.182 29.591 10.352 1.0 44.07 ? 361 SER B CA 1 183 . B ATOM 2616 C C . SER B 2 183 ? 10.282 28.613 10.739 1.0 47.49 ? 361 SER B C 1 183 . B ATOM 2617 O O . SER B 2 183 ? 10.748 27.838 9.895 1.0 47.78 ? 361 SER B O 1 183 . B ATOM 2618 C CB . SER B 2 183 ? 7.809 29.016 10.698 1.0 43.27 ? 361 SER B CB 1 183 . B ATOM 2619 O OG . SER B 2 183 ? 7.628 27.773 10.033 1.0 39.1 ? 361 SER B OG 1 183 . B ATOM 2620 N N . VAL B 2 184 ? 10.685 28.648 12.012 1.0 38.66 ? 362 VAL B N 1 184 . B ATOM 2621 C CA . VAL B 2 184 ? 11.644 27.703 12.587 1.0 33.58 ? 362 VAL B CA 1 184 . B ATOM 2622 C C . VAL B 2 184 ? 10.904 26.833 13.598 1.0 48.14 ? 362 VAL B C 1 184 . B ATOM 2623 O O . VAL B 2 184 ? 10.249 27.360 14.505 1.0 48.41 ? 362 VAL B O 1 184 . B ATOM 2624 C CB . VAL B 2 184 ? 12.822 28.421 13.275 1.0 42.64 ? 362 VAL B CB 1 184 . B ATOM 2625 C CG1 . VAL B 2 184 ? 13.956 27.444 13.525 1.0 42.41 ? 362 VAL B CG1 1 184 . B ATOM 2626 C CG2 . VAL B 2 184 ? 13.304 29.603 12.462 1.0 46.88 ? 362 VAL B CG2 1 184 . B ATOM 2627 N N . ASP B 2 185 ? 11.020 25.507 13.454 1.0 40.76 ? 363 ASP B N 1 185 . B ATOM 2628 C CA . ASP B 2 185 ? 10.325 24.587 14.344 1.0 34.88 ? 363 ASP B CA 1 185 . B ATOM 2629 C C . ASP B 2 185 ? 10.697 24.852 15.809 1.0 36.45 ? 363 ASP B C 1 185 . B ATOM 2630 O O . ASP B 2 185 ? 11.868 25.022 16.152 1.0 33.41 ? 363 ASP B O 1 185 . B ATOM 2631 C CB . ASP B 2 185 ? 10.669 23.139 13.986 1.0 49.22 ? 363 ASP B CB 1 185 . B ATOM 2632 C CG . ASP B 2 185 ? 10.176 22.723 12.595 1.0 49.76 ? 363 ASP B CG 1 185 . B ATOM 2633 O OD1 . ASP B 2 185 ? 9.702 23.589 11.823 1.0 49.83 ? 363 ASP B OD1 1 185 . B ATOM 2634 O OD2 . ASP B 2 185 ? 10.271 21.514 12.277 1.0 50.32 ? 363 ASP B OD2 1 185 . B ATOM 2635 N N . HIS B 2 186 ? 9.689 24.848 16.681 1.0 45.82 ? 364 HIS B N 1 186 . B ATOM 2636 C CA . HIS B 2 186 ? 9.905 24.984 18.128 1.0 39.62 ? 364 HIS B CA 1 186 . B ATOM 2637 C C . HIS B 2 186 ? 10.080 23.600 18.754 1.0 41.55 ? 364 HIS B C 1 186 . B ATOM 2638 O O . HIS B 2 186 ? 9.153 22.997 19.299 1.0 41.56 ? 364 HIS B O 1 186 . B ATOM 2639 C CB . HIS B 2 186 ? 8.755 25.750 18.751 1.0 32.63 ? 364 HIS B CB 1 186 . B ATOM 2640 C CG . HIS B 2 186 ? 8.726 27.193 18.358 1.0 39.07 ? 364 HIS B CG 1 186 . B ATOM 2641 N ND1 . HIS B 2 186 ? 7.608 27.800 17.829 1.0 40.31 ? 364 HIS B ND1 1 186 . B ATOM 2642 C CD2 . HIS B 2 186 ? 9.685 28.148 18.409 1.0 43.68 ? 364 HIS B CD2 1 186 . B ATOM 2643 C CE1 . HIS B 2 186 ? 7.875 29.072 17.586 1.0 42.13 ? 364 HIS B CE1 1 186 . B ATOM 2644 N NE2 . HIS B 2 186 ? 9.130 29.307 17.924 1.0 39.55 ? 364 HIS B NE2 1 186 . B ATOM 2645 N N . LYS B 2 187 ? 11.316 23.090 18.679 1.0 34.98 ? 365 LYS B N 1 187 . B ATOM 2646 C CA . LYS B 2 187 ? 11.735 21.813 19.243 1.0 36.38 ? 365 LYS B CA 1 187 . B ATOM 2647 C C . LYS B 2 187 ? 12.526 22.010 20.537 1.0 47.62 ? 365 LYS B C 1 187 . B ATOM 2648 O O . LYS B 2 187 ? 13.355 22.929 20.630 1.0 36.11 ? 365 LYS B O 1 187 . B ATOM 2649 C CB . LYS B 2 187 ? 12.592 21.047 18.235 1.0 49.03 ? 365 LYS B CB 1 187 . B ATOM 2650 C CG . LYS B 2 187 ? 11.783 20.487 17.054 1.0 50.39 ? 365 LYS B CG 1 187 . B ATOM 2651 C CD . LYS B 2 187 ? 10.566 19.742 17.571 1.0 56.67 ? 365 LYS B CD 1 187 . B ATOM 2652 C CE . LYS B 2 187 ? 10.208 18.550 16.717 1.0 57.14 ? 365 LYS B CE 1 187 . B ATOM 2653 N NZ . LYS B 2 187 ? 8.983 17.887 17.244 1.0 57.8 ? 365 LYS B NZ 1 187 . B ATOM 2654 N N . PRO B 2 188 ? 12.330 21.163 21.552 1.0 42.94 ? 366 PRO B N 1 188 . B ATOM 2655 C CA . PRO B 2 188 ? 12.993 21.419 22.844 1.0 52.07 ? 366 PRO B CA 1 188 . B ATOM 2656 C C . PRO B 2 188 ? 14.508 21.379 22.772 1.0 56.9 ? 366 PRO B C 1 188 . B ATOM 2657 O O . PRO B 2 188 ? 15.153 21.988 23.632 1.0 45.73 ? 366 PRO B O 1 188 . B ATOM 2658 C CB . PRO B 2 188 ? 12.443 20.311 23.757 1.0 49.41 ? 366 PRO B CB 1 188 . B ATOM 2659 C CG . PRO B 2 188 ? 11.180 19.864 23.111 1.0 41.97 ? 366 PRO B CG 1 188 . B ATOM 2660 C CD . PRO B 2 188 ? 11.451 19.988 21.615 1.0 40.61 ? 366 PRO B CD 1 188 . B ATOM 2661 N N . ASP B 2 189 ? 15.103 20.710 21.775 1.0 48.4 ? 367 ASP B N 1 189 . B ATOM 2662 C CA . ASP B 2 189 ? 16.557 20.650 21.668 1.0 44.5 ? 367 ASP B CA 1 189 . B ATOM 2663 C C . ASP B 2 189 ? 17.144 21.754 20.792 1.0 54.09 ? 367 ASP B C 1 189 . B ATOM 2664 O O . ASP B 2 189 ? 18.362 21.786 20.586 1.0 53.44 ? 367 ASP B O 1 189 . B ATOM 2665 C CB . ASP B 2 189 ? 17.000 19.286 21.145 1.0 45.77 ? 367 ASP B CB 1 189 . B ATOM 2666 C CG . ASP B 2 189 ? 16.306 18.903 19.852 1.0 60.17 ? 367 ASP B CG 1 189 . B ATOM 2667 O OD1 . ASP B 2 189 ? 15.235 19.474 19.560 1.0 59.5 ? 367 ASP B OD1 1 189 . B ATOM 2668 O OD2 . ASP B 2 189 ? 16.818 18.017 19.139 1.0 70.57 ? 367 ASP B OD2 1 189 . B ATOM 2669 N N . ARG B 2 190 ? 16.321 22.653 20.270 1.0 49.12 ? 368 ARG B N 1 190 . B ATOM 2670 C CA . ARG B 2 190 ? 16.855 23.826 19.588 1.0 54.72 ? 368 ARG B CA 1 190 . B ATOM 2671 C C . ARG B 2 190 ? 17.621 24.688 20.590 1.0 54.93 ? 368 ARG B C 1 190 . B ATOM 2672 O O . ARG B 2 190 ? 17.083 25.051 21.640 1.0 69.91 ? 368 ARG B O 1 190 . B ATOM 2673 C CB . ARG B 2 190 ? 15.722 24.621 18.953 1.0 43.43 ? 368 ARG B CB 1 190 . B ATOM 2674 C CG . ARG B 2 190 ? 16.170 25.596 17.875 1.0 49.62 ? 368 ARG B CG 1 190 . B ATOM 2675 C CD . ARG B 2 190 ? 14.968 26.252 17.251 1.0 44.65 ? 368 ARG B CD 1 190 . B ATOM 2676 N NE . ARG B 2 190 ? 14.667 27.538 17.871 1.0 49.39 ? 368 ARG B NE 1 190 . B ATOM 2677 C CZ . ARG B 2 190 ? 13.587 28.257 17.588 1.0 54.29 ? 368 ARG B CZ 1 190 . B ATOM 2678 N NH1 . ARG B 2 190 ? 12.711 27.801 16.706 1.0 53.18 ? 368 ARG B NH1 1 190 . B ATOM 2679 N NH2 . ARG B 2 190 ? 13.373 29.421 18.193 1.0 56.69 ? 368 ARG B NH2 1 190 . B ATOM 2680 N N . GLU B 2 191 ? 18.876 25.014 20.261 1.0 54.76 ? 369 GLU B N 1 191 . B ATOM 2681 C CA . GLU B 2 191 ? 19.788 25.678 21.193 1.0 64.99 ? 369 GLU B CA 1 191 . B ATOM 2682 C C . GLU B 2 191 ? 19.112 26.743 22.054 1.0 58.45 ? 369 GLU B C 1 191 . B ATOM 2683 O O . GLU B 2 191 ? 19.210 26.725 23.287 1.0 61.64 ? 369 GLU B O 1 191 . B ATOM 2684 C CB . GLU B 2 191 ? 20.957 26.306 20.420 1.0 74.76 ? 369 GLU B CB 1 191 . B ATOM 2685 C CG . GLU B 2 191 ? 21.923 27.109 21.312 1.0 90.41 ? 369 GLU B CG 1 191 . B ATOM 2686 C CD . GLU B 2 191 ? 22.132 28.556 20.845 1.0 96.11 ? 369 GLU B CD 1 191 . B ATOM 2687 O OE1 . GLU B 2 191 ? 22.703 29.364 21.614 1.0 93.72 ? 369 GLU B OE1 1 191 . B ATOM 2688 O OE2 . GLU B 2 191 ? 21.729 28.889 19.709 1.0 99.31 ? 369 GLU B OE2 1 191 . B ATOM 2689 N N . ASP B 2 192 ? 18.445 27.702 21.414 1.0 52.92 ? 370 ASP B N 1 192 . B ATOM 2690 C CA . ASP B 2 192 ? 17.879 28.817 22.164 1.0 51.27 ? 370 ASP B CA 1 192 . B ATOM 2691 C C . ASP B 2 192 ? 16.674 28.379 22.979 1.0 49.92 ? 370 ASP B C 1 192 . B ATOM 2692 O O . ASP B 2 192 ? 16.447 28.886 24.081 1.0 50.29 ? 370 ASP B O 1 192 . B ATOM 2693 C CB . ASP B 2 192 ? 17.496 29.944 21.213 1.0 63.9 ? 370 ASP B CB 1 192 . B ATOM 2694 C CG . ASP B 2 192 ? 16.548 29.487 20.125 1.0 68.83 ? 370 ASP B CG 1 192 . B ATOM 2695 O OD1 . ASP B 2 192 ? 16.424 28.261 19.922 1.0 74.66 ? 370 ASP B OD1 1 192 . B ATOM 2696 O OD2 . ASP B 2 192 ? 15.934 30.353 19.469 1.0 68.6 ? 370 ASP B OD2 1 192 . B ATOM 2697 N N . GLU B 2 193 ? 15.874 27.456 22.447 1.0 51.72 ? 371 GLU B N 1 193 . B ATOM 2698 C CA . GLU B 2 193 ? 14.718 26.992 23.202 1.0 56.51 ? 371 GLU B CA 1 193 . B ATOM 2699 C C . GLU B 2 193 ? 15.155 26.197 24.421 1.0 56.6 ? 371 GLU B C 1 193 . B ATOM 2700 O O . GLU B 2 193 ? 14.570 26.338 25.504 1.0 44.7 ? 371 GLU B O 1 193 . B ATOM 2701 C CB . GLU B 2 193 ? 13.797 26.158 22.314 1.0 52.59 ? 371 GLU B CB 1 193 . B ATOM 2702 C CG . GLU B 2 193 ? 12.958 27.000 21.360 1.0 53.83 ? 371 GLU B CG 1 193 . B ATOM 2703 C CD . GLU B 2 193 ? 12.017 27.934 22.104 1.0 54.97 ? 371 GLU B CD 1 193 . B ATOM 2704 O OE1 . GLU B 2 193 ? 10.827 27.589 22.262 1.0 49.44 ? 371 GLU B OE1 1 193 . B ATOM 2705 O OE2 . GLU B 2 193 ? 12.474 29.006 22.547 1.0 53.42 ? 371 GLU B OE2 1 193 . B ATOM 2706 N N . TYR B 2 194 ? 16.187 25.365 24.261 1.0 47.18 ? 372 TYR B N 1 194 . B ATOM 2707 C CA . TYR B 2 194 ? 16.699 24.592 25.381 1.0 58.21 ? 372 TYR B CA 1 194 . B ATOM 2708 C C . TYR B 2 194 ? 17.105 25.508 26.525 1.0 54.33 ? 372 TYR B C 1 194 . B ATOM 2709 O O . TYR B 2 194 ? 16.727 25.281 27.677 1.0 54.93 ? 372 TYR B O 1 194 . B ATOM 2710 C CB . TYR B 2 194 ? 17.877 23.739 24.924 1.0 55.27 ? 372 TYR B CB 1 194 . B ATOM 2711 C CG . TYR B 2 194 ? 18.410 22.788 25.968 1.0 48.58 ? 372 TYR B CG 1 194 . B ATOM 2712 C CD1 . TYR B 2 194 ? 19.244 23.232 26.983 1.0 60.63 ? 372 TYR B CD1 1 194 . B ATOM 2713 C CD2 . TYR B 2 194 ? 18.102 21.445 25.919 1.0 42.55 ? 372 TYR B CD2 1 194 . B ATOM 2714 C CE1 . TYR B 2 194 ? 19.742 22.355 27.928 1.0 61.92 ? 372 TYR B CE1 1 194 . B ATOM 2715 C CE2 . TYR B 2 194 ? 18.594 20.569 26.838 1.0 49.05 ? 372 TYR B CE2 1 194 . B ATOM 2716 C CZ . TYR B 2 194 ? 19.412 21.019 27.846 1.0 65.23 ? 372 TYR B CZ 1 194 . B ATOM 2717 O OH . TYR B 2 194 ? 19.895 20.117 28.772 1.0 70.23 ? 372 TYR B OH 1 194 . B ATOM 2718 N N . ALA B 2 195 ? 17.856 26.569 26.217 1.0 57.21 ? 373 ALA B N 1 195 . B ATOM 2719 C CA . ALA B 2 195 ? 18.241 27.517 27.254 1.0 52.6 ? 373 ALA B CA 1 195 . B ATOM 2720 C C . ALA B 2 195 ? 17.033 28.275 27.775 1.0 51.83 ? 373 ALA B C 1 195 . B ATOM 2721 O O . ALA B 2 195 ? 16.906 28.483 28.987 1.0 69.93 ? 373 ALA B O 1 195 . B ATOM 2722 C CB . ALA B 2 195 ? 19.298 28.484 26.730 1.0 57.74 ? 373 ALA B CB 1 195 . B ATOM 2723 N N . ARG B 2 196 ? 16.128 28.696 26.888 1.0 44.98 ? 374 ARG B N 1 196 . B ATOM 2724 C CA . ARG B 2 196 ? 14.942 29.392 27.374 1.0 53.24 ? 374 ARG B CA 1 196 . B ATOM 2725 C C . ARG B 2 196 ? 14.183 28.524 28.364 1.0 53.48 ? 374 ARG B C 1 196 . B ATOM 2726 O O . ARG B 2 196 ? 13.784 28.993 29.437 1.0 48.37 ? 374 ARG B O 1 196 . B ATOM 2727 C CB . ARG B 2 196 ? 14.024 29.800 26.221 1.0 47.66 ? 374 ARG B CB 1 196 . B ATOM 2728 C CG . ARG B 2 196 ? 12.731 30.468 26.723 1.0 51.33 ? 374 ARG B CG 1 196 . B ATOM 2729 C CD . ARG B 2 196 ? 11.654 30.658 25.633 1.0 46.35 ? 374 ARG B CD 1 196 . B ATOM 2730 N NE . ARG B 2 196 ? 11.139 29.399 25.097 1.0 53.26 ? 374 ARG B NE 1 196 . B ATOM 2731 C CZ . ARG B 2 196 ? 10.250 28.614 25.706 1.0 52.1 ? 374 ARG B CZ 1 196 . B ATOM 2732 N NH1 . ARG B 2 196 ? 9.765 28.943 26.893 1.0 41.78 ? 374 ARG B NH1 1 196 . B ATOM 2733 N NH2 . ARG B 2 196 ? 9.843 27.492 25.130 1.0 54.52 ? 374 ARG B NH2 1 196 . B ATOM 2734 N N . ILE B 2 197 ? 13.999 27.246 28.031 1.0 47.15 ? 375 ILE B N 1 197 . B ATOM 2735 C CA . ILE B 2 197 ? 13.268 26.349 28.925 1.0 46.62 ? 375 ILE B CA 1 197 . B ATOM 2736 C C . ILE B 2 197 ? 13.971 26.246 30.277 1.0 55.21 ? 375 ILE B C 1 197 . B ATOM 2737 O O . ILE B 2 197 ? 13.330 26.338 31.331 1.0 49.79 ? 375 ILE B O 1 197 . B ATOM 2738 C CB . ILE B 2 197 ? 13.074 24.970 28.271 1.0 41.48 ? 375 ILE B CB 1 197 . B ATOM 2739 C CG1 . ILE B 2 197 ? 12.125 25.083 27.079 1.0 44.44 ? 375 ILE B CG1 1 197 . B ATOM 2740 C CG2 . ILE B 2 197 ? 12.510 23.960 29.282 1.0 37.92 ? 375 ILE B CG2 1 197 . B ATOM 2741 C CD1 . ILE B 2 197 ? 12.002 23.824 26.273 1.0 46.17 ? 375 ILE B CD1 1 197 . B ATOM 2742 N N . GLU B 2 198 ? 15.300 26.070 30.274 1.0 54.32 ? 376 GLU B N 1 198 . B ATOM 2743 C CA . GLU B 2 198 ? 16.006 25.915 31.549 1.0 56.84 ? 376 GLU B CA 1 198 . B ATOM 2744 C C . GLU B 2 198 ? 15.994 27.207 32.362 1.0 55.63 ? 376 GLU B C 1 198 . B ATOM 2745 O O . GLU B 2 198 ? 15.827 27.173 33.584 1.0 58.7 ? 376 GLU B O 1 198 . B ATOM 2746 C CB . GLU B 2 198 ? 17.445 25.444 31.328 1.0 59.98 ? 376 GLU B CB 1 198 . B ATOM 2747 C CG . GLU B 2 198 ? 17.552 24.094 30.635 1.0 71.06 ? 376 GLU B CG 1 198 . B ATOM 2748 C CD . GLU B 2 198 ? 18.675 23.232 31.186 1.0 75.39 ? 376 GLU B CD 1 198 . B ATOM 2749 O OE1 . GLU B 2 198 ? 18.377 22.129 31.691 1.0 77.94 ? 376 GLU B OE1 1 198 . B ATOM 2750 O OE2 . GLU B 2 198 ? 19.850 23.656 31.117 1.0 75.7 ? 376 GLU B OE2 1 198 . B ATOM 2751 N N . ASN B 2 199 ? 16.173 28.356 31.711 1.0 66.77 ? 377 ASN B N 1 199 . B ATOM 2752 C CA . ASN B 2 199 ? 16.110 29.613 32.450 1.0 67.19 ? 377 ASN B CA 1 199 . B ATOM 2753 C C . ASN B 2 199 ? 14.735 29.846 33.068 1.0 65.45 ? 377 ASN B C 1 199 . B ATOM 2754 O O . ASN B 2 199 ? 14.626 30.617 34.029 1.0 63.72 ? 377 ASN B O 1 199 . B ATOM 2755 C CB . ASN B 2 199 ? 16.520 30.778 31.543 1.0 69.94 ? 377 ASN B CB 1 199 . B ATOM 2756 C CG . ASN B 2 199 ? 18.022 30.805 31.279 1.0 82.97 ? 377 ASN B CG 1 199 . B ATOM 2757 O OD1 . ASN B 2 199 ? 18.815 30.496 32.167 1.0 96.21 ? 377 ASN B OD1 1 199 . B ATOM 2758 N ND2 . ASN B 2 199 ? 18.417 31.167 30.059 1.0 76.38 ? 377 ASN B ND2 1 199 . B ATOM 2759 N N . ALA B 2 200 ? 13.696 29.174 32.569 1.0 57.59 ? 378 ALA B N 1 200 . B ATOM 2760 C CA . ALA B 2 200 ? 12.372 29.201 33.181 1.0 55.35 ? 378 ALA B CA 1 200 . B ATOM 2761 C C . ALA B 2 200 ? 12.218 28.189 34.305 1.0 53.28 ? 378 ALA B C 1 200 . B ATOM 2762 O O . ALA B 2 200 ? 11.173 28.166 34.964 1.0 52.08 ? 378 ALA B O 1 200 . B ATOM 2763 C CB . ALA B 2 200 ? 11.290 28.932 32.133 1.0 51.0 ? 378 ALA B CB 1 200 . B ATOM 2764 N N . GLY B 2 201 ? 13.214 27.338 34.516 1.0 50.47 ? 379 GLY B N 1 201 . B ATOM 2765 C CA . GLY B 2 201 ? 13.132 26.281 35.499 1.0 67.78 ? 379 GLY B CA 1 201 . B ATOM 2766 C C . GLY B 2 201 ? 12.630 24.953 34.973 1.0 57.01 ? 379 GLY B C 1 201 . B ATOM 2767 O O . GLY B 2 201 ? 12.338 24.060 35.771 1.0 56.28 ? 379 GLY B O 1 201 . B ATOM 2768 N N . GLY B 2 202 ? 12.503 24.790 33.660 1.0 43.76 ? 380 GLY B N 1 202 . B ATOM 2769 C CA . GLY B 2 202 ? 12.111 23.520 33.092 1.0 41.99 ? 380 GLY B CA 1 202 . B ATOM 2770 C C . GLY B 2 202 ? 13.308 22.610 32.866 1.0 43.74 ? 380 GLY B C 1 202 . B ATOM 2771 O O . GLY B 2 202 ? 14.461 22.963 33.104 1.0 45.66 ? 380 GLY B O 1 202 . B ATOM 2772 N N . LYS B 2 203 ? 13.004 21.410 32.391 1.0 47.43 ? 381 LYS B N 1 203 . B ATOM 2773 C CA . LYS B 2 203 ? 14.012 20.443 31.990 1.0 46.25 ? 381 LYS B CA 1 203 . B ATOM 2774 C C . LYS B 2 203 ? 13.624 19.838 30.648 1.0 42.02 ? 381 LYS B C 1 203 . B ATOM 2775 O O . LYS B 2 203 ? 12.444 19.605 30.382 1.0 41.05 ? 381 LYS B O 1 203 . B ATOM 2776 C CB . LYS B 2 203 ? 14.159 19.344 33.038 1.0 48.95 ? 381 LYS B CB 1 203 . B ATOM 2777 C CG . LYS B 2 203 ? 14.952 19.764 34.263 1.0 64.07 ? 381 LYS B CG 1 203 . B ATOM 2778 C CD . LYS B 2 203 ? 16.410 19.969 33.897 1.0 74.32 ? 381 LYS B CD 1 203 . B ATOM 2779 C CE . LYS B 2 203 ? 17.075 18.642 33.560 1.0 87.6 ? 381 LYS B CE 1 203 . B ATOM 2780 N NZ . LYS B 2 203 ? 18.164 18.795 32.544 1.0 99.77 ? 381 LYS B NZ 1 203 . B ATOM 2781 N N . VAL B 2 204 ? 14.619 19.599 29.801 1.0 44.34 ? 382 VAL B N 1 204 . B ATOM 2782 C CA . VAL B 2 204 ? 14.448 18.849 28.562 1.0 41.3 ? 382 VAL B CA 1 204 . B ATOM 2783 C C . VAL B 2 204 ? 15.274 17.580 28.663 1.0 46.72 ? 382 VAL B C 1 204 . B ATOM 2784 O O . VAL B 2 204 ? 16.455 17.629 29.027 1.0 51.5 ? 382 VAL B O 1 204 . B ATOM 2785 C CB . VAL B 2 204 ? 14.873 19.665 27.328 1.0 41.52 ? 382 VAL B CB 1 204 . B ATOM 2786 C CG1 . VAL B 2 204 ? 14.764 18.793 26.079 1.0 51.64 ? 382 VAL B CG1 1 204 . B ATOM 2787 C CG2 . VAL B 2 204 ? 14.025 20.923 27.204 1.0 41.72 ? 382 VAL B CG2 1 204 . B ATOM 2788 N N . ILE B 2 205 ? 14.664 16.448 28.327 1.0 44.85 ? 383 ILE B N 1 205 . B ATOM 2789 C CA . ILE B 2 205 ? 15.364 15.175 28.403 1.0 51.26 ? 383 ILE B CA 1 205 . B ATOM 2790 C C . ILE B 2 205 ? 15.082 14.360 27.152 1.0 49.13 ? 383 ILE B C 1 205 . B ATOM 2791 O O . ILE B 2 205 ? 14.019 14.471 26.535 1.0 47.27 ? 383 ILE B O 1 205 . B ATOM 2792 C CB . ILE B 2 205 ? 14.978 14.392 29.671 1.0 45.93 ? 383 ILE B CB 1 205 . B ATOM 2793 C CG1 . ILE B 2 205 ? 13.534 13.925 29.595 1.0 42.2 ? 383 ILE B CG1 1 205 . B ATOM 2794 C CG2 . ILE B 2 205 ? 15.184 15.267 30.908 1.0 49.31 ? 383 ILE B CG2 1 205 . B ATOM 2795 C CD1 . ILE B 2 205 ? 13.115 13.148 30.815 1.0 65.51 ? 383 ILE B CD1 1 205 . B ATOM 2796 N N . GLN B 2 206 ? 16.061 13.548 26.773 1.0 52.31 ? 384 GLN B N 1 206 . B ATOM 2797 C CA . GLN B 2 206 ? 15.951 12.668 25.610 1.0 51.82 ? 384 GLN B CA 1 206 . B ATOM 2798 C C . GLN B 2 206 ? 15.137 11.459 26.029 1.0 49.15 ? 384 GLN B C 1 206 . B ATOM 2799 O O . GLN B 2 206 ? 15.626 10.588 26.748 1.0 51.15 ? 384 GLN B O 1 206 . B ATOM 2800 C CB . GLN B 2 206 ? 17.331 12.262 25.111 1.0 44.44 ? 384 GLN B CB 1 206 . B ATOM 2801 C CG . GLN B 2 206 ? 17.500 12.445 23.633 1.0 69.2 ? 384 GLN B CG 1 206 . B ATOM 2802 C CD . GLN B 2 206 ? 17.332 13.896 23.234 1.0 84.71 ? 384 GLN B CD 1 206 . B ATOM 2803 O OE1 . GLN B 2 206 ? 17.318 14.788 24.085 1.0 87.26 ? 384 GLN B OE1 1 206 . B ATOM 2804 N NE2 . GLN B 2 206 ? 17.194 14.140 21.936 1.0 92.63 ? 384 GLN B NE2 1 206 . B ATOM 2805 N N . TRP B 2 207 ? 13.882 11.415 25.602 1.0 38.9 ? 385 TRP B N 1 207 . B ATOM 2806 C CA . TRP B 2 207 ? 12.976 10.346 26.005 1.0 36.16 ? 385 TRP B CA 1 207 . B ATOM 2807 C C . TRP B 2 207 ? 12.106 10.058 24.786 1.0 38.52 ? 385 TRP B C 1 207 . B ATOM 2808 O O . TRP B 2 207 ? 10.991 10.573 24.664 1.0 45.11 ? 385 TRP B O 1 207 . B ATOM 2809 C CB . TRP B 2 207 ? 12.155 10.747 27.225 1.0 36.3 ? 385 TRP B CB 1 207 . B ATOM 2810 C CG . TRP B 2 207 ? 11.475 9.599 27.890 1.0 43.18 ? 385 TRP B CG 1 207 . B ATOM 2811 C CD1 . TRP B 2 207 ? 10.322 8.989 27.497 1.0 54.38 ? 385 TRP B CD1 1 207 . B ATOM 2812 C CD2 . TRP B 2 207 ? 11.903 8.923 29.077 1.0 40.67 ? 385 TRP B CD2 1 207 . B ATOM 2813 N NE1 . TRP B 2 207 ? 10.007 7.968 28.361 1.0 50.73 ? 385 TRP B NE1 1 207 . B ATOM 2814 C CE2 . TRP B 2 207 ? 10.966 7.905 29.339 1.0 49.52 ? 385 TRP B CE2 1 207 . B ATOM 2815 C CE3 . TRP B 2 207 ? 13.001 9.066 29.931 1.0 50.62 ? 385 TRP B CE3 1 207 . B ATOM 2816 C CZ2 . TRP B 2 207 ? 11.085 7.037 30.428 1.0 51.05 ? 385 TRP B CZ2 1 207 . B ATOM 2817 C CZ3 . TRP B 2 207 ? 13.117 8.204 31.023 1.0 53.01 ? 385 TRP B CZ3 1 207 . B ATOM 2818 C CH2 . TRP B 2 207 ? 12.158 7.210 31.262 1.0 51.84 ? 385 TRP B CH2 1 207 . B ATOM 2819 N N . GLN B 2 208 ? 12.616 9.220 23.888 1.0 57.1 ? 386 GLN B N 1 208 . B ATOM 2820 C CA . GLN B 2 208 ? 12.015 9.042 22.571 1.0 48.51 ? 386 GLN B CA 1 208 . B ATOM 2821 C C . GLN B 2 208 ? 11.807 10.414 21.925 1.0 42.34 ? 386 GLN B C 1 208 . B ATOM 2822 O O . GLN B 2 208 ? 10.696 10.884 21.706 1.0 46.38 ? 386 GLN B O 1 208 . B ATOM 2823 C CB . GLN B 2 208 ? 10.712 8.244 22.679 1.0 54.02 ? 386 GLN B CB 1 208 . B ATOM 2824 C CG . GLN B 2 208 ? 9.901 8.126 21.385 1.0 57.05 ? 386 GLN B CG 1 208 . B ATOM 2825 C CD . GLN B 2 208 ? 8.606 7.373 21.605 1.0 62.36 ? 386 GLN B CD 1 208 . B ATOM 2826 O OE1 . GLN B 2 208 ? 8.582 6.344 22.287 1.0 77.57 ? 386 GLN B OE1 1 208 . B ATOM 2827 N NE2 . GLN B 2 208 ? 7.517 7.888 21.043 1.0 57.22 ? 386 GLN B NE2 1 208 . B ATOM 2828 N N . GLY B 2 209 ? 12.939 11.046 21.649 1.0 37.36 ? 387 GLY B N 1 209 . B ATOM 2829 C CA . GLY B 2 209 ? 13.008 12.426 21.218 1.0 35.21 ? 387 GLY B CA 1 209 . B ATOM 2830 C C . GLY B 2 209 ? 13.228 13.376 22.391 1.0 39.26 ? 387 GLY B C 1 209 . B ATOM 2831 O O . GLY B 2 209 ? 12.902 13.083 23.539 1.0 45.8 ? 387 GLY B O 1 209 . B ATOM 2832 N N . ALA B 2 210 ? 13.800 14.540 22.089 1.0 46.52 ? 388 ALA B N 1 210 . B ATOM 2833 C CA . ALA B 2 210 ? 13.907 15.606 23.082 1.0 44.55 ? 388 ALA B CA 1 210 . B ATOM 2834 C C . ALA B 2 210 ? 12.516 16.074 23.491 1.0 49.08 ? 388 ALA B C 1 210 . B ATOM 2835 O O . ALA B 2 210 ? 11.709 16.461 22.637 1.0 44.94 ? 388 ALA B O 1 210 . B ATOM 2836 C CB . ALA B 2 210 ? 14.718 16.772 22.528 1.0 44.07 ? 388 ALA B CB 1 210 . B ATOM 2837 N N . ARG B 2 211 ? 12.238 16.045 24.804 1.0 43.76 ? 389 ARG B N 1 211 . B ATOM 2838 C CA . ARG B 2 211 ? 10.924 16.386 25.339 1.0 40.52 ? 389 ARG B CA 1 211 . B ATOM 2839 C C . ARG B 2 211 ? 11.055 17.221 26.608 1.0 39.21 ? 389 ARG B C 1 211 . B ATOM 2840 O O . ARG B 2 211 ? 11.957 17.004 27.420 1.0 40.96 ? 389 ARG B O 1 211 . B ATOM 2841 C CB . ARG B 2 211 ? 10.098 15.135 25.668 1.0 41.16 ? 389 ARG B CB 1 211 . B ATOM 2842 C CG . ARG B 2 211 ? 9.680 14.342 24.473 1.0 42.95 ? 389 ARG B CG 1 211 . B ATOM 2843 C CD . ARG B 2 211 ? 8.874 13.106 24.821 1.0 45.49 ? 389 ARG B CD 1 211 . B ATOM 2844 N NE . ARG B 2 211 ? 8.707 12.283 23.620 1.0 45.15 ? 389 ARG B NE 1 211 . B ATOM 2845 C CZ . ARG B 2 211 ? 7.619 12.269 22.855 1.0 49.41 ? 389 ARG B CZ 1 211 . B ATOM 2846 N NH1 . ARG B 2 211 ? 6.560 13.021 23.156 1.0 42.3 ? 389 ARG B NH1 1 211 . B ATOM 2847 N NH2 . ARG B 2 211 ? 7.592 11.494 21.774 1.0 54.35 ? 389 ARG B NH2 1 211 . B ATOM 2848 N N . VAL B 2 212 ? 10.136 18.173 26.762 1.0 39.76 ? 390 VAL B N 1 212 . B ATOM 2849 C CA . VAL B 2 212 ? 9.987 18.961 27.981 1.0 39.06 ? 390 VAL B CA 1 212 . B ATOM 2850 C C . VAL B 2 212 ? 9.516 18.030 29.096 1.0 44.77 ? 390 VAL B C 1 212 . B ATOM 2851 O O . VAL B 2 212 ? 8.426 17.456 29.011 1.0 44.45 ? 390 VAL B O 1 212 . B ATOM 2852 C CB . VAL B 2 212 ? 9.003 20.112 27.769 1.0 40.37 ? 390 VAL B CB 1 212 . B ATOM 2853 C CG1 . VAL B 2 212 ? 8.883 20.940 29.055 1.0 46.07 ? 390 VAL B CG1 1 212 . B ATOM 2854 C CG2 . VAL B 2 212 ? 9.441 20.967 26.581 1.0 40.27 ? 390 VAL B CG2 1 212 . B ATOM 2855 N N . PHE B 2 213 ? 10.330 17.896 30.151 1.0 49.33 ? 391 PHE B N 1 213 . B ATOM 2856 C CA . PHE B 2 213 ? 10.122 16.914 31.221 1.0 49.45 ? 391 PHE B CA 1 213 . B ATOM 2857 C C . PHE B 2 213 ? 9.836 15.522 30.683 1.0 42.64 ? 391 PHE B C 1 213 . B ATOM 2858 O O . PHE B 2 213 ? 9.109 14.752 31.310 1.0 51.95 ? 391 PHE B O 1 213 . B ATOM 2859 C CB . PHE B 2 213 ? 8.999 17.332 32.174 1.0 47.62 ? 391 PHE B CB 1 213 . B ATOM 2860 C CG . PHE B 2 213 ? 9.302 18.580 32.938 1.0 43.18 ? 391 PHE B CG 1 213 . B ATOM 2861 C CD1 . PHE B 2 213 ? 10.266 18.576 33.925 1.0 48.95 ? 391 PHE B CD1 1 213 . B ATOM 2862 C CD2 . PHE B 2 213 ? 8.653 19.761 32.650 1.0 52.99 ? 391 PHE B CD2 1 213 . B ATOM 2863 C CE1 . PHE B 2 213 ? 10.553 19.724 34.640 1.0 54.29 ? 391 PHE B CE1 1 213 . B ATOM 2864 C CE2 . PHE B 2 213 ? 8.942 20.914 33.352 1.0 59.56 ? 391 PHE B CE2 1 213 . B ATOM 2865 C CZ . PHE B 2 213 ? 9.894 20.890 34.348 1.0 51.33 ? 391 PHE B CZ 1 213 . B ATOM 2866 N N . GLY B 2 214 ? 10.409 15.180 29.531 1.0 43.72 ? 392 GLY B N 1 214 . B ATOM 2867 C CA . GLY B 2 214 ? 10.189 13.872 28.945 1.0 35.68 ? 392 GLY B CA 1 214 . B ATOM 2868 C C . GLY B 2 214 ? 8.818 13.652 28.347 1.0 46.0 ? 392 GLY B C 1 214 . B ATOM 2869 O O . GLY B 2 214 ? 8.536 12.541 27.886 1.0 46.93 ? 392 GLY B O 1 214 . B ATOM 2870 N N . VAL B 2 215 ? 7.968 14.676 28.303 1.0 45.09 ? 393 VAL B N 1 215 . B ATOM 2871 C CA . VAL B 2 215 ? 6.576 14.496 27.910 1.0 45.99 ? 393 VAL B CA 1 215 . B ATOM 2872 C C . VAL B 2 215 ? 6.310 15.027 26.499 1.0 44.22 ? 393 VAL B C 1 215 . B ATOM 2873 O O . VAL B 2 215 ? 5.910 14.271 25.603 1.0 43.31 ? 393 VAL B O 1 215 . B ATOM 2874 C CB . VAL B 2 215 ? 5.647 15.171 28.932 1.0 42.06 ? 393 VAL B CB 1 215 . B ATOM 2875 C CG1 . VAL B 2 215 ? 4.214 14.876 28.596 1.0 40.64 ? 393 VAL B CG1 1 215 . B ATOM 2876 C CG2 . VAL B 2 215 ? 5.975 14.679 30.356 1.0 48.83 ? 393 VAL B CG2 1 215 . B ATOM 2877 N N . LEU B 2 216 ? 6.529 16.323 26.298 1.0 41.83 ? 394 LEU B N 1 216 . B ATOM 2878 C CA . LEU B 2 216 ? 6.078 17.034 25.106 1.0 53.3 ? 394 LEU B CA 1 216 . B ATOM 2879 C C . LEU B 2 216 ? 7.233 17.300 24.143 1.0 46.89 ? 394 LEU B C 1 216 . B ATOM 2880 O O . LEU B 2 216 ? 8.221 17.943 24.511 1.0 41.66 ? 394 LEU B O 1 216 . B ATOM 2881 C CB . LEU B 2 216 ? 5.416 18.353 25.504 1.0 44.5 ? 394 LEU B CB 1 216 . B ATOM 2882 C CG . LEU B 2 216 ? 4.647 18.966 24.346 1.0 49.6 ? 394 LEU B CG 1 216 . B ATOM 2883 C CD1 . LEU B 2 216 ? 3.512 18.022 24.005 1.0 52.33 ? 394 LEU B CD1 1 216 . B ATOM 2884 C CD2 . LEU B 2 216 ? 4.132 20.352 24.708 1.0 42.13 ? 394 LEU B CD2 1 216 . B ATOM 2885 N N . ALA B 2 217 ? 7.096 16.836 22.897 1.0 39.76 ? 395 ALA B N 1 217 . B ATOM 2886 C CA . ALA B 2 217 ? 8.173 16.958 21.923 1.0 42.98 ? 395 ALA B CA 1 217 . B ATOM 2887 C C . ALA B 2 217 ? 8.210 18.321 21.242 1.0 48.54 ? 395 ALA B C 1 217 . B ATOM 2888 O O . ALA B 2 217 ? 8.802 18.444 20.168 1.0 45.48 ? 395 ALA B O 1 217 . B ATOM 2889 C CB . ALA B 2 217 ? 8.074 15.856 20.863 1.0 40.67 ? 395 ALA B CB 1 217 . B ATOM 2890 N N . MET B 2 218 ? 7.600 19.347 21.825 1.0 46.18 ? 396 MET B N 1 218 . B ATOM 2891 C CA . MET B 2 218 ? 7.771 20.688 21.295 1.0 50.9 ? 396 MET B CA 1 218 . B ATOM 2892 C C . MET B 2 218 ? 7.845 21.677 22.449 1.0 48.41 ? 396 MET B C 1 218 . B ATOM 2893 O O . MET B 2 218 ? 7.383 21.411 23.561 1.0 44.16 ? 396 MET B O 1 218 . B ATOM 2894 C CB . MET B 2 218 ? 6.648 21.075 20.339 1.0 48.79 ? 396 MET B CB 1 218 . B ATOM 2895 C CG . MET B 2 218 ? 5.302 21.150 20.994 1.0 53.6 ? 396 MET B CG 1 218 . B ATOM 2896 S SD . MET B 2 218 ? 4.059 21.470 19.745 1.0 72.17 ? 396 MET B SD 1 218 . B ATOM 2897 C CE . MET B 2 218 ? 4.384 20.082 18.666 1.0 62.75 ? 396 MET B CE 1 218 . B ATOM 2898 N N . SER B 2 219 ? 8.422 22.840 22.153 1.0 43.75 ? 397 SER B N 1 219 . B ATOM 2899 C CA . SER B 2 219 ? 8.734 23.842 23.151 1.0 43.45 ? 397 SER B CA 1 219 . B ATOM 2900 C C . SER B 2 219 ? 7.740 24.994 23.188 1.0 52.42 ? 397 SER B C 1 219 . B ATOM 2901 O O . SER B 2 219 ? 7.817 25.831 24.105 1.0 40.33 ? 397 SER B O 1 219 . B ATOM 2902 C CB . SER B 2 219 ? 10.142 24.374 22.898 1.0 47.84 ? 397 SER B CB 1 219 . B ATOM 2903 O OG . SER B 2 219 ? 10.251 24.797 21.547 1.0 46.31 ? 397 SER B OG 1 219 . B ATOM 2904 N N . ARG B 2 220 ? 6.818 25.064 22.222 1.0 45.53 ? 398 ARG B N 1 220 . B ATOM 2905 C CA . ARG B 2 220 ? 5.761 26.062 22.242 1.0 32.85 ? 398 ARG B CA 1 220 . B ATOM 2906 C C . ARG B 2 220 ? 4.499 25.450 21.665 1.0 42.82 ? 398 ARG B C 1 220 . B ATOM 2907 O O . ARG B 2 220 ? 4.559 24.530 20.842 1.0 42.88 ? 398 ARG B O 1 220 . B ATOM 2908 C CB . ARG B 2 220 ? 6.151 27.324 21.478 1.0 42.58 ? 398 ARG B CB 1 220 . B ATOM 2909 C CG . ARG B 2 220 ? 7.543 27.839 21.791 1.0 43.57 ? 398 ARG B CG 1 220 . B ATOM 2910 C CD . ARG B 2 220 ? 7.696 29.267 21.322 1.0 40.8 ? 398 ARG B CD 1 220 . B ATOM 2911 N NE . ARG B 2 220 ? 9.060 29.753 21.504 1.0 43.0 ? 398 ARG B NE 1 220 . B ATOM 2912 C CZ . ARG B 2 220 ? 9.425 31.020 21.344 1.0 48.19 ? 398 ARG B CZ 1 220 . B ATOM 2913 N NH1 . ARG B 2 220 ? 8.523 31.927 20.995 1.0 51.76 ? 398 ARG B NH1 1 220 . B ATOM 2914 N NH2 . ARG B 2 220 ? 10.691 31.380 21.526 1.0 50.82 ? 398 ARG B NH2 1 220 . B ATOM 2915 N N . SER B 2 221 ? 3.355 25.949 22.122 1.0 34.7 ? 399 SER B N 1 221 . B ATOM 2916 C CA . SER B 2 221 ? 2.079 25.415 21.678 1.0 38.25 ? 399 SER B CA 1 221 . B ATOM 2917 C C . SER B 2 221 ? 0.969 26.307 22.197 1.0 45.01 ? 399 SER B C 1 221 . B ATOM 2918 O O . SER B 2 221 ? 1.168 27.106 23.113 1.0 40.28 ? 399 SER B O 1 221 . B ATOM 2919 C CB . SER B 2 221 ? 1.864 23.981 22.165 1.0 55.66 ? 399 SER B CB 1 221 . B ATOM 2920 O OG . SER B 2 221 ? 1.699 23.963 23.568 1.0 64.97 ? 399 SER B OG 1 221 . B ATOM 2921 N N . ILE B 2 222 ? -0.199 26.158 21.598 1.0 41.58 ? 400 ILE B N 1 222 . B ATOM 2922 C CA . ILE B 2 222 ? -1.418 26.690 22.181 1.0 44.02 ? 400 ILE B CA 1 222 . B ATOM 2923 C C . ILE B 2 222 ? -1.981 25.636 23.128 1.0 48.52 ? 400 ILE B C 1 222 . B ATOM 2924 O O . ILE B 2 222 ? -1.948 24.439 22.826 1.0 51.3 ? 400 ILE B O 1 222 . B ATOM 2925 C CB . ILE B 2 222 ? -2.411 27.062 21.069 1.0 38.32 ? 400 ILE B CB 1 222 . B ATOM 2926 C CG1 . ILE B 2 222 ? -1.734 27.969 20.041 1.0 46.52 ? 400 ILE B CG1 1 222 . B ATOM 2927 C CG2 . ILE B 2 222 ? -3.604 27.781 21.644 1.0 43.57 ? 400 ILE B CG2 1 222 . B ATOM 2928 C CD1 . ILE B 2 222 ? -1.514 29.366 20.544 1.0 48.84 ? 400 ILE B CD1 1 222 . B ATOM 2929 N N . GLY B 2 223 ? -2.473 26.067 24.291 1.0 41.08 ? 401 GLY B N 1 223 . B ATOM 2930 C CA . GLY B 2 223 ? -2.950 25.082 25.261 1.0 44.8 ? 401 GLY B CA 1 223 . B ATOM 2931 C C . GLY B 2 223 ? -1.814 24.498 26.086 1.0 39.91 ? 401 GLY B C 1 223 . B ATOM 2932 O O . GLY B 2 223 ? -0.836 25.170 26.402 1.0 48.73 ? 401 GLY B O 1 223 . B ATOM 2933 N N . ASP B 2 224 ? -1.940 23.223 26.449 1.0 40.98 ? 402 ASP B N 1 224 . B ATOM 2934 C CA . ASP B 2 224 ? -0.927 22.569 27.277 1.0 42.96 ? 402 ASP B CA 1 224 . B ATOM 2935 C C . ASP B 2 224 ? -0.691 23.299 28.603 1.0 46.26 ? 402 ASP B C 1 224 . B ATOM 2936 O O . ASP B 2 224 ? 0.436 23.341 29.096 1.0 40.12 ? 402 ASP B O 1 224 . B ATOM 2937 C CB . ASP B 2 224 ? 0.402 22.444 26.531 1.0 46.69 ? 402 ASP B CB 1 224 . B ATOM 2938 C CG . ASP B 2 224 ? 0.329 21.505 25.343 1.0 55.1 ? 402 ASP B CG 1 224 . B ATOM 2939 O OD1 . ASP B 2 224 ? -0.130 20.349 25.495 1.0 51.46 ? 402 ASP B OD1 1 224 . B ATOM 2940 O OD2 . ASP B 2 224 ? 0.756 21.934 24.251 1.0 53.76 ? 402 ASP B OD2 1 224 . B ATOM 2941 N N . ARG B 2 225 ? -1.729 23.923 29.148 1.0 47.71 ? 403 ARG B N 1 225 . B ATOM 2942 C CA . ARG B 2 225 ? -1.754 24.496 30.495 1.0 47.42 ? 403 ARG B CA 1 225 . B ATOM 2943 C C . ARG B 2 225 ? -0.742 23.868 31.456 1.0 42.8 ? 403 ARG B C 1 225 . B ATOM 2944 O O . ARG B 2 225 ? 0.035 24.577 32.092 1.0 48.56 ? 403 ARG B O 1 225 . B ATOM 2945 C CB . ARG B 2 225 ? -3.169 24.336 31.056 1.0 49.55 ? 403 ARG B CB 1 225 . B ATOM 2946 C CG . ARG B 2 225 ? -3.512 25.183 32.242 1.0 75.07 ? 403 ARG B CG 1 225 . B ATOM 2947 C CD . ARG B 2 225 ? -4.867 25.847 32.043 1.0 78.12 ? 403 ARG B CD 1 225 . B ATOM 2948 N NE . ARG B 2 225 ? -5.746 25.068 31.173 1.0 77.06 ? 403 ARG B NE 1 225 . B ATOM 2949 C CZ . ARG B 2 225 ? -6.308 23.919 31.523 1.0 74.92 ? 403 ARG B CZ 1 225 . B ATOM 2950 N NH1 . ARG B 2 225 ? -7.101 23.275 30.676 1.0 84.1 ? 403 ARG B NH1 1 225 . B ATOM 2951 N NH2 . ARG B 2 225 ? -6.056 23.405 32.711 1.0 82.02 ? 403 ARG B NH2 1 225 . B ATOM 2952 N N . TYR B 2 226 ? -0.719 22.538 31.533 1.0 44.38 ? 404 TYR B N 1 226 . B ATOM 2953 C CA . TYR B 2 226 ? 0.048 21.848 32.562 1.0 56.91 ? 404 TYR B CA 1 226 . B ATOM 2954 C C . TYR B 2 226 ? 1.548 22.046 32.423 1.0 63.12 ? 404 TYR B C 1 226 . B ATOM 2955 O O . TYR B 2 226 ? 2.288 21.767 33.370 1.0 60.21 ? 404 TYR B O 1 226 . B ATOM 2956 C CB . TYR B 2 226 ? -0.304 20.357 32.572 1.0 44.53 ? 404 TYR B CB 1 226 . B ATOM 2957 C CG . TYR B 2 226 ? 0.178 19.542 31.382 1.0 63.19 ? 404 TYR B CG 1 226 . B ATOM 2958 C CD1 . TYR B 2 226 ? -0.228 19.842 30.084 1.0 64.25 ? 404 TYR B CD1 1 226 . B ATOM 2959 C CD2 . TYR B 2 226 ? 1.009 18.449 31.565 1.0 57.86 ? 404 TYR B CD2 1 226 . B ATOM 2960 C CE1 . TYR B 2 226 ? 0.206 19.083 29.002 1.0 66.04 ? 404 TYR B CE1 1 226 . B ATOM 2961 C CE2 . TYR B 2 226 ? 1.438 17.682 30.491 1.0 57.77 ? 404 TYR B CE2 1 226 . B ATOM 2962 C CZ . TYR B 2 226 ? 1.035 17.998 29.214 1.0 61.46 ? 404 TYR B CZ 1 226 . B ATOM 2963 O OH . TYR B 2 226 ? 1.467 17.226 28.155 1.0 57.27 ? 404 TYR B OH 1 226 . B ATOM 2964 N N . LEU B 2 227 ? 2.016 22.540 31.287 1.0 54.84 ? 405 LEU B N 1 227 . B ATOM 2965 C CA . LEU B 2 227 ? 3.442 22.753 31.084 1.0 47.73 ? 405 LEU B CA 1 227 . B ATOM 2966 C C . LEU B 2 227 ? 3.803 24.231 30.995 1.0 45.23 ? 405 LEU B C 1 227 . B ATOM 2967 O O . LEU B 2 227 ? 4.942 24.561 30.644 1.0 49.45 ? 405 LEU B O 1 227 . B ATOM 2968 C CB . LEU B 2 227 ? 3.910 21.997 29.834 1.0 45.91 ? 405 LEU B CB 1 227 . B ATOM 2969 C CG . LEU B 2 227 ? 4.073 20.489 30.026 1.0 44.48 ? 405 LEU B CG 1 227 . B ATOM 2970 C CD1 . LEU B 2 227 ? 4.315 19.782 28.704 1.0 60.14 ? 405 LEU B CD1 1 227 . B ATOM 2971 C CD2 . LEU B 2 227 ? 5.218 20.209 30.975 1.0 56.38 ? 405 LEU B CD2 1 227 . B ATOM 2972 N N . LYS B 2 228 ? 2.858 25.125 31.277 1.0 47.17 ? 406 LYS B N 1 228 . B ATOM 2973 C CA . LYS B 2 228 ? 3.156 26.542 31.479 1.0 53.85 ? 406 LYS B CA 1 228 . B ATOM 2974 C C . LYS B 2 228 ? 3.972 26.652 32.780 1.0 54.85 ? 406 LYS B C 1 228 . B ATOM 2975 O O . LYS B 2 228 ? 3.700 25.943 33.745 1.0 62.47 ? 406 LYS B O 1 228 . B ATOM 2976 C CB . LYS B 2 228 ? 1.848 27.356 31.531 1.0 61.93 ? 406 LYS B CB 1 228 . B ATOM 2977 C CG . LYS B 2 228 ? 1.962 28.811 32.009 1.0 88.93 ? 406 LYS B CG 1 228 . B ATOM 2978 C CD . LYS B 2 228 ? 0.572 29.471 32.145 1.0 99.06 ? 406 LYS B CD 1 228 . B ATOM 2979 C CE . LYS B 2 228 ? 0.669 30.988 32.369 1.0 99.01 ? 406 LYS B CE 1 228 . B ATOM 2980 N NZ . LYS B 2 228 ? -0.675 31.652 32.416 1.0 98.64 ? 406 LYS B NZ 1 228 . B ATOM 2981 N N . PRO B 2 229 ? 4.991 27.523 32.807 1.0 56.89 ? 407 PRO B N 1 229 . B ATOM 2982 C CA . PRO B 2 229 ? 5.413 28.439 31.745 1.0 52.72 ? 407 PRO B CA 1 229 . B ATOM 2983 C C . PRO B 2 229 ? 6.607 27.936 30.935 1.0 42.56 ? 407 PRO B C 1 229 . B ATOM 2984 O O . PRO B 2 229 ? 7.356 28.723 30.371 1.0 42.6 ? 407 PRO B O 1 229 . B ATOM 2985 C CB . PRO B 2 229 ? 5.817 29.676 32.529 1.0 55.45 ? 407 PRO B CB 1 229 . B ATOM 2986 C CG . PRO B 2 229 ? 6.465 29.078 33.772 1.0 52.76 ? 407 PRO B CG 1 229 . B ATOM 2987 C CD . PRO B 2 229 ? 5.731 27.782 34.057 1.0 52.46 ? 407 PRO B CD 1 229 . B ATOM 2988 N N . TYR B 2 230 ? 6.825 26.634 30.915 1.0 44.42 ? 408 TYR B N 1 230 . B ATOM 2989 C CA . TYR B 2 230 ? 7.968 26.126 30.172 1.0 52.9 ? 408 TYR B CA 1 230 . B ATOM 2990 C C . TYR B 2 230 ? 7.666 26.104 28.681 1.0 40.18 ? 408 TYR B C 1 230 . B ATOM 2991 O O . TYR B 2 230 ? 8.433 26.635 27.875 1.0 46.18 ? 408 TYR B O 1 230 . B ATOM 2992 C CB . TYR B 2 230 ? 8.330 24.744 30.697 1.0 52.28 ? 408 TYR B CB 1 230 . B ATOM 2993 C CG . TYR B 2 230 ? 8.315 24.713 32.217 1.0 52.59 ? 408 TYR B CG 1 230 . B ATOM 2994 C CD1 . TYR B 2 230 ? 9.286 25.390 32.954 1.0 49.47 ? 408 TYR B CD1 1 230 . B ATOM 2995 C CD2 . TYR B 2 230 ? 7.315 24.041 32.912 1.0 47.26 ? 408 TYR B CD2 1 230 . B ATOM 2996 C CE1 . TYR B 2 230 ? 9.278 25.365 34.350 1.0 54.42 ? 408 TYR B CE1 1 230 . B ATOM 2997 C CE2 . TYR B 2 230 ? 7.300 24.017 34.306 1.0 45.58 ? 408 TYR B CE2 1 230 . B ATOM 2998 C CZ . TYR B 2 230 ? 8.280 24.680 35.010 1.0 46.56 ? 408 TYR B CZ 1 230 . B ATOM 2999 O OH . TYR B 2 230 ? 8.269 24.646 36.389 1.0 54.19 ? 408 TYR B OH 1 230 . B ATOM 3000 N N . VAL B 2 231 ? 6.537 25.513 28.319 1.0 44.79 ? 409 VAL B N 1 231 . B ATOM 3001 C CA . VAL B 2 231 ? 5.966 25.612 26.982 1.0 48.94 ? 409 VAL B CA 1 231 . B ATOM 3002 C C . VAL B 2 231 ? 5.090 26.861 26.964 1.0 49.48 ? 409 VAL B C 1 231 . B ATOM 3003 O O . VAL B 2 231 ? 4.178 26.989 27.789 1.0 50.23 ? 409 VAL B O 1 231 . B ATOM 3004 C CB . VAL B 2 231 ? 5.151 24.349 26.654 1.0 39.1 ? 409 VAL B CB 1 231 . B ATOM 3005 C CG1 . VAL B 2 231 ? 4.676 24.354 25.235 1.0 45.24 ? 409 VAL B CG1 1 231 . B ATOM 3006 C CG2 . VAL B 2 231 ? 5.967 23.105 26.924 1.0 33.68 ? 409 VAL B CG2 1 231 . B ATOM 3007 N N . ILE B 2 232 ? 5.362 27.778 26.040 1.0 51.69 ? 410 ILE B N 1 232 . B ATOM 3008 C CA . ILE B 2 232 ? 4.690 29.076 25.998 1.0 44.2 ? 410 ILE B CA 1 232 . B ATOM 3009 C C . ILE B 2 232 ? 3.965 29.196 24.671 1.0 44.39 ? 410 ILE B C 1 232 . B ATOM 3010 O O . ILE B 2 232 ? 4.295 28.503 23.688 1.0 45.13 ? 410 ILE B O 1 232 . B ATOM 3011 C CB . ILE B 2 232 ? 5.683 30.244 26.194 1.0 52.89 ? 410 ILE B CB 1 232 . B ATOM 3012 C CG1 . ILE B 2 232 ? 6.816 30.149 25.174 1.0 46.56 ? 410 ILE B CG1 1 232 . B ATOM 3013 C CG2 . ILE B 2 232 ? 6.251 30.242 27.605 1.0 53.95 ? 410 ILE B CG2 1 232 . B ATOM 3014 C CD1 . ILE B 2 232 ? 7.806 31.282 25.254 1.0 47.59 ? 410 ILE B CD1 1 232 . B ATOM 3015 N N . PRO B 2 233 ? 2.977 30.087 24.585 1.0 43.24 ? 411 PRO B N 1 233 . B ATOM 3016 C CA . PRO B 2 233 ? 2.306 30.337 23.303 1.0 44.37 ? 411 PRO B CA 1 233 . B ATOM 3017 C C . PRO B 2 233 ? 2.828 31.540 22.538 1.0 47.28 ? 411 PRO B C 1 233 . B ATOM 3018 O O . PRO B 2 233 ? 2.138 32.025 21.639 1.0 58.82 ? 411 PRO B O 1 233 . B ATOM 3019 C CB . PRO B 2 233 ? 0.857 30.569 23.726 1.0 47.13 ? 411 PRO B CB 1 233 . B ATOM 3020 C CG . PRO B 2 233 ? 0.990 31.257 25.053 1.0 55.38 ? 411 PRO B CG 1 233 . B ATOM 3021 C CD . PRO B 2 233 ? 2.252 30.703 25.715 1.0 42.95 ? 411 PRO B CD 1 233 . B ATOM 3022 N N . GLU B 2 234 ? 4.010 32.057 22.868 1.0 49.65 ? 412 GLU B N 1 234 . B ATOM 3023 C CA . GLU B 2 234 ? 4.522 33.210 22.125 1.0 51.47 ? 412 GLU B CA 1 234 . B ATOM 3024 C C . GLU B 2 234 ? 4.972 32.764 20.739 1.0 46.55 ? 412 GLU B C 1 234 . B ATOM 3025 O O . GLU B 2 234 ? 5.880 31.929 20.627 1.0 42.03 ? 412 GLU B O 1 234 . B ATOM 3026 C CB . GLU B 2 234 ? 5.677 33.899 22.863 1.0 59.21 ? 412 GLU B CB 1 234 . B ATOM 3027 C CG . GLU B 2 234 ? 5.263 35.029 23.825 1.0 84.44 ? 412 GLU B CG 1 234 . B ATOM 3028 C CD . GLU B 2 234 ? 4.763 34.510 25.173 1.0 103.76 ? 412 GLU B CD 1 234 . B ATOM 3029 O OE1 . GLU B 2 234 ? 4.363 35.333 26.022 1.0 109.22 ? 412 GLU B OE1 1 234 . B ATOM 3030 O OE2 . GLU B 2 234 ? 4.771 33.280 25.394 1.0 111.7 ? 412 GLU B OE2 1 234 . B ATOM 3031 N N . PRO B 2 235 ? 4.392 33.293 19.672 1.0 42.17 ? 413 PRO B N 1 235 . B ATOM 3032 C CA . PRO B 2 235 ? 4.821 32.901 18.331 1.0 44.4 ? 413 PRO B CA 1 235 . B ATOM 3033 C C . PRO B 2 235 ? 6.092 33.620 17.895 1.0 58.13 ? 413 PRO B C 1 235 . B ATOM 3034 O O . PRO B 2 235 ? 6.524 34.609 18.490 1.0 62.94 ? 413 PRO B O 1 235 . B ATOM 3035 C CB . PRO B 2 235 ? 3.631 33.318 17.457 1.0 43.59 ? 413 PRO B CB 1 235 . B ATOM 3036 C CG . PRO B 2 235 ? 3.076 34.518 18.145 1.0 39.84 ? 413 PRO B CG 1 235 . B ATOM 3037 C CD . PRO B 2 235 ? 3.257 34.237 19.637 1.0 39.45 ? 413 PRO B CD 1 235 . B ATOM 3038 N N . GLU B 2 236 ? 6.699 33.082 16.838 1.0 51.94 ? 414 GLU B N 1 236 . B ATOM 3039 C CA . GLU B 2 236 ? 7.718 33.768 16.054 1.0 40.46 ? 414 GLU B CA 1 236 . B ATOM 3040 C C . GLU B 2 236 ? 7.051 34.303 14.795 1.0 53.62 ? 414 GLU B C 1 236 . B ATOM 3041 O O . GLU B 2 236 ? 6.483 33.526 14.020 1.0 41.68 ? 414 GLU B O 1 236 . B ATOM 3042 C CB . GLU B 2 236 ? 8.852 32.817 15.666 1.0 53.62 ? 414 GLU B CB 1 236 . B ATOM 3043 C CG . GLU B 2 236 ? 10.164 33.022 16.387 1.0 67.39 ? 414 GLU B CG 1 236 . B ATOM 3044 C CD . GLU B 2 236 ? 10.847 31.703 16.688 1.0 69.81 ? 414 GLU B CD 1 236 . B ATOM 3045 O OE1 . GLU B 2 236 ? 10.756 31.249 17.843 1.0 74.6 ? 414 GLU B OE1 1 236 . B ATOM 3046 O OE2 . GLU B 2 236 ? 11.449 31.109 15.769 1.0 81.16 ? 414 GLU B OE2 1 236 . B ATOM 3047 N N . VAL B 2 237 ? 7.108 35.617 14.596 1.0 41.27 ? 415 VAL B N 1 237 . B ATOM 3048 C CA . VAL B 2 237 ? 6.428 36.260 13.478 1.0 42.97 ? 415 VAL B CA 1 237 . B ATOM 3049 C C . VAL B 2 237 ? 7.452 36.644 12.416 1.0 43.66 ? 415 VAL B C 1 237 . B ATOM 3050 O O . VAL B 2 237 ? 8.523 37.175 12.730 1.0 43.51 ? 415 VAL B O 1 237 . B ATOM 3051 C CB . VAL B 2 237 ? 5.620 37.488 13.940 1.0 45.0 ? 415 VAL B CB 1 237 . B ATOM 3052 C CG1 . VAL B 2 237 ? 4.907 38.137 12.766 1.0 45.43 ? 415 VAL B CG1 1 237 . B ATOM 3053 C CG2 . VAL B 2 237 ? 4.614 37.073 14.985 1.0 55.87 ? 415 VAL B CG2 1 237 . B ATOM 3054 N N . THR B 2 238 ? 7.122 36.365 11.158 1.0 39.43 ? 416 THR B N 1 238 . B ATOM 3055 C CA . THR B 2 238 ? 7.957 36.718 10.012 1.0 36.48 ? 416 THR B CA 1 238 . B ATOM 3056 C C . THR B 2 238 ? 7.182 37.690 9.137 1.0 40.82 ? 416 THR B C 1 238 . B ATOM 3057 O O . THR B 2 238 ? 5.988 37.490 8.890 1.0 44.91 ? 416 THR B O 1 238 . B ATOM 3058 C CB . THR B 2 238 ? 8.367 35.469 9.209 1.0 47.13 ? 416 THR B CB 1 238 . B ATOM 3059 O OG1 . THR B 2 238 ? 9.349 34.729 9.938 1.0 55.89 ? 416 THR B OG1 1 238 . B ATOM 3060 C CG2 . THR B 2 238 ? 8.957 35.847 7.832 1.0 68.12 ? 416 THR B CG2 1 238 . B ATOM 3061 N N . PHE B 2 239 ? 7.855 38.746 8.693 1.0 42.27 ? 417 PHE B N 1 239 . B ATOM 3062 C CA . PHE B 2 239 ? 7.304 39.743 7.783 1.0 49.26 ? 417 PHE B CA 1 239 . B ATOM 3063 C C . PHE B 2 239 ? 8.163 39.683 6.524 1.0 48.66 ? 417 PHE B C 1 239 . B ATOM 3064 O O . PHE B 2 239 ? 9.362 39.971 6.572 1.0 59.43 ? 417 PHE B O 1 239 . B ATOM 3065 C CB . PHE B 2 239 ? 7.325 41.136 8.425 1.0 54.12 ? 417 PHE B CB 1 239 . B ATOM 3066 C CG . PHE B 2 239 ? 6.503 42.177 7.701 1.0 59.78 ? 417 PHE B CG 1 239 . B ATOM 3067 C CD1 . PHE B 2 239 ? 5.147 41.997 7.495 1.0 61.28 ? 417 PHE B CD1 1 239 . B ATOM 3068 C CD2 . PHE B 2 239 ? 7.082 43.361 7.272 1.0 66.5 ? 417 PHE B CD2 1 239 . B ATOM 3069 C CE1 . PHE B 2 239 ? 4.389 42.966 6.844 1.0 61.47 ? 417 PHE B CE1 1 239 . B ATOM 3070 C CE2 . PHE B 2 239 ? 6.331 44.334 6.625 1.0 68.29 ? 417 PHE B CE2 1 239 . B ATOM 3071 C CZ . PHE B 2 239 ? 4.981 44.138 6.417 1.0 70.22 ? 417 PHE B CZ 1 239 . B ATOM 3072 N N . MET B 2 240 ? 7.572 39.251 5.415 1.0 42.21 ? 418 MET B N 1 240 . B ATOM 3073 C CA . MET B 2 240 ? 8.339 38.954 4.209 1.0 45.57 ? 418 MET B CA 1 240 . B ATOM 3074 C C . MET B 2 240 ? 7.748 39.739 3.040 1.0 43.4 ? 418 MET B C 1 240 . B ATOM 3075 O O . MET B 2 240 ? 6.601 39.462 2.632 1.0 42.52 ? 418 MET B O 1 240 . B ATOM 3076 C CB . MET B 2 240 ? 8.334 37.446 3.925 1.0 49.84 ? 418 MET B CB 1 240 . B ATOM 3077 C CG . MET B 2 240 ? 8.946 37.028 2.590 1.0 54.05 ? 418 MET B CG 1 240 . B ATOM 3078 S SD . MET B 2 240 ? 10.736 37.278 2.473 1.0 58.25 ? 418 MET B SD 1 240 . B ATOM 3079 C CE . MET B 2 240 ? 11.297 36.294 3.860 1.0 68.15 ? 418 MET B CE 1 240 . B ATOM 3080 N N . PRO B 2 241 ? 8.468 40.719 2.495 1.0 45.2 ? 419 PRO B N 1 241 . B ATOM 3081 C CA . PRO B 2 241 ? 7.982 41.397 1.287 1.0 45.49 ? 419 PRO B CA 1 241 . B ATOM 3082 C C . PRO B 2 241 ? 7.885 40.418 0.138 1.0 42.05 ? 419 PRO B C 1 241 . B ATOM 3083 O O . PRO B 2 241 ? 8.793 39.616 -0.087 1.0 40.35 ? 419 PRO B O 1 241 . B ATOM 3084 C CB . PRO B 2 241 ? 9.054 42.463 1.012 1.0 48.55 ? 419 PRO B CB 1 241 . B ATOM 3085 C CG . PRO B 2 241 ? 9.758 42.641 2.314 1.0 60.83 ? 419 PRO B CG 1 241 . B ATOM 3086 C CD . PRO B 2 241 ? 9.739 41.285 2.969 1.0 51.78 ? 419 PRO B CD 1 241 . B ATOM 3087 N N . ARG B 2 242 ? 6.775 40.489 -0.588 1.0 51.13 ? 420 ARG B N 1 242 . B ATOM 3088 C CA . ARG B 2 242 ? 6.608 39.638 -1.752 1.0 40.47 ? 420 ARG B CA 1 242 . B ATOM 3089 C C . ARG B 2 242 ? 7.514 40.106 -2.880 1.0 46.61 ? 420 ARG B C 1 242 . B ATOM 3090 O O . ARG B 2 242 ? 8.026 41.228 -2.882 1.0 62.55 ? 420 ARG B O 1 242 . B ATOM 3091 C CB . ARG B 2 242 ? 5.140 39.603 -2.186 1.0 46.72 ? 420 ARG B CB 1 242 . B ATOM 3092 C CG . ARG B 2 242 ? 4.341 38.565 -1.384 1.0 42.35 ? 420 ARG B CG 1 242 . B ATOM 3093 C CD . ARG B 2 242 ? 2.877 38.488 -1.750 1.0 49.04 ? 420 ARG B CD 1 242 . B ATOM 3094 N NE . ARG B 2 242 ? 2.695 37.898 -3.062 1.0 36.76 ? 420 ARG B NE 1 242 . B ATOM 3095 C CZ . ARG B 2 242 ? 1.518 37.660 -3.626 1.0 45.28 ? 420 ARG B CZ 1 242 . B ATOM 3096 N NH1 . ARG B 2 242 ? 0.394 37.950 -2.982 1.0 44.57 ? 420 ARG B NH1 1 242 . B ATOM 3097 N NH2 . ARG B 2 242 ? 1.474 37.125 -4.845 1.0 39.52 ? 420 ARG B NH2 1 242 . B ATOM 3098 N N . SER B 2 243 ? 7.735 39.210 -3.834 1.0 42.7 ? 421 SER B N 1 243 . B ATOM 3099 C CA . SER B 2 243 ? 8.668 39.429 -4.927 1.0 46.69 ? 421 SER B CA 1 243 . B ATOM 3100 C C . SER B 2 243 ? 8.130 38.724 -6.154 1.0 44.41 ? 421 SER B C 1 243 . B ATOM 3101 O O . SER B 2 243 ? 7.498 37.674 -6.042 1.0 40.37 ? 421 SER B O 1 243 . B ATOM 3102 C CB . SER B 2 243 ? 10.064 38.894 -4.607 1.0 49.17 ? 421 SER B CB 1 243 . B ATOM 3103 O OG . SER B 2 243 ? 10.638 38.330 -5.773 1.0 65.79 ? 421 SER B OG 1 243 . B ATOM 3104 N N . ARG B 2 244 ? 8.378 39.310 -7.331 1.0 44.35 ? 422 ARG B N 1 244 . B ATOM 3105 C CA . ARG B 2 244 ? 7.797 38.740 -8.539 1.0 46.82 ? 422 ARG B CA 1 244 . B ATOM 3106 C C . ARG B 2 244 ? 8.260 37.311 -8.758 1.0 43.52 ? 422 ARG B C 1 244 . B ATOM 3107 O O . ARG B 2 244 ? 7.545 36.524 -9.380 1.0 46.41 ? 422 ARG B O 1 244 . B ATOM 3108 C CB . ARG B 2 244 ? 8.128 39.607 -9.759 1.0 62.98 ? 422 ARG B CB 1 244 . B ATOM 3109 C CG . ARG B 2 244 ? 7.580 41.017 -9.633 1.0 82.92 ? 422 ARG B CG 1 244 . B ATOM 3110 C CD . ARG B 2 244 ? 6.296 41.031 -8.804 1.0 94.73 ? 422 ARG B CD 1 244 . B ATOM 3111 N NE . ARG B 2 244 ? 6.189 42.234 -7.976 1.0 98.81 ? 422 ARG B NE 1 244 . B ATOM 3112 C CZ . ARG B 2 244 ? 5.428 42.332 -6.888 1.0 93.57 ? 422 ARG B CZ 1 244 . B ATOM 3113 N NH1 . ARG B 2 244 ? 4.704 41.293 -6.484 1.0 83.83 ? 422 ARG B NH1 1 244 . B ATOM 3114 N NH2 . ARG B 2 244 ? 5.399 43.466 -6.196 1.0 91.63 ? 422 ARG B NH2 1 244 . B ATOM 3115 N N . GLU B 2 245 ? 9.422 36.950 -8.230 1.0 41.78 ? 423 GLU B N 1 245 . B ATOM 3116 C CA . GLU B 2 245 ? 9.928 35.592 -8.340 1.0 41.07 ? 423 GLU B CA 1 245 . B ATOM 3117 C C . GLU B 2 245 ? 9.240 34.606 -7.397 1.0 50.49 ? 423 GLU B C 1 245 . B ATOM 3118 O O . GLU B 2 245 ? 9.509 33.406 -7.498 1.0 43.02 ? 423 GLU B O 1 245 . B ATOM 3119 C CB . GLU B 2 245 ? 11.434 35.577 -8.076 1.0 44.09 ? 423 GLU B CB 1 245 . B ATOM 3120 C CG . GLU B 2 245 ? 12.253 36.159 -9.201 1.0 79.5 ? 423 GLU B CG 1 245 . B ATOM 3121 C CD . GLU B 2 245 ? 11.841 35.603 -10.561 1.0 110.04 ? 423 GLU B CD 1 245 . B ATOM 3122 O OE1 . GLU B 2 245 ? 11.369 36.377 -11.430 1.0 114.81 ? 423 GLU B OE1 1 245 . B ATOM 3123 O OE2 . GLU B 2 245 ? 11.984 34.380 -10.757 1.0 120.72 ? 423 GLU B OE2 1 245 . B ATOM 3124 N N . ASP B 2 246 ? 8.369 35.058 -6.491 1.0 47.85 ? 424 ASP B N 1 246 . B ATOM 3125 C CA . ASP B 2 246 ? 7.678 34.117 -5.605 1.0 47.87 ? 424 ASP B CA 1 246 . B ATOM 3126 C C . ASP B 2 246 ? 6.857 33.123 -6.423 1.0 45.17 ? 424 ASP B C 1 246 . B ATOM 3127 O O . ASP B 2 246 ? 6.149 33.499 -7.362 1.0 40.47 ? 424 ASP B O 1 246 . B ATOM 3128 C CB . ASP B 2 246 ? 6.770 34.858 -4.619 1.0 48.29 ? 424 ASP B CB 1 246 . B ATOM 3129 C CG . ASP B 2 246 ? 7.546 35.705 -3.611 1.0 48.07 ? 424 ASP B CG 1 246 . B ATOM 3130 O OD1 . ASP B 2 246 ? 8.770 35.511 -3.446 1.0 46.28 ? 424 ASP B OD1 1 246 . B ATOM 3131 O OD2 . ASP B 2 246 ? 6.917 36.565 -2.966 1.0 56.64 ? 424 ASP B OD2 1 246 . B ATOM 3132 N N . GLU B 2 247 ? 6.956 31.846 -6.060 1.0 33.7 ? 425 GLU B N 1 247 . B ATOM 3133 C CA . GLU B 2 247 ? 6.259 30.780 -6.764 1.0 27.74 ? 425 GLU B CA 1 247 . B ATOM 3134 C C . GLU B 2 247 ? 5.047 30.264 -5.999 1.0 42.54 ? 425 GLU B C 1 247 . B ATOM 3135 O O . GLU B 2 247 ? 3.927 30.274 -6.533 1.0 36.4 ? 425 GLU B O 1 247 . B ATOM 3136 C CB . GLU B 2 247 ? 7.232 29.631 -7.049 1.0 32.06 ? 425 GLU B CB 1 247 . B ATOM 3137 C CG . GLU B 2 247 ? 8.285 29.943 -8.095 1.0 39.64 ? 425 GLU B CG 1 247 . B ATOM 3138 C CD . GLU B 2 247 ? 7.786 29.729 -9.533 1.0 47.87 ? 425 GLU B CD 1 247 . B ATOM 3139 O OE1 . GLU B 2 247 ? 8.598 29.904 -10.463 1.0 55.95 ? 425 GLU B OE1 1 247 . B ATOM 3140 O OE2 . GLU B 2 247 ? 6.599 29.389 -9.731 1.0 45.98 ? 425 GLU B OE2 1 247 . B ATOM 3141 N N . CYS B 2 248 ? 5.249 29.819 -4.751 1.0 33.87 ? 426 CYS B N 1 248 . B ATOM 3142 C CA . CYS B 2 248 ? 4.166 29.295 -3.934 1.0 34.63 ? 426 CYS B CA 1 248 . B ATOM 3143 C C . CYS B 2 248 ? 4.559 29.322 -2.461 1.0 33.74 ? 426 CYS B C 1 248 . B ATOM 3144 O O . CYS B 2 248 ? 5.732 29.408 -2.100 1.0 33.76 ? 426 CYS B O 1 248 . B ATOM 3145 C CB . CYS B 2 248 ? 3.790 27.870 -4.338 1.0 42.86 ? 426 CYS B CB 1 248 . B ATOM 3146 S SG . CYS B 2 248 ? 5.207 26.818 -4.353 1.0 48.07 ? 426 CYS B SG 1 248 . B ATOM 3147 N N . LEU B 2 249 ? 3.545 29.247 -1.624 1.0 30.56 ? 427 LEU B N 1 249 . B ATOM 3148 C CA . LEU B 2 249 ? 3.703 29.168 -0.182 1.0 31.55 ? 427 LEU B CA 1 249 . B ATOM 3149 C C . LEU B 2 249 ? 3.017 27.893 0.281 1.0 30.12 ? 427 LEU B C 1 249 . B ATOM 3150 O O . LEU B 2 249 ? 1.892 27.607 -0.133 1.0 30.35 ? 427 LEU B O 1 249 . B ATOM 3151 C CB . LEU B 2 249 ? 3.097 30.417 0.508 1.0 25.92 ? 427 LEU B CB 1 249 . B ATOM 3152 C CG . LEU B 2 249 ? 3.053 30.459 2.051 1.0 34.71 ? 427 LEU B CG 1 249 . B ATOM 3153 C CD1 . LEU B 2 249 ? 4.436 30.333 2.629 1.0 26.64 ? 427 LEU B CD1 1 249 . B ATOM 3154 C CD2 . LEU B 2 249 ? 2.389 31.748 2.529 1.0 48.45 ? 427 LEU B CD2 1 249 . B ATOM 3155 N N . ILE B 2 250 ? 3.698 27.115 1.119 1.0 23.81 ? 428 ILE B N 1 250 . B ATOM 3156 C CA . ILE B 2 250 ? 3.157 25.858 1.616 1.0 24.24 ? 428 ILE B CA 1 250 . B ATOM 3157 C C . ILE B 2 250 ? 3.116 25.947 3.137 1.0 27.82 ? 428 ILE B C 1 250 . B ATOM 3158 O O . ILE B 2 250 ? 4.138 26.253 3.763 1.0 36.8 ? 428 ILE B O 1 250 . B ATOM 3159 C CB . ILE B 2 250 ? 4.006 24.650 1.188 1.0 29.49 ? 428 ILE B CB 1 250 . B ATOM 3160 C CG1 . ILE B 2 250 ? 4.413 24.730 -0.292 1.0 44.09 ? 428 ILE B CG1 1 250 . B ATOM 3161 C CG2 . ILE B 2 250 ? 3.233 23.347 1.500 1.0 34.03 ? 428 ILE B CG2 1 250 . B ATOM 3162 C CD1 . ILE B 2 250 ? 3.405 24.141 -1.210 1.0 40.04 ? 428 ILE B CD1 1 250 . B ATOM 3163 N N . LEU B 2 251 ? 1.935 25.730 3.714 1.0 26.23 ? 429 LEU B N 1 251 . B ATOM 3164 C CA . LEU B 2 251 ? 1.773 25.492 5.147 1.0 26.19 ? 429 LEU B CA 1 251 . B ATOM 3165 C C . LEU B 2 251 ? 1.433 24.033 5.351 1.0 31.93 ? 429 LEU B C 1 251 . B ATOM 3166 O O . LEU B 2 251 ? 0.559 23.495 4.663 1.0 37.13 ? 429 LEU B O 1 251 . B ATOM 3167 C CB . LEU B 2 251 ? 0.646 26.309 5.767 1.0 33.24 ? 429 LEU B CB 1 251 . B ATOM 3168 C CG . LEU B 2 251 ? 0.567 27.822 5.695 1.0 35.81 ? 429 LEU B CG 1 251 . B ATOM 3169 C CD1 . LEU B 2 251 ? -0.081 28.313 6.955 1.0 31.74 ? 429 LEU B CD1 1 251 . B ATOM 3170 C CD2 . LEU B 2 251 ? 1.936 28.401 5.508 1.0 50.31 ? 429 LEU B CD2 1 251 . B ATOM 3171 N N . ALA B 2 252 ? 2.078 23.394 6.326 1.0 32.23 ? 430 ALA B N 1 252 . B ATOM 3172 C CA . ALA B 2 252 ? 1.696 22.013 6.551 1.0 29.35 ? 430 ALA B CA 1 252 . B ATOM 3173 C C . ALA B 2 252 ? 2.088 21.576 7.955 1.0 29.72 ? 430 ALA B C 1 252 . B ATOM 3174 O O . ALA B 2 252 ? 2.986 22.146 8.583 1.0 35.33 ? 430 ALA B O 1 252 . B ATOM 3175 C CB . ALA B 2 252 ? 2.329 21.096 5.509 1.0 28.98 ? 430 ALA B CB 1 252 . B ATOM 3176 N N . SER B 2 253 ? 1.415 20.531 8.419 1.0 28.51 ? 431 SER B N 1 253 . B ATOM 3177 C CA . SER B 2 253 ? 1.789 19.875 9.662 1.0 36.27 ? 431 SER B CA 1 253 . B ATOM 3178 C C . SER B 2 253 ? 2.992 18.970 9.429 1.0 49.56 ? 431 SER B C 1 253 . B ATOM 3179 O O . SER B 2 253 ? 3.353 18.644 8.290 1.0 34.47 ? 431 SER B O 1 253 . B ATOM 3180 C CB . SER B 2 253 ? 0.619 19.080 10.214 1.0 34.88 ? 431 SER B CB 1 253 . B ATOM 3181 O OG . SER B 2 253 ? 0.201 18.057 9.306 1.0 36.98 ? 431 SER B OG 1 253 . B ATOM 3182 N N . ASP B 2 254 ? 3.618 18.553 10.529 1.0 38.33 ? 432 ASP B N 1 254 . B ATOM 3183 C CA . ASP B 2 254 ? 4.792 17.704 10.423 1.0 25.13 ? 432 ASP B CA 1 254 . B ATOM 3184 C C . ASP B 2 254 ? 4.480 16.342 9.814 1.0 27.63 ? 432 ASP B C 1 254 . B ATOM 3185 O O . ASP B 2 254 ? 5.409 15.607 9.467 1.0 40.94 ? 432 ASP B O 1 254 . B ATOM 3186 C CB . ASP B 2 254 ? 5.460 17.542 11.806 1.0 32.15 ? 432 ASP B CB 1 254 . B ATOM 3187 C CG . ASP B 2 254 ? 4.534 16.927 12.867 1.0 42.34 ? 432 ASP B CG 1 254 . B ATOM 3188 O OD1 . ASP B 2 254 ? 3.381 16.556 12.564 1.0 54.25 ? 432 ASP B OD1 1 254 . B ATOM 3189 O OD2 . ASP B 2 254 ? 5.004 16.798 14.025 1.0 55.66 ? 432 ASP B OD2 1 254 . B ATOM 3190 N N . GLY B 2 255 ? 3.217 15.988 9.644 1.0 30.17 ? 433 GLY B N 1 255 . B ATOM 3191 C CA . GLY B 2 255 ? 2.932 14.771 8.914 1.0 33.82 ? 433 GLY B CA 1 255 . B ATOM 3192 C C . GLY B 2 255 ? 3.571 14.771 7.539 1.0 36.46 ? 433 GLY B C 1 255 . B ATOM 3193 O O . GLY B 2 255 ? 3.848 13.709 6.975 1.0 36.03 ? 433 GLY B O 1 255 . B ATOM 3194 N N . LEU B 2 256 ? 3.834 15.958 6.997 1.0 33.85 ? 434 LEU B N 1 256 . B ATOM 3195 C CA . LEU B 2 256 ? 4.464 16.113 5.689 1.0 36.48 ? 434 LEU B CA 1 256 . B ATOM 3196 C C . LEU B 2 256 ? 5.977 16.274 5.819 1.0 31.76 ? 434 LEU B C 1 256 . B ATOM 3197 O O . LEU B 2 256 ? 6.751 15.524 5.214 1.0 38.0 ? 434 LEU B O 1 256 . B ATOM 3198 C CB . LEU B 2 256 ? 3.851 17.324 4.961 1.0 32.16 ? 434 LEU B CB 1 256 . B ATOM 3199 C CG . LEU B 2 256 ? 4.568 17.669 3.653 1.0 32.64 ? 434 LEU B CG 1 256 . B ATOM 3200 C CD1 . LEU B 2 256 ? 4.324 16.555 2.645 1.0 30.59 ? 434 LEU B CD1 1 256 . B ATOM 3201 C CD2 . LEU B 2 256 ? 4.136 19.018 3.087 1.0 33.45 ? 434 LEU B CD2 1 256 . B ATOM 3202 N N . TRP B 2 257 ? 6.407 17.231 6.640 1.0 28.97 ? 435 TRP B N 1 257 . B ATOM 3203 C CA . TRP B 2 257 ? 7.827 17.541 6.766 1.0 33.36 ? 435 TRP B CA 1 257 . B ATOM 3204 C C . TRP B 2 257 ? 8.651 16.391 7.349 1.0 33.8 ? 435 TRP B C 1 257 . B ATOM 3205 O O . TRP B 2 257 ? 9.866 16.362 7.133 1.0 35.21 ? 435 TRP B O 1 257 . B ATOM 3206 C CB . TRP B 2 257 ? 8.008 18.792 7.630 1.0 33.34 ? 435 TRP B CB 1 257 . B ATOM 3207 C CG . TRP B 2 257 ? 7.118 19.936 7.227 1.0 40.97 ? 435 TRP B CG 1 257 . B ATOM 3208 C CD1 . TRP B 2 257 ? 6.133 20.505 7.971 1.0 40.2 ? 435 TRP B CD1 1 257 . B ATOM 3209 C CD2 . TRP B 2 257 ? 7.145 20.654 5.983 1.0 31.68 ? 435 TRP B CD2 1 257 . B ATOM 3210 N NE1 . TRP B 2 257 ? 5.545 21.537 7.270 1.0 38.23 ? 435 TRP B NE1 1 257 . B ATOM 3211 C CE2 . TRP B 2 257 ? 6.150 21.643 6.048 1.0 32.05 ? 435 TRP B CE2 1 257 . B ATOM 3212 C CE3 . TRP B 2 257 ? 7.914 20.547 4.820 1.0 37.02 ? 435 TRP B CE3 1 257 . B ATOM 3213 C CZ2 . TRP B 2 257 ? 5.890 22.518 4.985 1.0 42.49 ? 435 TRP B CZ2 1 257 . B ATOM 3214 C CZ3 . TRP B 2 257 ? 7.657 21.418 3.765 1.0 35.88 ? 435 TRP B CZ3 1 257 . B ATOM 3215 C CH2 . TRP B 2 257 ? 6.661 22.390 3.857 1.0 30.46 ? 435 TRP B CH2 1 257 . B ATOM 3216 N N . ASP B 2 258 ? 8.036 15.464 8.106 1.0 37.32 ? 436 ASP B N 1 258 . B ATOM 3217 C CA . ASP B 2 258 ? 8.802 14.344 8.662 1.0 47.4 ? 436 ASP B CA 1 258 . B ATOM 3218 C C . ASP B 2 258 ? 9.402 13.470 7.573 1.0 45.79 ? 436 ASP B C 1 258 . B ATOM 3219 O O . ASP B 2 258 ? 10.467 12.874 7.773 1.0 48.13 ? 436 ASP B O 1 258 . B ATOM 3220 C CB . ASP B 2 258 ? 7.931 13.460 9.555 1.0 50.61 ? 436 ASP B CB 1 258 . B ATOM 3221 C CG . ASP B 2 258 ? 7.650 14.075 10.910 1.0 47.02 ? 436 ASP B CG 1 258 . B ATOM 3222 O OD1 . ASP B 2 258 ? 8.414 14.968 11.347 1.0 52.32 ? 436 ASP B OD1 1 258 . B ATOM 3223 O OD2 . ASP B 2 258 ? 6.650 13.659 11.531 1.0 54.94 ? 436 ASP B OD2 1 258 . B ATOM 3224 N N . VAL B 2 259 ? 8.735 13.368 6.426 1.0 35.61 ? 437 VAL B N 1 259 . B ATOM 3225 C CA . VAL B 2 259 ? 9.146 12.440 5.382 1.0 39.29 ? 437 VAL B CA 1 259 . B ATOM 3226 C C . VAL B 2 259 ? 9.594 13.139 4.109 1.0 45.68 ? 437 VAL B C 1 259 . B ATOM 3227 O O . VAL B 2 259 ? 10.063 12.460 3.182 1.0 41.8 ? 437 VAL B O 1 259 . B ATOM 3228 C CB . VAL B 2 259 ? 8.027 11.423 5.068 1.0 42.23 ? 437 VAL B CB 1 259 . B ATOM 3229 C CG1 . VAL B 2 259 ? 7.664 10.664 6.333 1.0 43.63 ? 437 VAL B CG1 1 259 . B ATOM 3230 C CG2 . VAL B 2 259 ? 6.807 12.117 4.496 1.0 34.47 ? 437 VAL B CG2 1 259 . B ATOM 3231 N N . MET B 2 260 ? 9.515 14.465 4.040 1.0 31.33 ? 438 MET B N 1 260 . B ATOM 3232 C CA . MET B 2 260 ? 9.844 15.176 2.820 1.0 41.21 ? 438 MET B CA 1 260 . B ATOM 3233 C C . MET B 2 260 ? 10.548 16.488 3.141 1.0 39.5 ? 438 MET B C 1 260 . B ATOM 3234 O O . MET B 2 260 ? 10.179 17.212 4.062 1.0 41.28 ? 438 MET B O 1 260 . B ATOM 3235 C CB . MET B 2 260 ? 8.593 15.451 1.968 1.0 30.58 ? 438 MET B CB 1 260 . B ATOM 3236 C CG . MET B 2 260 ? 8.038 14.209 1.274 1.0 53.74 ? 438 MET B CG 1 260 . B ATOM 3237 S SD . MET B 2 260 ? 6.919 14.667 -0.058 1.0 51.95 ? 438 MET B SD 1 260 . B ATOM 3238 C CE . MET B 2 260 ? 8.082 15.520 -1.126 1.0 49.34 ? 438 MET B CE 1 260 . B ATOM 3239 N N . ASN B 2 261 ? 11.513 16.804 2.301 1.0 44.07 ? 439 ASN B N 1 261 . B ATOM 3240 C CA . ASN B 2 261 ? 12.427 17.915 2.451 1.0 51.8 ? 439 ASN B CA 1 261 . B ATOM 3241 C C . ASN B 2 261 ? 11.813 19.215 1.892 1.0 44.75 ? 439 ASN B C 1 261 . B ATOM 3242 O O . ASN B 2 261 ? 10.995 19.186 0.971 1.0 44.76 ? 439 ASN B O 1 261 . B ATOM 3243 C CB . ASN B 2 261 ? 13.715 17.478 1.747 1.0 52.07 ? 439 ASN B CB 1 261 . B ATOM 3244 C CG . ASN B 2 261 ? 14.493 18.592 1.189 1.0 62.7 ? 439 ASN B CG 1 261 . B ATOM 3245 O OD1 . ASN B 2 261 ? 14.214 19.059 0.084 1.0 50.78 ? 439 ASN B OD1 1 261 . B ATOM 3246 N ND2 . ASN B 2 261 ? 15.524 19.012 1.917 1.0 63.99 ? 439 ASN B ND2 1 261 . B ATOM 3247 N N . ASN B 2 262 ? 12.165 20.353 2.508 1.0 35.64 ? 440 ASN B N 1 262 . B ATOM 3248 C CA . ASN B 2 262 ? 11.570 21.644 2.129 1.0 34.73 ? 440 ASN B CA 1 262 . B ATOM 3249 C C . ASN B 2 262 ? 11.708 21.900 0.633 1.0 36.91 ? 440 ASN B C 1 262 . B ATOM 3250 O O . ASN B 2 262 ? 10.755 22.298 -0.047 1.0 29.3 ? 440 ASN B O 1 262 . B ATOM 3251 C CB . ASN B 2 262 ? 12.238 22.815 2.860 1.0 30.05 ? 440 ASN B CB 1 262 . B ATOM 3252 C CG . ASN B 2 262 ? 11.885 22.888 4.344 1.0 42.81 ? 440 ASN B CG 1 262 . B ATOM 3253 O OD1 . ASN B 2 262 ? 10.930 22.268 4.808 1.0 47.1 ? 440 ASN B OD1 1 262 . B ATOM 3254 N ND2 . ASN B 2 262 ? 12.651 23.681 5.084 1.0 44.23 ? 440 ASN B ND2 1 262 . B ATOM 3255 N N . GLN B 2 263 ? 12.930 21.773 0.129 1.0 30.74 ? 441 GLN B N 1 263 . B ATOM 3256 C CA . GLN B 2 263 ? 13.167 22.059 -1.278 1.0 35.7 ? 441 GLN B CA 1 263 . B ATOM 3257 C C . GLN B 2 263 ? 12.332 21.139 -2.164 1.0 36.46 ? 441 GLN B C 1 263 . B ATOM 3258 O O . GLN B 2 263 ? 11.728 21.585 -3.146 1.0 35.32 ? 441 GLN B O 1 263 . B ATOM 3259 C CB . GLN B 2 263 ? 14.655 21.927 -1.584 1.0 33.16 ? 441 GLN B CB 1 263 . B ATOM 3260 C CG . GLN B 2 263 ? 14.991 22.223 -3.011 1.0 43.38 ? 441 GLN B CG 1 263 . B ATOM 3261 C CD . GLN B 2 263 ? 15.161 23.707 -3.273 1.0 48.14 ? 441 GLN B CD 1 263 . B ATOM 3262 O OE1 . GLN B 2 263 ? 15.378 24.505 -2.345 1.0 38.51 ? 441 GLN B OE1 1 263 . B ATOM 3263 N NE2 . GLN B 2 263 ? 15.070 24.086 -4.538 1.0 37.25 ? 441 GLN B NE2 1 263 . B ATOM 3264 N N . GLU B 2 264 ? 12.251 19.848 -1.806 1.0 34.27 ? 442 GLU B N 1 264 . B ATOM 3265 C CA . GLU B 2 264 ? 11.509 18.889 -2.625 1.0 36.99 ? 442 GLU B CA 1 264 . B ATOM 3266 C C . GLU B 2 264 ? 10.008 19.159 -2.599 1.0 38.54 ? 442 GLU B C 1 264 . B ATOM 3267 O O . GLU B 2 264 ? 9.330 19.053 -3.634 1.0 38.77 ? 442 GLU B O 1 264 . B ATOM 3268 C CB . GLU B 2 264 ? 11.798 17.453 -2.171 1.0 47.57 ? 442 GLU B CB 1 264 . B ATOM 3269 C CG . GLU B 2 264 ? 10.967 16.422 -2.936 1.0 57.06 ? 442 GLU B CG 1 264 . B ATOM 3270 C CD . GLU B 2 264 ? 11.666 15.081 -3.131 1.0 69.33 ? 442 GLU B CD 1 264 . B ATOM 3271 O OE1 . GLU B 2 264 ? 11.342 14.391 -4.122 1.0 81.64 ? 442 GLU B OE1 1 264 . B ATOM 3272 O OE2 . GLU B 2 264 ? 12.534 14.711 -2.316 1.0 60.9 ? 442 GLU B OE2 1 264 . B ATOM 3273 N N . VAL B 2 265 ? 9.468 19.518 -1.434 1.0 33.79 ? 443 VAL B N 1 265 . B ATOM 3274 C CA . VAL B 2 265 ? 8.044 19.833 -1.339 1.0 37.29 ? 443 VAL B CA 1 265 . B ATOM 3275 C C . VAL B 2 265 ? 7.694 21.010 -2.249 1.0 37.45 ? 443 VAL B C 1 265 . B ATOM 3276 O O . VAL B 2 265 ? 6.711 20.973 -3.003 1.0 35.3 ? 443 VAL B O 1 265 . B ATOM 3277 C CB . VAL B 2 265 ? 7.662 20.124 0.122 1.0 31.66 ? 443 VAL B CB 1 265 . B ATOM 3278 C CG1 . VAL B 2 265 ? 6.235 20.610 0.191 1.0 36.06 ? 443 VAL B CG1 1 265 . B ATOM 3279 C CG2 . VAL B 2 265 ? 7.859 18.884 0.987 1.0 42.15 ? 443 VAL B CG2 1 265 . B ATOM 3280 N N . CYS B 2 266 ? 8.481 22.086 -2.167 1.0 32.53 ? 444 CYS B N 1 266 . B ATOM 3281 C CA . CYS B 2 266 ? 8.217 23.280 -2.966 1.0 33.76 ? 444 CYS B CA 1 266 . B ATOM 3282 C C . CYS B 2 266 ? 8.276 22.985 -4.459 1.0 30.15 ? 444 CYS B C 1 266 . B ATOM 3283 O O . CYS B 2 266 ? 7.396 23.413 -5.217 1.0 33.0 ? 444 CYS B O 1 266 . B ATOM 3284 C CB . CYS B 2 266 ? 9.216 24.376 -2.613 1.0 41.08 ? 444 CYS B CB 1 266 . B ATOM 3285 S SG . CYS B 2 266 ? 8.866 25.205 -1.041 1.0 50.9 ? 444 CYS B SG 1 266 . B ATOM 3286 N N . GLU B 2 267 ? 9.330 22.303 -4.909 1.0 30.84 ? 445 GLU B N 1 267 . B ATOM 3287 C CA . GLU B 2 267 ? 9.458 22.030 -6.345 1.0 44.18 ? 445 GLU B CA 1 267 . B ATOM 3288 C C . GLU B 2 267 ? 8.327 21.127 -6.816 1.0 42.45 ? 445 GLU B C 1 267 . B ATOM 3289 O O . GLU B 2 267 ? 7.772 21.327 -7.903 1.0 40.65 ? 445 GLU B O 1 267 . B ATOM 3290 C CB . GLU B 2 267 ? 10.822 21.397 -6.666 1.0 35.84 ? 445 GLU B CB 1 267 . B ATOM 3291 C CG . GLU B 2 267 ? 12.025 22.272 -6.332 1.0 42.04 ? 445 GLU B CG 1 267 . B ATOM 3292 C CD . GLU B 2 267 ? 13.339 21.509 -6.372 1.0 49.26 ? 445 GLU B CD 1 267 . B ATOM 3293 O OE1 . GLU B 2 267 ? 13.307 20.259 -6.393 1.0 47.18 ? 445 GLU B OE1 1 267 . B ATOM 3294 O OE2 . GLU B 2 267 ? 14.409 22.152 -6.393 1.0 47.26 ? 445 GLU B OE2 1 267 . B ATOM 3295 N N . ILE B 2 268 ? 7.938 20.144 -5.988 1.0 32.87 ? 446 ILE B N 1 268 . B ATOM 3296 C CA . ILE B 2 268 ? 6.861 19.239 -6.395 1.0 28.49 ? 446 ILE B CA 1 268 . B ATOM 3297 C C . ILE B 2 268 ? 5.555 20.005 -6.534 1.0 35.46 ? 446 ILE B C 1 268 . B ATOM 3298 O O . ILE B 2 268 ? 4.824 19.858 -7.525 1.0 38.16 ? 446 ILE B O 1 268 . B ATOM 3299 C CB . ILE B 2 268 ? 6.709 18.062 -5.416 1.0 31.84 ? 446 ILE B CB 1 268 . B ATOM 3300 C CG1 . ILE B 2 268 ? 7.808 17.027 -5.635 1.0 35.98 ? 446 ILE B CG1 1 268 . B ATOM 3301 C CG2 . ILE B 2 268 ? 5.356 17.422 -5.613 1.0 31.71 ? 446 ILE B CG2 1 268 . B ATOM 3302 C CD1 . ILE B 2 268 ? 7.942 16.003 -4.461 1.0 41.64 ? 446 ILE B CD1 1 268 . B ATOM 3303 N N . ALA B 2 269 ? 5.242 20.845 -5.546 1.0 32.69 ? 447 ALA B N 1 269 . B ATOM 3304 C CA . ALA B 2 269 ? 4.051 21.668 -5.658 1.0 23.04 ? 447 ALA B CA 1 269 . B ATOM 3305 C C . ALA B 2 269 ? 4.096 22.494 -6.942 1.0 26.23 ? 447 ALA B C 1 269 . B ATOM 3306 O O . ALA B 2 269 ? 3.115 22.553 -7.686 1.0 34.12 ? 447 ALA B O 1 269 . B ATOM 3307 C CB . ALA B 2 269 ? 3.909 22.577 -4.436 1.0 27.67 ? 447 ALA B CB 1 269 . B ATOM 3308 N N . ARG B 2 270 ? 5.232 23.136 -7.219 1.0 33.8 ? 448 ARG B N 1 270 . B ATOM 3309 C CA . ARG B 2 270 ? 5.315 23.983 -8.408 1.0 34.1 ? 448 ARG B CA 1 270 . B ATOM 3310 C C . ARG B 2 270 ? 5.156 23.160 -9.678 1.0 36.02 ? 448 ARG B C 1 270 . B ATOM 3311 O O . ARG B 2 270 ? 4.395 23.527 -10.574 1.0 40.13 ? 448 ARG B O 1 270 . B ATOM 3312 C CB . ARG B 2 270 ? 6.634 24.759 -8.438 1.0 34.33 ? 448 ARG B CB 1 270 . B ATOM 3313 C CG . ARG B 2 270 ? 6.783 25.646 -9.722 1.0 32.26 ? 448 ARG B CG 1 270 . B ATOM 3314 C CD . ARG B 2 270 ? 8.162 26.256 -9.848 1.0 32.53 ? 448 ARG B CD 1 270 . B ATOM 3315 N NE . ARG B 2 270 ? 8.366 26.871 -11.161 1.0 41.99 ? 448 ARG B NE 1 270 . B ATOM 3316 C CZ . ARG B 2 270 ? 9.000 26.277 -12.168 1.0 45.98 ? 448 ARG B CZ 1 270 . B ATOM 3317 N NH1 . ARG B 2 270 ? 9.527 25.065 -12.013 1.0 35.6 ? 448 ARG B NH1 1 270 . B ATOM 3318 N NH2 . ARG B 2 270 ? 9.127 26.910 -13.326 1.0 45.73 ? 448 ARG B NH2 1 270 . B ATOM 3319 N N . ARG B 2 271 ? 5.860 22.035 -9.761 1.0 35.87 ? 449 ARG B N 1 271 . B ATOM 3320 C CA . ARG B 2 271 ? 5.780 21.162 -10.926 1.0 35.58 ? 449 ARG B CA 1 271 . B ATOM 3321 C C . ARG B 2 271 ? 4.346 20.665 -11.163 1.0 47.15 ? 449 ARG B C 1 271 . B ATOM 3322 O O . ARG B 2 271 ? 3.859 20.657 -12.306 1.0 37.61 ? 449 ARG B O 1 271 . B ATOM 3323 C CB . ARG B 2 271 ? 6.782 20.020 -10.696 1.0 39.2 ? 449 ARG B CB 1 271 . B ATOM 3324 C CG . ARG B 2 271 ? 6.949 18.984 -11.769 1.0 54.01 ? 449 ARG B CG 1 271 . B ATOM 3325 C CD . ARG B 2 271 ? 7.983 17.979 -11.277 1.0 55.61 ? 449 ARG B CD 1 271 . B ATOM 3326 N NE . ARG B 2 271 ? 9.166 18.663 -10.762 1.0 42.59 ? 449 ARG B NE 1 271 . B ATOM 3327 C CZ . ARG B 2 271 ? 9.893 18.252 -9.723 1.0 47.05 ? 449 ARG B CZ 1 271 . B ATOM 3328 N NH1 . ARG B 2 271 ? 9.567 17.158 -9.045 1.0 40.2 ? 449 ARG B NH1 1 271 . B ATOM 3329 N NH2 . ARG B 2 271 ? 10.945 18.953 -9.339 1.0 47.47 ? 449 ARG B NH2 1 271 . B ATOM 3330 N N . ARG B 2 272 ? 3.643 20.277 -10.088 1.0 32.53 ? 450 ARG B N 1 272 . B ATOM 3331 C CA . ARG B 2 272 ? 2.257 19.825 -10.184 1.0 29.14 ? 450 ARG B CA 1 272 . B ATOM 3332 C C . ARG B 2 272 ? 1.299 20.944 -10.558 1.0 34.16 ? 450 ARG B C 1 272 . B ATOM 3333 O O . ARG B 2 272 ? 0.303 20.701 -11.253 1.0 43.84 ? 450 ARG B O 1 272 . B ATOM 3334 C CB . ARG B 2 272 ? 1.797 19.209 -8.858 1.0 33.34 ? 450 ARG B CB 1 272 . B ATOM 3335 C CG . ARG B 2 272 ? 2.348 17.820 -8.627 1.0 53.05 ? 450 ARG B CG 1 272 . B ATOM 3336 C CD . ARG B 2 272 ? 1.880 16.858 -9.715 1.0 48.83 ? 450 ARG B CD 1 272 . B ATOM 3337 N NE . ARG B 2 272 ? 2.941 15.925 -10.059 1.0 62.04 ? 450 ARG B NE 1 272 . B ATOM 3338 C CZ . ARG B 2 272 ? 2.735 14.711 -10.548 1.0 65.42 ? 450 ARG B CZ 1 272 . B ATOM 3339 N NH1 . ARG B 2 272 ? 1.499 14.279 -10.736 1.0 58.1 ? 450 ARG B NH1 1 272 . B ATOM 3340 N NH2 . ARG B 2 272 ? 3.764 13.929 -10.836 1.0 79.07 ? 450 ARG B NH2 1 272 . B ATOM 3341 N N . ILE B 2 273 ? 1.543 22.155 -10.078 1.0 32.81 ? 451 ILE B N 1 273 . B ATOM 3342 C CA . ILE B 2 273 ? 0.724 23.265 -10.538 1.0 35.04 ? 451 ILE B CA 1 273 . B ATOM 3343 C C . ILE B 2 273 ? 0.905 23.459 -12.040 1.0 31.74 ? 451 ILE B C 1 273 . B ATOM 3344 O O . ILE B 2 273 ? -0.072 23.541 -12.787 1.0 37.94 ? 451 ILE B O 1 273 . B ATOM 3345 C CB . ILE B 2 273 ? 1.063 24.542 -9.762 1.0 39.86 ? 451 ILE B CB 1 273 . B ATOM 3346 C CG1 . ILE B 2 273 ? 0.524 24.433 -8.340 1.0 35.33 ? 451 ILE B CG1 1 273 . B ATOM 3347 C CG2 . ILE B 2 273 ? 0.473 25.751 -10.484 1.0 36.63 ? 451 ILE B CG2 1 273 . B ATOM 3348 C CD1 . ILE B 2 273 ? 1.126 25.433 -7.404 1.0 33.73 ? 451 ILE B CD1 1 273 . B ATOM 3349 N N . LEU B 2 274 ? 2.156 23.499 -12.503 1.0 32.29 ? 452 LEU B N 1 274 . B ATOM 3350 C CA . LEU B 2 274 ? 2.413 23.707 -13.927 1.0 35.93 ? 452 LEU B CA 1 274 . B ATOM 3351 C C . LEU B 2 274 ? 1.855 22.561 -14.756 1.0 34.33 ? 452 LEU B C 1 274 . B ATOM 3352 O O . LEU B 2 274 ? 1.220 22.789 -15.785 1.0 42.83 ? 452 LEU B O 1 274 . B ATOM 3353 C CB . LEU B 2 274 ? 3.906 23.870 -14.180 1.0 39.82 ? 452 LEU B CB 1 274 . B ATOM 3354 C CG . LEU B 2 274 ? 4.549 25.125 -13.603 1.0 45.32 ? 452 LEU B CG 1 274 . B ATOM 3355 C CD1 . LEU B 2 274 ? 6.047 25.020 -13.781 1.0 45.46 ? 452 LEU B CD1 1 274 . B ATOM 3356 C CD2 . LEU B 2 274 ? 4.005 26.371 -14.276 1.0 43.05 ? 452 LEU B CD2 1 274 . B ATOM 3357 N N . MET B 2 275 ? 2.073 21.320 -14.317 1.0 38.35 ? 453 MET B N 1 275 . B ATOM 3358 C CA . MET B 2 275 ? 1.475 20.173 -14.998 1.0 46.31 ? 453 MET B CA 1 275 . B ATOM 3359 C C . MET B 2 275 ? -0.030 20.355 -15.193 1.0 52.23 ? 453 MET B C 1 275 . B ATOM 3360 O O . MET B 2 275 ? -0.569 20.058 -16.266 1.0 45.44 ? 453 MET B O 1 275 . B ATOM 3361 C CB . MET B 2 275 ? 1.769 18.895 -14.210 1.0 45.07 ? 453 MET B CB 1 275 . B ATOM 3362 C CG . MET B 2 275 ? 1.621 17.592 -14.973 1.0 57.73 ? 453 MET B CG 1 275 . B ATOM 3363 S SD . MET B 2 275 ? 1.845 16.161 -13.875 1.0 69.43 ? 453 MET B SD 1 275 . B ATOM 3364 C CE . MET B 2 275 ? 3.420 16.572 -13.106 1.0 58.46 ? 453 MET B CE 1 275 . B ATOM 3365 N N . TRP B 2 276 ? -0.733 20.857 -14.177 1.0 39.49 ? 454 TRP B N 1 276 . B ATOM 3366 C CA . TRP B 2 276 ? -2.179 21.026 -14.323 1.0 39.43 ? 454 TRP B CA 1 276 . B ATOM 3367 C C . TRP B 2 276 ? -2.517 22.084 -15.373 1.0 45.82 ? 454 TRP B C 1 276 . B ATOM 3368 O O . TRP B 2 276 ? -3.452 21.916 -16.170 1.0 38.64 ? 454 TRP B O 1 276 . B ATOM 3369 C CB . TRP B 2 276 ? -2.819 21.397 -12.985 1.0 39.76 ? 454 TRP B CB 1 276 . B ATOM 3370 C CG . TRP B 2 276 ? -4.314 21.393 -13.090 1.0 40.08 ? 454 TRP B CG 1 276 . B ATOM 3371 C CD1 . TRP B 2 276 ? -5.144 20.339 -12.847 1.0 43.99 ? 454 TRP B CD1 1 276 . B ATOM 3372 C CD2 . TRP B 2 276 ? -5.155 22.483 -13.506 1.0 38.66 ? 454 TRP B CD2 1 276 . B ATOM 3373 N NE1 . TRP B 2 276 ? -6.449 20.708 -13.068 1.0 47.04 ? 454 TRP B NE1 1 276 . B ATOM 3374 C CE2 . TRP B 2 276 ? -6.481 22.021 -13.469 1.0 38.41 ? 454 TRP B CE2 1 276 . B ATOM 3375 C CE3 . TRP B 2 276 ? -4.912 23.809 -13.892 1.0 49.52 ? 454 TRP B CE3 1 276 . B ATOM 3376 C CZ2 . TRP B 2 276 ? -7.564 22.831 -13.810 1.0 45.24 ? 454 TRP B CZ2 1 276 . B ATOM 3377 C CZ3 . TRP B 2 276 ? -5.996 24.618 -14.234 1.0 47.0 ? 454 TRP B CZ3 1 276 . B ATOM 3378 C CH2 . TRP B 2 276 ? -7.303 24.122 -14.189 1.0 47.93 ? 454 TRP B CH2 1 276 . B ATOM 3379 N N . HIS B 2 277 ? -1.809 23.213 -15.356 1.0 36.77 ? 455 HIS B N 1 277 . B ATOM 3380 C CA . HIS B 2 277 ? -2.093 24.247 -16.347 1.0 42.36 ? 455 HIS B CA 1 277 . B ATOM 3381 C C . HIS B 2 277 ? -1.761 23.766 -17.759 1.0 52.01 ? 455 HIS B C 1 277 . B ATOM 3382 O O . HIS B 2 277 ? -2.490 24.055 -18.718 1.0 48.77 ? 455 HIS B O 1 277 . B ATOM 3383 C CB . HIS B 2 277 ? -1.328 25.520 -16.018 1.0 38.71 ? 455 HIS B CB 1 277 . B ATOM 3384 C CG . HIS B 2 277 ? -1.922 26.300 -14.890 1.0 44.63 ? 455 HIS B CG 1 277 . B ATOM 3385 N ND1 . HIS B 2 277 ? -2.940 27.212 -15.069 1.0 43.58 ? 455 HIS B ND1 1 277 . B ATOM 3386 C CD2 . HIS B 2 277 ? -1.637 26.306 -13.564 1.0 33.95 ? 455 HIS B CD2 1 277 . B ATOM 3387 C CE1 . HIS B 2 277 ? -3.258 27.748 -13.903 1.0 49.25 ? 455 HIS B CE1 1 277 . B ATOM 3388 N NE2 . HIS B 2 277 ? -2.485 27.213 -12.974 1.0 43.31 ? 455 HIS B NE2 1 277 . B ATOM 3389 N N . LYS B 2 278 ? -0.652 23.043 -17.911 1.0 50.49 ? 456 LYS B N 1 278 . B ATOM 3390 C CA . LYS B 2 278 ? -0.303 22.512 -19.225 1.0 51.57 ? 456 LYS B CA 1 278 . B ATOM 3391 C C . LYS B 2 278 ? -1.426 21.652 -19.789 1.0 48.49 ? 456 LYS B C 1 278 . B ATOM 3392 O O . LYS B 2 278 ? -1.833 21.831 -20.941 1.0 61.83 ? 456 LYS B O 1 278 . B ATOM 3393 C CB . LYS B 2 278 ? 0.985 21.702 -19.138 1.0 54.06 ? 456 LYS B CB 1 278 . B ATOM 3394 C CG . LYS B 2 278 ? 1.529 21.319 -20.481 1.0 64.24 ? 456 LYS B CG 1 278 . B ATOM 3395 C CD . LYS B 2 278 ? 2.802 20.507 -20.360 1.0 71.12 ? 456 LYS B CD 1 278 . B ATOM 3396 C CE . LYS B 2 278 ? 3.414 20.275 -21.738 1.0 87.46 ? 456 LYS B CE 1 278 . B ATOM 3397 N NZ . LYS B 2 278 ? 4.665 19.466 -21.670 1.0 92.9 ? 456 LYS B NZ 1 278 . B ATOM 3398 N N . LYS B 2 279 ? -1.960 20.735 -18.981 1.0 47.14 ? 457 LYS B N 1 279 . B ATOM 3399 C CA . LYS B 2 279 ? -2.956 19.778 -19.450 1.0 56.56 ? 457 LYS B CA 1 279 . B ATOM 3400 C C . LYS B 2 279 ? -4.361 20.349 -19.562 1.0 56.02 ? 457 LYS B C 1 279 . B ATOM 3401 O O . LYS B 2 279 ? -5.213 19.723 -20.203 1.0 59.28 ? 457 LYS B O 1 279 . B ATOM 3402 C CB . LYS B 2 279 ? -3.022 18.573 -18.516 1.0 58.21 ? 457 LYS B CB 1 279 . B ATOM 3403 C CG . LYS B 2 279 ? -1.774 17.743 -18.464 1.0 74.35 ? 457 LYS B CG 1 279 . B ATOM 3404 C CD . LYS B 2 279 ? -2.123 16.362 -17.935 1.0 82.77 ? 457 LYS B CD 1 279 . B ATOM 3405 C CE . LYS B 2 279 ? -1.083 15.842 -16.959 1.0 86.02 ? 457 LYS B CE 1 279 . B ATOM 3406 N NZ . LYS B 2 279 ? 0.228 15.556 -17.594 1.0 85.77 ? 457 LYS B NZ 1 279 . B ATOM 3407 N N . ASN B 2 280 ? -4.642 21.491 -18.943 1.0 47.75 ? 458 ASN B N 1 280 . B ATOM 3408 C CA . ASN B 2 280 ? -6.014 21.945 -18.810 1.0 49.57 ? 458 ASN B CA 1 280 . B ATOM 3409 C C . ASN B 2 280 ? -6.259 23.357 -19.302 1.0 57.43 ? 458 ASN B C 1 280 . B ATOM 3410 O O . ASN B 2 280 ? -7.393 23.661 -19.690 1.0 66.39 ? 458 ASN B O 1 280 . B ATOM 3411 C CB . ASN B 2 280 ? -6.461 21.846 -17.340 1.0 62.77 ? 458 ASN B CB 1 280 . B ATOM 3412 C CG . ASN B 2 280 ? -6.612 20.408 -16.879 1.0 61.99 ? 458 ASN B CG 1 280 . B ATOM 3413 O OD1 . ASN B 2 280 ? -7.581 19.737 -17.221 1.0 74.34 ? 458 ASN B OD1 1 280 . B ATOM 3414 N ND2 . ASN B 2 280 ? -5.639 19.919 -16.127 1.0 58.58 ? 458 ASN B ND2 1 280 . B ATOM 3415 N N . GLY B 2 281 ? -5.246 24.210 -19.330 1.0 75.65 ? 459 GLY B N 1 281 . B ATOM 3416 C CA . GLY B 2 281 ? -5.471 25.624 -19.541 1.0 83.13 ? 459 GLY B CA 1 281 . B ATOM 3417 C C . GLY B 2 281 ? -5.801 26.293 -18.222 1.0 92.0 ? 459 GLY B C 1 281 . B ATOM 3418 O O . GLY B 2 281 ? -5.534 25.759 -17.144 1.0 99.28 ? 459 GLY B O 1 281 . B ATOM 3419 N N . ALA B 2 282 ? -6.402 27.472 -18.309 1.0 95.05 ? 460 ALA B N 1 282 . B ATOM 3420 C CA . ALA B 2 282 ? -6.777 28.137 -17.074 1.0 91.36 ? 460 ALA B CA 1 282 . B ATOM 3421 C C . ALA B 2 282 ? -8.291 28.289 -16.993 1.0 96.08 ? 460 ALA B C 1 282 . B ATOM 3422 O O . ALA B 2 282 ? -8.974 28.331 -18.022 1.0 97.28 ? 460 ALA B O 1 282 . B ATOM 3423 C CB . ALA B 2 282 ? -6.119 29.517 -16.948 1.0 87.9 ? 460 ALA B CB 1 282 . B ATOM 3424 N N . PRO B 2 283 ? -8.843 28.349 -15.785 1.0 96.78 ? 461 PRO B N 1 283 . B ATOM 3425 C CA . PRO B 2 283 ? -10.288 28.553 -15.633 1.0 99.24 ? 461 PRO B CA 1 283 . B ATOM 3426 C C . PRO B 2 283 ? -10.669 29.985 -15.964 1.0 101.65 ? 461 PRO B C 1 283 . B ATOM 3427 O O . PRO B 2 283 ? -9.798 30.864 -16.059 1.0 100.04 ? 461 PRO B O 1 283 . B ATOM 3428 C CB . PRO B 2 283 ? -10.540 28.233 -14.148 1.0 97.76 ? 461 PRO B CB 1 283 . B ATOM 3429 C CG . PRO B 2 283 ? -9.286 27.517 -13.664 1.0 94.42 ? 461 PRO B CG 1 283 . B ATOM 3430 C CD . PRO B 2 283 ? -8.180 28.091 -14.497 1.0 96.26 ? 461 PRO B CD 1 283 . B ATOM 3431 N N . PRO B 2 284 ? -11.957 30.260 -16.161 1.0 106.64 ? 462 PRO B N 1 284 . B ATOM 3432 C CA . PRO B 2 284 ? -12.384 31.647 -16.399 1.0 111.0 ? 462 PRO B CA 1 284 . B ATOM 3433 C C . PRO B 2 284 ? -12.145 32.493 -15.157 1.0 112.68 ? 462 PRO B C 1 284 . B ATOM 3434 O O . PRO B 2 284 ? -12.550 32.123 -14.053 1.0 111.98 ? 462 PRO B O 1 284 . B ATOM 3435 C CB . PRO B 2 284 ? -13.881 31.514 -16.717 1.0 106.35 ? 462 PRO B CB 1 284 . B ATOM 3436 C CG . PRO B 2 284 ? -14.096 30.055 -17.025 1.0 103.03 ? 462 PRO B CG 1 284 . B ATOM 3437 C CD . PRO B 2 284 ? -13.087 29.317 -16.202 1.0 102.76 ? 462 PRO B CD 1 284 . B ATOM 3438 N N . LEU B 2 285 ? -11.480 33.638 -15.342 1.0 113.45 ? 463 LEU B N 1 285 . B ATOM 3439 C CA . LEU B 2 285 ? -11.135 34.472 -14.194 1.0 116.05 ? 463 LEU B CA 1 285 . B ATOM 3440 C C . LEU B 2 285 ? -12.360 35.047 -13.490 1.0 120.92 ? 463 LEU B C 1 285 . B ATOM 3441 O O . LEU B 2 285 ? -12.214 35.612 -12.400 1.0 125.78 ? 463 LEU B O 1 285 . B ATOM 3442 C CB . LEU B 2 285 ? -10.182 35.604 -14.606 1.0 113.16 ? 463 LEU B CB 1 285 . B ATOM 3443 C CG . LEU B 2 285 ? -10.530 36.553 -15.757 1.0 114.1 ? 463 LEU B CG 1 285 . B ATOM 3444 C CD1 . LEU B 2 285 ? -9.824 37.896 -15.577 1.0 109.43 ? 463 LEU B CD1 1 285 . B ATOM 3445 C CD2 . LEU B 2 285 ? -10.163 35.932 -17.102 1.0 112.68 ? 463 LEU B CD2 1 285 . B ATOM 3446 N N . ALA B 2 286 ? -13.557 34.916 -14.073 1.0 116.18 ? 464 ALA B N 1 286 . B ATOM 3447 C CA . ALA B 2 286 ? -14.773 35.228 -13.332 1.0 114.83 ? 464 ALA B CA 1 286 . B ATOM 3448 C C . ALA B 2 286 ? -15.032 34.221 -12.220 1.0 114.08 ? 464 ALA B C 1 286 . B ATOM 3449 O O . ALA B 2 286 ? -15.803 34.514 -11.299 1.0 114.14 ? 464 ALA B O 1 286 . B ATOM 3450 C CB . ALA B 2 286 ? -15.977 35.281 -14.273 1.0 110.75 ? 464 ALA B CB 1 286 . B ATOM 3451 N N . GLU B 2 287 ? -14.401 33.047 -12.284 1.0 110.55 ? 465 GLU B N 1 287 . B ATOM 3452 C CA . GLU B 2 287 ? -14.576 32.009 -11.279 1.0 110.36 ? 465 GLU B CA 1 287 . B ATOM 3453 C C . GLU B 2 287 ? -13.437 31.940 -10.270 1.0 103.89 ? 465 GLU B C 1 287 . B ATOM 3454 O O . GLU B 2 287 ? -13.627 31.383 -9.182 1.0 106.46 ? 465 GLU B O 1 287 . B ATOM 3455 C CB . GLU B 2 287 ? -14.734 30.640 -11.959 1.0 115.29 ? 465 GLU B CB 1 287 . B ATOM 3456 C CG . GLU B 2 287 ? -15.939 30.545 -12.897 1.0 124.04 ? 465 GLU B CG 1 287 . B ATOM 3457 C CD . GLU B 2 287 ? -16.189 29.130 -13.405 1.0 129.23 ? 465 GLU B CD 1 287 . B ATOM 3458 O OE1 . GLU B 2 287 ? -15.212 28.364 -13.554 1.0 131.13 ? 465 GLU B OE1 1 287 . B ATOM 3459 O OE2 . GLU B 2 287 ? -17.366 28.783 -13.652 1.0 127.67 ? 465 GLU B OE2 1 287 . B ATOM 3460 N N . ARG B 2 288 ? -12.273 32.499 -10.592 1.0 94.82 ? 466 ARG B N 1 288 . B ATOM 3461 C CA . ARG B 2 288 ? -11.105 32.337 -9.739 1.0 86.63 ? 466 ARG B CA 1 288 . B ATOM 3462 C C . ARG B 2 288 ? -11.239 33.146 -8.451 1.0 88.16 ? 466 ARG B C 1 288 . B ATOM 3463 O O . ARG B 2 288 ? -11.852 34.216 -8.416 1.0 86.56 ? 466 ARG B O 1 288 . B ATOM 3464 C CB . ARG B 2 288 ? -9.844 32.745 -10.495 1.0 83.42 ? 466 ARG B CB 1 288 . B ATOM 3465 C CG . ARG B 2 288 ? -9.747 32.119 -11.873 1.0 87.38 ? 466 ARG B CG 1 288 . B ATOM 3466 C CD . ARG B 2 288 ? -8.309 32.077 -12.363 1.0 86.66 ? 466 ARG B CD 1 288 . B ATOM 3467 N NE . ARG B 2 288 ? -7.568 30.968 -11.772 1.0 84.31 ? 466 ARG B NE 1 288 . B ATOM 3468 C CZ . ARG B 2 288 ? -6.310 30.664 -12.073 1.0 88.81 ? 466 ARG B CZ 1 288 . B ATOM 3469 N NH1 . ARG B 2 288 ? -5.645 31.395 -12.958 1.0 94.9 ? 466 ARG B NH1 1 288 . B ATOM 3470 N NH2 . ARG B 2 288 ? -5.712 29.630 -11.491 1.0 81.74 ? 466 ARG B NH2 1 288 . B ATOM 3471 N N . GLY B 2 289 ? -10.650 32.618 -7.378 1.0 88.18 ? 467 GLY B N 1 289 . B ATOM 3472 C CA . GLY B 2 289 ? -10.767 33.210 -6.065 1.0 85.39 ? 467 GLY B CA 1 289 . B ATOM 3473 C C . GLY B 2 289 ? -11.916 32.683 -5.234 1.0 89.36 ? 467 GLY B C 1 289 . B ATOM 3474 O O . GLY B 2 289 ? -11.971 32.967 -4.030 1.0 93.35 ? 467 GLY B O 1 289 . B ATOM 3475 N N . LYS B 2 290 ? -12.827 31.917 -5.835 1.0 92.38 ? 468 LYS B N 1 290 . B ATOM 3476 C CA . LYS B 2 290 ? -14.001 31.360 -5.160 1.0 89.85 ? 468 LYS B CA 1 290 . B ATOM 3477 C C . LYS B 2 290 ? -13.784 29.858 -4.965 1.0 77.56 ? 468 LYS B C 1 290 . B ATOM 3478 O O . LYS B 2 290 ? -14.011 29.064 -5.884 1.0 87.03 ? 468 LYS B O 1 290 . B ATOM 3479 C CB . LYS B 2 290 ? -15.266 31.633 -5.973 1.0 86.65 ? 468 LYS B CB 1 290 . B ATOM 3480 C CG . LYS B 2 290 ? -15.244 32.945 -6.739 1.0 87.16 ? 468 LYS B CG 1 290 . B ATOM 3481 C CD . LYS B 2 290 ? -15.177 34.131 -5.796 1.0 88.48 ? 468 LYS B CD 1 290 . B ATOM 3482 C CE . LYS B 2 290 ? -15.247 35.447 -6.552 1.0 92.24 ? 468 LYS B CE 1 290 . B ATOM 3483 N NZ . LYS B 2 290 ? -16.540 35.591 -7.278 1.0 96.33 ? 468 LYS B NZ 1 290 . B ATOM 3484 N N . GLY B 2 291 ? -13.351 29.467 -3.769 1.0 49.66 ? 469 GLY B N 1 291 . B ATOM 3485 C CA . GLY B 2 291 ? -13.035 28.073 -3.533 1.0 39.16 ? 469 GLY B CA 1 291 . B ATOM 3486 C C . GLY B 2 291 ? -11.621 27.726 -3.973 1.0 38.69 ? 469 GLY B C 1 291 . B ATOM 3487 O O . GLY B 2 291 ? -10.811 28.595 -4.295 1.0 49.04 ? 469 GLY B O 1 291 . B ATOM 3488 N N . ILE B 2 292 ? -11.326 26.425 -3.991 1.0 39.3 ? 470 ILE B N 1 292 . B ATOM 3489 C CA . ILE B 2 292 ? -9.964 25.975 -4.249 1.0 30.85 ? 470 ILE B CA 1 292 . B ATOM 3490 C C . ILE B 2 292 ? -9.589 26.228 -5.707 1.0 40.08 ? 470 ILE B C 1 292 . B ATOM 3491 O O . ILE B 2 292 ? -10.442 26.350 -6.597 1.0 38.71 ? 470 ILE B O 1 292 . B ATOM 3492 C CB . ILE B 2 292 ? -9.787 24.492 -3.853 1.0 27.27 ? 470 ILE B CB 1 292 . B ATOM 3493 C CG1 . ILE B 2 292 ? -10.776 23.593 -4.581 1.0 35.0 ? 470 ILE B CG1 1 292 . B ATOM 3494 C CG2 . ILE B 2 292 ? -9.985 24.314 -2.332 1.0 31.9 ? 470 ILE B CG2 1 292 . B ATOM 3495 C CD1 . ILE B 2 292 ? -10.186 22.905 -5.789 1.0 48.87 ? 470 ILE B CD1 1 292 . B ATOM 3496 N N . ASP B 2 293 ? -8.291 26.354 -5.945 1.0 36.9 ? 471 ASP B N 1 293 . B ATOM 3497 C CA . ASP B 2 293 ? -7.769 26.421 -7.296 1.0 36.57 ? 471 ASP B CA 1 293 . B ATOM 3498 C C . ASP B 2 293 ? -7.419 25.013 -7.745 1.0 39.74 ? 471 ASP B C 1 293 . B ATOM 3499 O O . ASP B 2 293 ? -6.633 24.339 -7.069 1.0 36.61 ? 471 ASP B O 1 293 . B ATOM 3500 C CB . ASP B 2 293 ? -6.550 27.318 -7.355 1.0 37.31 ? 471 ASP B CB 1 293 . B ATOM 3501 C CG . ASP B 2 293 ? -5.840 27.266 -8.703 1.0 48.09 ? 471 ASP B CG 1 293 . B ATOM 3502 O OD1 . ASP B 2 293 ? -6.450 27.640 -9.742 1.0 49.8 ? 471 ASP B OD1 1 293 . B ATOM 3503 O OD2 . ASP B 2 293 ? -4.653 26.875 -8.715 1.0 43.74 ? 471 ASP B OD2 1 293 . B ATOM 3504 N N . PRO B 2 294 ? -7.973 24.527 -8.851 1.0 33.62 ? 472 PRO B N 1 294 . B ATOM 3505 C CA . PRO B 2 294 ? -7.679 23.146 -9.268 1.0 43.48 ? 472 PRO B CA 1 294 . B ATOM 3506 C C . PRO B 2 294 ? -6.198 22.803 -9.290 1.0 38.09 ? 472 PRO B C 1 294 . B ATOM 3507 O O . PRO B 2 294 ? -5.813 21.722 -8.838 1.0 35.88 ? 472 PRO B O 1 294 . B ATOM 3508 C CB . PRO B 2 294 ? -8.290 23.079 -10.674 1.0 43.92 ? 472 PRO B CB 1 294 . B ATOM 3509 C CG . PRO B 2 294 ? -9.408 24.067 -10.645 1.0 41.06 ? 472 PRO B CG 1 294 . B ATOM 3510 C CD . PRO B 2 294 ? -8.996 25.173 -9.692 1.0 33.04 ? 472 PRO B CD 1 294 . B ATOM 3511 N N . ALA B 2 295 ? -5.353 23.671 -9.842 1.0 41.48 ? 473 ALA B N 1 295 . B ATOM 3512 C CA . ALA B 2 295 ? -3.933 23.350 -9.886 1.0 34.37 ? 473 ALA B CA 1 295 . B ATOM 3513 C C . ALA B 2 295 ? -3.361 23.190 -8.477 1.0 38.21 ? 473 ALA B C 1 295 . B ATOM 3514 O O . ALA B 2 295 ? -2.609 22.246 -8.206 1.0 35.88 ? 473 ALA B O 1 295 . B ATOM 3515 C CB . ALA B 2 295 ? -3.181 24.418 -10.675 1.0 29.55 ? 473 ALA B CB 1 295 . B ATOM 3516 N N . CYS B 2 296 ? -3.686 24.118 -7.569 1.0 35.42 ? 474 CYS B N 1 296 . B ATOM 3517 C CA . CYS B 2 296 ? -3.192 23.994 -6.196 1.0 29.59 ? 474 CYS B CA 1 296 . B ATOM 3518 C C . CYS B 2 296 ? -3.744 22.749 -5.528 1.0 32.06 ? 474 CYS B C 1 296 . B ATOM 3519 O O . CYS B 2 296 ? -3.063 22.122 -4.716 1.0 41.72 ? 474 CYS B O 1 296 . B ATOM 3520 C CB . CYS B 2 296 ? -3.571 25.221 -5.363 1.0 29.56 ? 474 CYS B CB 1 296 . B ATOM 3521 S SG . CYS B 2 296 ? -2.739 26.726 -5.795 1.0 35.17 ? 474 CYS B SG 1 296 . B ATOM 3522 N N . GLN B 2 297 ? -4.991 22.390 -5.832 1.0 33.38 ? 475 GLN B N 1 297 . B ATOM 3523 C CA . GLN B 2 297 ? -5.552 21.177 -5.272 1.0 37.12 ? 475 GLN B CA 1 297 . B ATOM 3524 C C . GLN B 2 297 ? -4.815 19.940 -5.772 1.0 47.16 ? 475 GLN B C 1 297 . B ATOM 3525 O O . GLN B 2 297 ? -4.588 18.996 -4.996 1.0 36.25 ? 475 GLN B O 1 297 . B ATOM 3526 C CB . GLN B 2 297 ? -7.043 21.101 -5.599 1.0 42.71 ? 475 GLN B CB 1 297 . B ATOM 3527 C CG . GLN B 2 297 ? -7.775 20.008 -4.827 1.0 43.75 ? 475 GLN B CG 1 297 . B ATOM 3528 C CD . GLN B 2 297 ? -7.590 20.143 -3.321 1.0 41.79 ? 475 GLN B CD 1 297 . B ATOM 3529 O OE1 . GLN B 2 297 ? -7.612 21.248 -2.783 1.0 43.19 ? 475 GLN B OE1 1 297 . B ATOM 3530 N NE2 . GLN B 2 297 ? -7.404 19.018 -2.639 1.0 40.84 ? 475 GLN B NE2 1 297 . B ATOM 3531 N N . ALA B 2 298 ? -4.414 19.927 -7.047 1.0 40.57 ? 476 ALA B N 1 298 . B ATOM 3532 C CA . ALA B 2 298 ? -3.650 18.788 -7.551 1.0 34.65 ? 476 ALA B CA 1 298 . B ATOM 3533 C C . ALA B 2 298 ? -2.307 18.671 -6.846 1.0 31.89 ? 476 ALA B C 1 298 . B ATOM 3534 O O . ALA B 2 298 ? -1.849 17.561 -6.552 1.0 40.8 ? 476 ALA B O 1 298 . B ATOM 3535 C CB . ALA B 2 298 ? -3.448 18.899 -9.068 1.0 40.55 ? 476 ALA B CB 1 298 . B ATOM 3536 N N . ALA B 2 299 ? -1.662 19.793 -6.548 1.0 25.32 ? 477 ALA B N 1 299 . B ATOM 3537 C CA . ALA B 2 299 ? -0.371 19.721 -5.862 1.0 28.25 ? 477 ALA B CA 1 299 . B ATOM 3538 C C . ALA B 2 299 ? -0.532 19.263 -4.408 1.0 35.34 ? 477 ALA B C 1 299 . B ATOM 3539 O O . ALA B 2 299 ? 0.273 18.474 -3.901 1.0 28.26 ? 477 ALA B O 1 299 . B ATOM 3540 C CB . ALA B 2 299 ? 0.329 21.072 -5.913 1.0 26.84 ? 477 ALA B CB 1 299 . B ATOM 3541 N N . ALA B 2 300 ? -1.558 19.759 -3.721 1.0 33.85 ? 478 ALA B N 1 300 . B ATOM 3542 C CA . ALA B 2 300 ? -1.813 19.312 -2.355 1.0 33.28 ? 478 ALA B CA 1 300 . B ATOM 3543 C C . ALA B 2 300 ? -2.207 17.839 -2.335 1.0 44.16 ? 478 ALA B C 1 300 . B ATOM 3544 O O . ALA B 2 300 ? -1.744 17.064 -1.485 1.0 41.97 ? 478 ALA B O 1 300 . B ATOM 3545 C CB . ALA B 2 300 ? -2.905 20.171 -1.724 1.0 24.96 ? 478 ALA B CB 1 300 . B ATOM 3546 N N . ASP B 2 301 ? -3.086 17.439 -3.255 1.0 35.35 ? 479 ASP B N 1 301 . B ATOM 3547 C CA . ASP B 2 301 ? -3.468 16.038 -3.365 1.0 36.7 ? 479 ASP B CA 1 301 . B ATOM 3548 C C . ASP B 2 301 ? -2.233 15.162 -3.530 1.0 46.52 ? 479 ASP B C 1 301 . B ATOM 3549 O O . ASP B 2 301 ? -2.033 14.186 -2.794 1.0 37.61 ? 479 ASP B O 1 301 . B ATOM 3550 C CB . ASP B 2 301 ? -4.423 15.847 -4.548 1.0 46.36 ? 479 ASP B CB 1 301 . B ATOM 3551 C CG . ASP B 2 301 ? -4.896 14.399 -4.703 1.0 78.81 ? 479 ASP B CG 1 301 . B ATOM 3552 O OD1 . ASP B 2 301 ? -5.913 14.036 -4.084 1.0 87.83 ? 479 ASP B OD1 1 301 . B ATOM 3553 O OD2 . ASP B 2 301 ? -4.263 13.626 -5.453 1.0 86.53 ? 479 ASP B OD2 1 301 . B ATOM 3554 N N . TYR B 2 302 ? -1.371 15.532 -4.473 1.0 36.22 ? 480 TYR B N 1 302 . B ATOM 3555 C CA . TYR B 2 302 ? -0.207 14.721 -4.798 1.0 39.67 ? 480 TYR B CA 1 302 . B ATOM 3556 C C . TYR B 2 302 ? 0.815 14.713 -3.664 1.0 39.49 ? 480 TYR B C 1 302 . B ATOM 3557 O O . TYR B 2 302 ? 1.452 13.685 -3.399 1.0 33.47 ? 480 TYR B O 1 302 . B ATOM 3558 C CB . TYR B 2 302 ? 0.408 15.252 -6.092 1.0 37.15 ? 480 TYR B CB 1 302 . B ATOM 3559 C CG . TYR B 2 302 ? 1.574 14.456 -6.593 1.0 42.86 ? 480 TYR B CG 1 302 . B ATOM 3560 C CD1 . TYR B 2 302 ? 1.382 13.292 -7.323 1.0 37.41 ? 480 TYR B CD1 1 302 . B ATOM 3561 C CD2 . TYR B 2 302 ? 2.867 14.875 -6.347 1.0 43.11 ? 480 TYR B CD2 1 302 . B ATOM 3562 C CE1 . TYR B 2 302 ? 2.456 12.572 -7.789 1.0 39.8 ? 480 TYR B CE1 1 302 . B ATOM 3563 C CE2 . TYR B 2 302 ? 3.938 14.162 -6.795 1.0 40.57 ? 480 TYR B CE2 1 302 . B ATOM 3564 C CZ . TYR B 2 302 ? 3.735 13.012 -7.510 1.0 44.89 ? 480 TYR B CZ 1 302 . B ATOM 3565 O OH . TYR B 2 302 ? 4.832 12.324 -7.953 1.0 50.91 ? 480 TYR B OH 1 302 . B ATOM 3566 N N . LEU B 2 303 ? 1.009 15.854 -3.004 1.0 32.04 ? 481 LEU B N 1 303 . B ATOM 3567 C CA . LEU B 2 303 ? 1.926 15.892 -1.877 1.0 28.48 ? 481 LEU B CA 1 303 . B ATOM 3568 C C . LEU B 2 303 ? 1.462 14.947 -0.786 1.0 29.47 ? 481 LEU B C 1 303 . B ATOM 3569 O O . LEU B 2 303 ? 2.268 14.228 -0.191 1.0 37.59 ? 481 LEU B O 1 303 . B ATOM 3570 C CB . LEU B 2 303 ? 2.035 17.322 -1.333 1.0 27.87 ? 481 LEU B CB 1 303 . B ATOM 3571 C CG . LEU B 2 303 ? 2.984 18.237 -2.096 1.0 36.42 ? 481 LEU B CG 1 303 . B ATOM 3572 C CD1 . LEU B 2 303 ? 2.888 19.656 -1.546 1.0 49.31 ? 481 LEU B CD1 1 303 . B ATOM 3573 C CD2 . LEU B 2 303 ? 4.427 17.733 -2.031 1.0 30.84 ? 481 LEU B CD2 1 303 . B ATOM 3574 N N . SER B 2 304 ? 0.155 14.910 -0.531 1.0 36.48 ? 482 SER B N 1 304 . B ATOM 3575 C CA . SER B 2 304 ? -0.337 14.074 0.555 1.0 34.18 ? 482 SER B CA 1 304 . B ATOM 3576 C C . SER B 2 304 ? -0.200 12.598 0.209 1.0 34.7 ? 482 SER B C 1 304 . B ATOM 3577 O O . SER B 2 304 ? 0.208 11.791 1.051 1.0 35.67 ? 482 SER B O 1 304 . B ATOM 3578 C CB . SER B 2 304 ? -1.783 14.433 0.880 1.0 32.15 ? 482 SER B CB 1 304 . B ATOM 3579 O OG . SER B 2 304 ? -2.682 13.948 -0.103 1.0 41.26 ? 482 SER B OG 1 304 . B ATOM 3580 N N . MET B 2 305 ? -0.533 12.224 -1.021 1.0 38.33 ? 483 MET B N 1 305 . B ATOM 3581 C CA . MET B 2 305 ? -0.330 10.840 -1.438 1.0 41.79 ? 483 MET B CA 1 305 . B ATOM 3582 C C . MET B 2 305 ? 1.144 10.445 -1.381 1.0 33.9 ? 483 MET B C 1 305 . B ATOM 3583 O O . MET B 2 305 ? 1.479 9.337 -0.946 1.0 36.25 ? 483 MET B O 1 305 . B ATOM 3584 C CB . MET B 2 305 ? -0.901 10.626 -2.837 1.0 48.12 ? 483 MET B CB 1 305 . B ATOM 3585 C CG . MET B 2 305 ? -2.432 10.675 -2.858 1.0 78.46 ? 483 MET B CG 1 305 . B ATOM 3586 S SD . MET B 2 305 ? -3.261 9.793 -1.480 1.0 81.2 ? 483 MET B SD 1 305 . B ATOM 3587 C CE . MET B 2 305 ? -3.461 11.101 -0.272 1.0 64.89 ? 483 MET B CE 1 305 . B ATOM 3588 N N . LEU B 2 306 ? 2.041 11.331 -1.822 1.0 31.52 ? 484 LEU B N 1 306 . B ATOM 3589 C CA . LEU B 2 306 ? 3.475 11.063 -1.705 1.0 31.49 ? 484 LEU B CA 1 306 . B ATOM 3590 C C . LEU B 2 306 ? 3.874 10.835 -0.243 1.0 33.59 ? 484 LEU B C 1 306 . B ATOM 3591 O O . LEU B 2 306 ? 4.608 9.896 0.084 1.0 43.72 ? 484 LEU B O 1 306 . B ATOM 3592 C CB . LEU B 2 306 ? 4.260 12.230 -2.301 1.0 32.47 ? 484 LEU B CB 1 306 . B ATOM 3593 C CG . LEU B 2 306 ? 5.356 12.005 -3.348 1.0 45.18 ? 484 LEU B CG 1 306 . B ATOM 3594 C CD1 . LEU B 2 306 ? 4.975 10.962 -4.399 1.0 34.02 ? 484 LEU B CD1 1 306 . B ATOM 3595 C CD2 . LEU B 2 306 ? 5.685 13.323 -4.024 1.0 45.42 ? 484 LEU B CD2 1 306 . B ATOM 3596 N N . ALA B 2 307 ? 3.398 11.700 0.650 1.0 31.15 ? 485 ALA B N 1 307 . B ATOM 3597 C CA . ALA B 2 307 ? 3.739 11.571 2.061 1.0 32.01 ? 485 ALA B CA 1 307 . B ATOM 3598 C C . ALA B 2 307 ? 3.273 10.233 2.630 1.0 32.66 ? 485 ALA B C 1 307 . B ATOM 3599 O O . ALA B 2 307 ? 4.009 9.580 3.371 1.0 34.28 ? 485 ALA B O 1 307 . B ATOM 3600 C CB . ALA B 2 307 ? 3.125 12.724 2.845 1.0 44.82 ? 485 ALA B CB 1 307 . B ATOM 3601 N N . LEU B 2 308 ? 2.048 9.814 2.308 1.0 33.44 ? 486 LEU B N 1 308 . B ATOM 3602 C CA . LEU B 2 308 ? 1.592 8.493 2.726 1.0 41.4 ? 486 LEU B CA 1 308 . B ATOM 3603 C C . LEU B 2 308 ? 2.447 7.404 2.095 1.0 42.97 ? 486 LEU B C 1 308 . B ATOM 3604 O O . LEU B 2 308 ? 2.862 6.446 2.757 1.0 41.71 ? 486 LEU B O 1 308 . B ATOM 3605 C CB . LEU B 2 308 ? 0.135 8.285 2.338 1.0 37.64 ? 486 LEU B CB 1 308 . B ATOM 3606 C CG . LEU B 2 308 ? -0.935 8.986 3.155 1.0 41.36 ? 486 LEU B CG 1 308 . B ATOM 3607 C CD1 . LEU B 2 308 ? -2.265 8.606 2.544 1.0 47.21 ? 486 LEU B CD1 1 308 . B ATOM 3608 C CD2 . LEU B 2 308 ? -0.894 8.580 4.613 1.0 47.08 ? 486 LEU B CD2 1 308 . B ATOM 3609 N N . GLN B 2 309 ? 2.728 7.543 0.812 1.0 40.41 ? 487 GLN B N 1 309 . B ATOM 3610 C CA . GLN B 2 309 ? 3.493 6.514 0.136 1.0 39.18 ? 487 GLN B CA 1 309 . B ATOM 3611 C C . GLN B 2 309 ? 4.884 6.373 0.739 1.0 49.35 ? 487 GLN B C 1 309 . B ATOM 3612 O O . GLN B 2 309 ? 5.427 5.261 0.792 1.0 46.7 ? 487 GLN B O 1 309 . B ATOM 3613 C CB . GLN B 2 309 ? 3.545 6.843 -1.349 1.0 36.09 ? 487 GLN B CB 1 309 . B ATOM 3614 C CG . GLN B 2 309 ? 4.669 6.216 -2.084 1.0 53.9 ? 487 GLN B CG 1 309 . B ATOM 3615 C CD . GLN B 2 309 ? 4.678 6.672 -3.522 1.0 63.59 ? 487 GLN B CD 1 309 . B ATOM 3616 O OE1 . GLN B 2 309 ? 3.627 6.768 -4.156 1.0 67.41 ? 487 GLN B OE1 1 309 . B ATOM 3617 N NE2 . GLN B 2 309 ? 5.857 6.997 -4.031 1.0 63.2 ? 487 GLN B NE2 1 309 . B ATOM 3618 N N . LYS B 2 310 ? 5.469 7.471 1.220 1.0 39.76 ? 488 LYS B N 1 310 . B ATOM 3619 C CA . LYS B 2 310 ? 6.751 7.394 1.917 1.0 34.08 ? 488 LYS B CA 1 310 . B ATOM 3620 C C . LYS B 2 310 ? 6.622 6.853 3.336 1.0 43.53 ? 488 LYS B C 1 310 . B ATOM 3621 O O . LYS B 2 310 ? 7.632 6.741 4.042 1.0 50.38 ? 488 LYS B O 1 310 . B ATOM 3622 C CB . LYS B 2 310 ? 7.415 8.774 1.941 1.0 39.02 ? 488 LYS B CB 1 310 . B ATOM 3623 C CG . LYS B 2 310 ? 7.871 9.240 0.576 1.0 39.9 ? 488 LYS B CG 1 310 . B ATOM 3624 C CD . LYS B 2 310 ? 8.504 10.619 0.617 1.0 41.02 ? 488 LYS B CD 1 310 . B ATOM 3625 C CE . LYS B 2 310 ? 8.784 11.100 -0.805 1.0 61.45 ? 488 LYS B CE 1 310 . B ATOM 3626 N NZ . LYS B 2 310 ? 9.825 10.283 -1.474 1.0 68.48 ? 488 LYS B NZ 1 310 . B ATOM 3627 N N . GLY B 2 311 ? 5.414 6.519 3.772 1.0 45.27 ? 489 GLY B N 1 311 . B ATOM 3628 C CA . GLY B 2 311 ? 5.239 5.893 5.058 1.0 49.72 ? 489 GLY B CA 1 311 . B ATOM 3629 C C . GLY B 2 311 ? 5.033 6.842 6.209 1.0 52.54 ? 489 GLY B C 1 311 . B ATOM 3630 O O . GLY B 2 311 ? 5.306 6.467 7.349 1.0 51.88 ? 489 GLY B O 1 311 . B ATOM 3631 N N . SER B 2 312 ? 4.566 8.063 5.960 1.0 42.5 ? 490 SER B N 1 312 . B ATOM 3632 C CA . SER B 2 312 ? 4.180 8.905 7.076 1.0 45.68 ? 490 SER B CA 1 312 . B ATOM 3633 C C . SER B 2 312 ? 3.006 8.268 7.798 1.0 46.57 ? 490 SER B C 1 312 . B ATOM 3634 O O . SER B 2 312 ? 2.023 7.858 7.174 1.0 39.46 ? 490 SER B O 1 312 . B ATOM 3635 C CB . SER B 2 312 ? 3.823 10.317 6.619 1.0 50.27 ? 490 SER B CB 1 312 . B ATOM 3636 O OG . SER B 2 312 ? 3.434 11.082 7.739 1.0 41.6 ? 490 SER B OG 1 312 . B ATOM 3637 N N . LYS B 2 313 ? 3.137 8.155 9.118 1.0 36.85 ? 491 LYS B N 1 313 . B ATOM 3638 C CA . LYS B 2 313 ? 2.141 7.508 9.959 1.0 46.9 ? 491 LYS B CA 1 313 . B ATOM 3639 C C . LYS B 2 313 ? 1.324 8.511 10.767 1.0 42.07 ? 491 LYS B C 1 313 . B ATOM 3640 O O . LYS B 2 313 ? 0.534 8.108 11.625 1.0 46.17 ? 491 LYS B O 1 313 . B ATOM 3641 C CB . LYS B 2 313 ? 2.826 6.499 10.900 1.0 48.38 ? 491 LYS B CB 1 313 . B ATOM 3642 C CG . LYS B 2 313 ? 3.442 5.296 10.179 1.0 57.88 ? 491 LYS B CG 1 313 . B ATOM 3643 C CD . LYS B 2 313 ? 2.392 4.570 9.330 1.0 73.55 ? 491 LYS B CD 1 313 . B ATOM 3644 C CE . LYS B 2 313 ? 2.994 3.437 8.492 1.0 80.77 ? 491 LYS B CE 1 313 . B ATOM 3645 N NZ . LYS B 2 313 ? 3.725 3.900 7.265 1.0 71.42 ? 491 LYS B NZ 1 313 . B ATOM 3646 N N . ASP B 2 314 ? 1.477 9.798 10.492 1.0 36.94 ? 492 ASP B N 1 314 . B ATOM 3647 C CA . ASP B 2 314 ? 0.818 10.870 11.226 1.0 34.72 ? 492 ASP B CA 1 314 . B ATOM 3648 C C . ASP B 2 314 ? -0.360 11.407 10.423 1.0 40.23 ? 492 ASP B C 1 314 . B ATOM 3649 O O . ASP B 2 314 ? -0.486 11.157 9.215 1.0 39.91 ? 492 ASP B O 1 314 . B ATOM 3650 C CB . ASP B 2 314 ? 1.830 11.988 11.497 1.0 37.36 ? 492 ASP B CB 1 314 . B ATOM 3651 C CG . ASP B 2 314 ? 1.403 12.924 12.609 1.0 40.04 ? 492 ASP B CG 1 314 . B ATOM 3652 O OD1 . ASP B 2 314 ? 0.373 12.651 13.272 1.0 33.99 ? 492 ASP B OD1 1 314 . B ATOM 3653 O OD2 . ASP B 2 314 ? 2.123 13.923 12.822 1.0 37.03 ? 492 ASP B OD2 1 314 . B ATOM 3654 N N . ASN B 2 315 ? -1.228 12.164 11.100 1.0 35.48 ? 493 ASN B N 1 315 . B ATOM 3655 C CA . ASN B 2 315 ? -2.102 13.094 10.395 1.0 32.78 ? 493 ASN B CA 1 315 . B ATOM 3656 C C . ASN B 2 315 ? -1.264 13.950 9.438 1.0 30.53 ? 493 ASN B C 1 315 . B ATOM 3657 O O . ASN B 2 315 ? -0.111 14.274 9.725 1.0 34.28 ? 493 ASN B O 1 315 . B ATOM 3658 C CB . ASN B 2 315 ? -2.849 14.014 11.378 1.0 31.15 ? 493 ASN B CB 1 315 . B ATOM 3659 C CG . ASN B 2 315 ? -3.656 13.255 12.441 1.0 37.61 ? 493 ASN B CG 1 315 . B ATOM 3660 O OD1 . ASN B 2 315 ? -3.919 13.794 13.518 1.0 38.36 ? 493 ASN B OD1 1 315 . B ATOM 3661 N ND2 . ASN B 2 315 ? -4.046 12.020 12.146 1.0 32.63 ? 493 ASN B ND2 1 315 . B ATOM 3662 N N . ILE B 2 316 ? -1.833 14.312 8.285 1.0 29.13 ? 494 ILE B N 1 316 . B ATOM 3663 C CA . ILE B 2 316 ? -1.114 15.077 7.265 1.0 26.66 ? 494 ILE B CA 1 316 . B ATOM 3664 C C . ILE B 2 316 ? -2.051 16.164 6.751 1.0 31.54 ? 494 ILE B C 1 316 . B ATOM 3665 O O . ILE B 2 316 ? -3.137 15.859 6.242 1.0 30.05 ? 494 ILE B O 1 316 . B ATOM 3666 C CB . ILE B 2 316 ? -0.630 14.180 6.109 1.0 39.96 ? 494 ILE B CB 1 316 . B ATOM 3667 C CG1 . ILE B 2 316 ? 0.420 13.204 6.603 1.0 31.04 ? 494 ILE B CG1 1 316 . B ATOM 3668 C CG2 . ILE B 2 316 ? -0.012 15.017 4.978 1.0 34.44 ? 494 ILE B CG2 1 316 . B ATOM 3669 C CD1 . ILE B 2 316 ? 0.556 12.000 5.746 1.0 37.73 ? 494 ILE B CD1 1 316 . B ATOM 3670 N N . SER B 2 317 ? -1.653 17.433 6.921 1.0 27.58 ? 495 SER B N 1 317 . B ATOM 3671 C CA . SER B 2 317 ? -2.461 18.575 6.492 1.0 30.92 ? 495 SER B CA 1 317 . B ATOM 3672 C C . SER B 2 317 ? -1.602 19.555 5.712 1.0 25.76 ? 495 SER B C 1 317 . B ATOM 3673 O O . SER B 2 317 ? -0.508 19.916 6.156 1.0 33.89 ? 495 SER B O 1 317 . B ATOM 3674 C CB . SER B 2 317 ? -3.112 19.284 7.687 1.0 42.35 ? 495 SER B CB 1 317 . B ATOM 3675 O OG . SER B 2 317 ? -4.000 18.396 8.349 1.0 42.03 ? 495 SER B OG 1 317 . B ATOM 3676 N N . ILE B 2 318 ? -2.087 19.972 4.535 1.0 33.29 ? 496 ILE B N 1 318 . B ATOM 3677 C CA . ILE B 2 318 ? -1.286 20.777 3.617 1.0 27.2 ? 496 ILE B CA 1 318 . B ATOM 3678 C C . ILE B 2 318 ? -2.150 21.868 3.010 1.0 25.97 ? 496 ILE B C 1 318 . B ATOM 3679 O O . ILE B 2 318 ? -3.272 21.605 2.575 1.0 33.65 ? 496 ILE B O 1 318 . B ATOM 3680 C CB . ILE B 2 318 ? -0.679 19.902 2.508 1.0 29.82 ? 496 ILE B CB 1 318 . B ATOM 3681 C CG1 . ILE B 2 318 ? 0.101 18.753 3.142 1.0 31.79 ? 496 ILE B CG1 1 318 . B ATOM 3682 C CG2 . ILE B 2 318 ? 0.232 20.738 1.580 1.0 29.77 ? 496 ILE B CG2 1 318 . B ATOM 3683 C CD1 . ILE B 2 318 ? 0.541 17.651 2.150 1.0 28.07 ? 496 ILE B CD1 1 318 . B ATOM 3684 N N . ILE B 2 319 ? -1.629 23.089 2.979 1.0 28.67 ? 497 ILE B N 1 319 . B ATOM 3685 C CA . ILE B 2 319 ? -2.204 24.181 2.203 1.0 31.46 ? 497 ILE B CA 1 319 . B ATOM 3686 C C . ILE B 2 319 ? -1.184 24.597 1.157 1.0 34.46 ? 497 ILE B C 1 319 . B ATOM 3687 O O . ILE B 2 319 ? -0.077 25.015 1.509 1.0 35.62 ? 497 ILE B O 1 319 . B ATOM 3688 C CB . ILE B 2 319 ? -2.585 25.395 3.061 1.0 37.09 ? 497 ILE B CB 1 319 . B ATOM 3689 C CG1 . ILE B 2 319 ? -3.479 25.005 4.248 1.0 35.49 ? 497 ILE B CG1 1 319 . B ATOM 3690 C CG2 . ILE B 2 319 ? -3.269 26.441 2.159 1.0 31.52 ? 497 ILE B CG2 1 319 . B ATOM 3691 C CD1 . ILE B 2 319 ? -3.829 26.201 5.152 1.0 27.22 ? 497 ILE B CD1 1 319 . B ATOM 3692 N N . VAL B 2 320 ? -1.534 24.470 -0.121 1.0 28.73 ? 498 VAL B N 1 320 . B ATOM 3693 C CA . VAL B 2 320 ? -0.681 24.978 -1.207 1.0 25.65 ? 498 VAL B CA 1 320 . B ATOM 3694 C C . VAL B 2 320 ? -1.271 26.285 -1.735 1.0 27.33 ? 498 VAL B C 1 320 . B ATOM 3695 O O . VAL B 2 320 ? -2.443 26.332 -2.124 1.0 29.16 ? 498 VAL B O 1 320 . B ATOM 3696 C CB . VAL B 2 320 ? -0.525 23.969 -2.348 1.0 31.55 ? 498 VAL B CB 1 320 . B ATOM 3697 C CG1 . VAL B 2 320 ? 0.387 24.570 -3.414 1.0 26.82 ? 498 VAL B CG1 1 320 . B ATOM 3698 C CG2 . VAL B 2 320 ? 0.055 22.667 -1.802 1.0 31.23 ? 498 VAL B CG2 1 320 . B ATOM 3699 N N . ILE B 2 321 ? -0.458 27.334 -1.762 1.0 35.62 ? 499 ILE B N 1 321 . B ATOM 3700 C CA . ILE B 2 321 ? -0.875 28.671 -2.187 1.0 32.69 ? 499 ILE B CA 1 321 . B ATOM 3701 C C . ILE B 2 321 ? -0.015 29.075 -3.378 1.0 33.78 ? 499 ILE B C 1 321 . B ATOM 3702 O O . ILE B 2 321 ? 1.213 29.163 -3.258 1.0 38.37 ? 499 ILE B O 1 321 . B ATOM 3703 C CB . ILE B 2 321 ? -0.730 29.688 -1.043 1.0 29.29 ? 499 ILE B CB 1 321 . B ATOM 3704 C CG1 . ILE B 2 321 ? -1.529 29.242 0.190 1.0 36.31 ? 499 ILE B CG1 1 321 . B ATOM 3705 C CG2 . ILE B 2 321 ? -1.135 31.091 -1.497 1.0 28.64 ? 499 ILE B CG2 1 321 . B ATOM 3706 C CD1 . ILE B 2 321 ? -0.922 29.748 1.512 1.0 33.1 ? 499 ILE B CD1 1 321 . B ATOM 3707 N N . ASP B 2 322 ? -0.646 29.301 -4.526 1.0 33.29 ? 500 ASP B N 1 322 . B ATOM 3708 C CA . ASP B 2 322 ? 0.075 29.775 -5.699 1.0 30.11 ? 500 ASP B CA 1 322 . B ATOM 3709 C C . ASP B 2 322 ? 0.208 31.295 -5.608 1.0 29.73 ? 500 ASP B C 1 322 . B ATOM 3710 O O . ASP B 2 322 ? -0.786 32.008 -5.451 1.0 40.92 ? 500 ASP B O 1 322 . B ATOM 3711 C CB . ASP B 2 322 ? -0.669 29.365 -6.977 1.0 40.98 ? 500 ASP B CB 1 322 . B ATOM 3712 C CG . ASP B 2 322 ? 0.113 29.667 -8.250 1.0 49.04 ? 500 ASP B CG 1 322 . B ATOM 3713 O OD1 . ASP B 2 322 ? 1.136 30.381 -8.198 1.0 47.04 ? 500 ASP B OD1 1 322 . B ATOM 3714 O OD2 . ASP B 2 322 ? -0.310 29.182 -9.320 1.0 50.49 ? 500 ASP B OD2 1 322 . B ATOM 3715 N N . LEU B 2 323 ? 1.435 31.792 -5.681 1.0 34.2 ? 501 LEU B N 1 323 . B ATOM 3716 C CA . LEU B 2 323 ? 1.692 33.218 -5.557 1.0 34.78 ? 501 LEU B CA 1 323 . B ATOM 3717 C C . LEU B 2 323 ? 1.964 33.909 -6.892 1.0 47.97 ? 501 LEU B C 1 323 . B ATOM 3718 O O . LEU B 2 323 ? 2.297 35.098 -6.892 1.0 58.38 ? 501 LEU B O 1 323 . B ATOM 3719 C CB . LEU B 2 323 ? 2.872 33.448 -4.618 1.0 33.56 ? 501 LEU B CB 1 323 . B ATOM 3720 C CG . LEU B 2 323 ? 2.748 32.914 -3.176 1.0 39.23 ? 501 LEU B CG 1 323 . B ATOM 3721 C CD1 . LEU B 2 323 ? 4.118 32.970 -2.579 1.0 41.61 ? 501 LEU B CD1 1 323 . B ATOM 3722 C CD2 . LEU B 2 323 ? 1.785 33.771 -2.398 1.0 33.15 ? 501 LEU B CD2 1 323 . B ATOM 3723 N N . LYS B 2 324 ? 1.871 33.194 -8.014 1.0 44.71 ? 502 LYS B N 1 324 . B ATOM 3724 C CA . LYS B 2 324 ? 2.024 33.786 -9.344 1.0 41.09 ? 502 LYS B CA 1 324 . B ATOM 3725 C C . LYS B 2 324 ? 0.679 34.266 -9.879 1.0 41.01 ? 502 LYS B C 1 324 . B ATOM 3726 O O . LYS B 2 324 ? -0.302 33.519 -9.892 1.0 46.09 ? 502 LYS B O 1 324 . B ATOM 3727 C CB . LYS B 2 324 ? 2.607 32.781 -10.344 1.0 41.91 ? 502 LYS B CB 1 324 . B ATOM 3728 C CG . LYS B 2 324 ? 4.055 32.370 -10.156 1.0 42.35 ? 502 LYS B CG 1 324 . B ATOM 3729 C CD . LYS B 2 324 ? 5.036 33.502 -10.427 1.0 52.55 ? 502 LYS B CD 1 324 . B ATOM 3730 C CE . LYS B 2 324 ? 6.426 32.937 -10.707 1.0 49.81 ? 502 LYS B CE 1 324 . B ATOM 3731 N NZ . LYS B 2 324 ? 7.479 33.980 -10.876 1.0 46.63 ? 502 LYS B NZ 1 324 . B ATOM 3732 N N . ALA B 2 325 ? 0.650 35.506 -10.369 1.0 54.48 ? 503 ALA B N 1 325 . B ATOM 3733 C CA . ALA B 2 325 ? -0.564 36.023 -11.001 1.0 62.41 ? 503 ALA B CA 1 325 . B ATOM 3734 C C . ALA B 2 325 ? -0.994 35.171 -12.191 1.0 60.23 ? 503 ALA B C 1 325 . B ATOM 3735 O O . ALA B 2 325 ? -2.193 34.966 -12.411 1.0 67.39 ? 503 ALA B O 1 325 . B ATOM 3736 C CB . ALA B 2 325 ? -0.349 37.469 -11.447 1.0 71.14 ? 503 ALA B CB 1 325 . B ATOM 3737 N N . GLN B 2 326 ? -0.037 34.664 -12.964 1.0 54.28 ? 504 GLN B N 1 326 . B ATOM 3738 C CA . GLN B 2 326 ? -0.347 34.044 -14.243 1.0 59.38 ? 504 GLN B CA 1 326 . B ATOM 3739 C C . GLN B 2 326 ? 0.658 32.940 -14.533 1.0 55.51 ? 504 GLN B C 1 326 . B ATOM 3740 O O . GLN B 2 326 ? 1.846 33.076 -14.234 1.0 54.74 ? 504 GLN B O 1 326 . B ATOM 3741 C CB . GLN B 2 326 ? -0.325 35.085 -15.380 1.0 54.7 ? 504 GLN B CB 1 326 . B ATOM 3742 C CG . GLN B 2 326 ? -1.408 34.893 -16.425 1.0 82.51 ? 504 GLN B CG 1 326 . B ATOM 3743 C CD . GLN B 2 326 ? -2.807 35.068 -15.856 1.0 104.63 ? 504 GLN B CD 1 326 . B ATOM 3744 O OE1 . GLN B 2 326 ? -3.121 36.097 -15.252 1.0 111.7 ? 504 GLN B OE1 1 326 . B ATOM 3745 N NE2 . GLN B 2 326 ? -3.652 34.059 -16.041 1.0 107.97 ? 504 GLN B NE2 1 326 . B ATOM 3746 N N . ARG B 2 327 ? 0.178 31.854 -15.134 1.0 60.36 ? 505 ARG B N 1 327 . B ATOM 3747 C CA . ARG B 2 327 ? 1.076 30.811 -15.615 1.0 57.22 ? 505 ARG B CA 1 327 . B ATOM 3748 C C . ARG B 2 327 ? 0.701 30.372 -17.027 1.0 65.54 ? 505 ARG B C 1 327 . B ATOM 3749 O O . ARG B 2 327 ? 1.430 30.657 -17.971 1.0 71.15 ? 505 ARG B O 1 327 . B ATOM 3750 C CB . ARG B 2 327 ? 1.076 29.613 -14.665 1.0 50.98 ? 505 ARG B CB 1 327 . B ATOM 3751 C CG . ARG B 2 327 ? 1.543 29.974 -13.253 1.0 58.13 ? 505 ARG B CG 1 327 . B ATOM 3752 C CD . ARG B 2 327 ? 1.712 28.742 -12.401 1.0 40.84 ? 505 ARG B CD 1 327 . B ATOM 3753 N NE . ARG B 2 327 ? 2.121 29.045 -11.032 1.0 36.37 ? 505 ARG B NE 1 327 . B ATOM 3754 C CZ . ARG B 2 327 ? 3.376 29.003 -10.589 1.0 43.3 ? 505 ARG B CZ 1 327 . B ATOM 3755 N NH1 . ARG B 2 327 ? 4.368 28.702 -11.411 1.0 36.88 ? 505 ARG B NH1 1 327 . B ATOM 3756 N NH2 . ARG B 2 327 ? 3.642 29.255 -9.304 1.0 39.33 ? 505 ARG B NH2 1 327 . B HETATM 3757 C C1 . A8S C 3 . ? 0.242 6.219 36.644 1.0 87.36 ? 301 A8S C C1 1 301 . A HETATM 3758 C C2 . A8S C 3 . ? 1.685 6.546 36.505 1.0 76.38 ? 301 A8S C C2 1 301 . A HETATM 3759 C C3 . A8S C 3 . ? 2.391 6.638 35.360 1.0 59.84 ? 301 A8S C C3 1 301 . A HETATM 3760 C C4 . A8S C 3 . ? 1.792 6.441 34.019 1.0 63.48 ? 301 A8S C C4 1 301 . A HETATM 3761 C C5 . A8S C 3 . ? 2.504 6.513 32.889 1.0 60.88 ? 301 A8S C C5 1 301 . A HETATM 3762 C C6 . A8S C 3 . ? 3.859 6.963 35.493 1.0 43.91 ? 301 A8S C C6 1 301 . A HETATM 3763 C C7 . A8S C 3 . ? 1.903 6.305 31.508 1.0 56.98 ? 301 A8S C C7 1 301 . A HETATM 3764 O O7 . A8S C 3 . ? 0.509 5.963 31.589 1.0 62.89 ? 301 A8S C O7 1 301 . A HETATM 3765 C C8 . A8S C 3 . ? 2.125 7.618 30.794 1.0 47.92 ? 301 A8S C C8 1 301 . A HETATM 3766 C C9 . A8S C 3 . ? 3.202 7.808 30.015 1.0 46.02 ? 301 A8S C C9 1 301 . A HETATM 3767 C C10 . A8S C 3 . ? 4.234 6.768 29.866 1.0 53.72 ? 301 A8S C C10 1 301 . A HETATM 3768 O O10 . A8S C 3 . ? 5.237 6.996 29.207 1.0 67.12 ? 301 A8S C O10 1 301 . A HETATM 3769 C C11 . A8S C 3 . ? 4.060 5.426 30.533 1.0 45.57 ? 301 A8S C C11 1 301 . A HETATM 3770 O O11 . A8S C 3 . ? -0.216 6.117 37.804 1.0 94.33 ? 301 A8S C O11 1 301 . A HETATM 3771 C C12 . A8S C 3 . ? 2.592 5.135 30.796 1.0 53.65 ? 301 A8S C C12 1 301 . A HETATM 3772 O O12 . A8S C 3 . ? -0.496 6.022 35.665 1.0 82.14 ? 301 A8S C O12 1 301 . A HETATM 3773 C C13 . A8S C 3 . ? 1.170 8.753 31.008 1.0 42.57 ? 301 A8S C C13 1 301 . A HETATM 3774 C C14 . A8S C 3 . ? 1.942 4.873 29.434 1.0 57.96 ? 301 A8S C C14 1 301 . A HETATM 3775 C C15 . A8S C 3 . ? 2.438 3.867 31.640 1.0 44.0 ? 301 A8S C C15 1 301 . A HETATM 3776 H H2 . A8S C 3 . ? 2.233 6.696 37.420 1.0 91.65 ? 301 A8S C H2 1 301 . A HETATM 3777 H H4 . A8S C 3 . ? 0.741 6.212 33.952 1.0 76.18 ? 301 A8S C H4 1 301 . A HETATM 3778 H H5 . A8S C 3 . ? 3.555 6.736 32.961 1.0 73.06 ? 301 A8S C H5 1 301 . A HETATM 3779 H H6 . A8S C 3 . ? 4.413 6.064 35.576 1.0 52.7 ? 301 A8S C H6 1 301 . A HETATM 3780 H H6A . A8S C 3 . ? 4.014 7.553 36.359 1.0 52.7 ? 301 A8S C H6A 1 301 . A HETATM 3781 H H6B . A8S C 3 . ? 4.181 7.499 34.638 1.0 52.7 ? 301 A8S C H6B 1 301 . A HETATM 3782 H HO7 . A8S C 3 . ? 0.027 6.677 32.029 1.0 75.47 ? 301 A8S C HO7 1 301 . A HETATM 3783 H H9 . A8S C 3 . ? 3.336 8.757 29.525 1.0 55.22 ? 301 A8S C H9 1 301 . A HETATM 3784 H H11 . A8S C 3 . ? 4.477 4.645 29.894 1.0 54.68 ? 301 A8S C H11 1 301 . A HETATM 3785 H H11A . A8S C 3 . ? 4.609 5.415 31.478 1.0 54.68 ? 301 A8S C H11A 1 301 . A HETATM 3786 H H13 . A8S C 3 . ? 1.471 9.312 31.856 1.0 51.08 ? 301 A8S C H13 1 301 . A HETATM 3787 H H13A . A8S C 3 . ? 0.196 8.369 31.165 1.0 51.08 ? 301 A8S C H13A 1 301 . A HETATM 3788 H H14 . A8S C 3 . ? 2.027 5.738 28.830 1.0 69.55 ? 301 A8S C H14 1 301 . A HETATM 3789 H H14A . A8S C 3 . ? 0.919 4.636 29.571 1.0 69.55 ? 301 A8S C H14A 1 301 . A HETATM 3790 H H14B . A8S C 3 . ? 2.431 4.062 28.960 1.0 69.55 ? 301 A8S C H14B 1 301 . A HETATM 3791 H H15 . A8S C 3 . ? 1.409 3.649 31.765 1.0 52.8 ? 301 A8S C H15 1 301 . A HETATM 3792 H H15A . A8S C 3 . ? 2.884 4.018 32.589 1.0 52.8 ? 301 A8S C H15A 1 301 . A HETATM 3793 H H15B . A8S C 3 . ? 2.914 3.058 31.151 1.0 52.8 ? 301 A8S C H15B 1 301 . A HETATM 3794 H H13B . A8S C 3 . ? 1.170 9.379 30.155 1.0 51.08 ? 301 A8S C H13B 1 301 . A HETATM 3795 C C1 . GOL D 4 . ? -7.241 14.513 -7.534 1.0 92.33 ? 601 GOL D C1 1 601 . B HETATM 3796 O O1 . GOL D 4 . ? -8.148 14.031 -8.509 1.0 95.79 ? 601 GOL D O1 1 601 . B HETATM 3797 C C2 . GOL D 4 . ? -7.266 16.045 -7.433 1.0 87.7 ? 601 GOL D C2 1 601 . B HETATM 3798 O O2 . GOL D 4 . ? -6.661 16.628 -8.570 1.0 89.06 ? 601 GOL D O2 1 601 . B HETATM 3799 C C3 . GOL D 4 . ? -8.691 16.570 -7.284 1.0 78.48 ? 601 GOL D C3 1 601 . B HETATM 3800 O O3 . GOL D 4 . ? -9.193 16.237 -6.009 1.0 78.91 ? 601 GOL D O3 1 601 . B HETATM 3801 MN MN . MN E 5 . ? 0.120 27.409 26.977 1.0 163.97 ? 602 MN E MN 1 602 . B HETATM 3802 MN MN . MN F 5 . ? -1.079 15.916 16.203 1.0 53.85 ? 603 MN F MN 1 603 . B HETATM 3803 MN MN . MN G 5 . ? 1.689 15.896 13.553 1.0 40.21 ? 604 MN G MN 1 604 . B HETATM 3804 CL CL . CL H 6 . ? 6.341 15.957 -9.634 1.0 57.77 ? 605 CL H CL 1 605 . B HETATM 3805 CL CL . CL I 6 . ? -3.144 6.851 17.133 1.0 82.13 ? 606 CL I CL 1 606 . B HETATM 3806 CL CL . CL J 6 . ? -2.774 17.274 -13.099 1.0 59.52 ? 607 CL J CL 1 607 . B HETATM 3807 CL CL . CL K 6 . ? -9.922 16.593 23.318 1.0 58.12 ? 608 CL K CL 1 608 . B HETATM 3808 CL CL . CL L 6 . ? 18.299 17.266 24.361 1.0 82.19 ? 609 CL L CL 1 609 . B HETATM 3809 CL CL . CL M 6 . ? 0.829 47.722 16.579 1.0 122.9 ? 610 CL M CL 1 610 . B HETATM 3810 O O . HOH N 7 . ? 3.184 20.637 63.286 1.0 73.54 ? 401 HOH N O 1 401 . A HETATM 3811 O O . HOH N 7 . ? 20.670 -2.890 40.882 1.0 74.84 ? 402 HOH N O 1 402 . A HETATM 3812 O O . HOH N 7 . ? 10.942 10.798 51.384 1.0 58.83 ? 403 HOH N O 1 403 . A HETATM 3813 O O . HOH N 7 . ? 11.897 6.432 63.135 1.0 52.89 ? 404 HOH N O 1 404 . A HETATM 3814 O O . HOH N 7 . ? -8.200 15.026 32.903 1.0 55.6 ? 405 HOH N O 1 405 . A HETATM 3815 O O . HOH N 7 . ? 1.139 8.867 22.645 1.0 47.16 ? 406 HOH N O 1 406 . A HETATM 3816 O O . HOH N 7 . ? -3.337 4.474 54.309 1.0 50.77 ? 407 HOH N O 1 407 . A HETATM 3817 O O . HOH N 7 . ? -5.125 13.679 30.521 1.0 66.32 ? 408 HOH N O 1 408 . A HETATM 3818 O O . HOH N 7 . ? 2.023 5.349 39.823 1.0 52.76 ? 409 HOH N O 1 409 . A HETATM 3819 O O . HOH N 7 . ? 3.474 15.864 44.781 1.0 57.49 ? 410 HOH N O 1 410 . A HETATM 3820 O O . HOH N 7 . ? -2.773 6.717 42.710 1.0 60.41 ? 411 HOH N O 1 411 . A HETATM 3821 O O . HOH N 7 . ? 11.505 1.062 31.902 1.0 57.55 ? 412 HOH N O 1 412 . A HETATM 3822 O O . HOH N 7 . ? 4.117 -8.859 37.628 1.0 60.96 ? 413 HOH N O 1 413 . A HETATM 3823 O O . HOH N 7 . ? 4.344 15.651 21.976 1.0 44.35 ? 414 HOH N O 1 414 . A HETATM 3824 O O . HOH N 7 . ? -14.899 3.469 45.266 1.0 50.26 ? 415 HOH N O 1 415 . A HETATM 3825 O O . HOH N 7 . ? -12.415 -8.610 37.079 1.0 68.71 ? 416 HOH N O 1 416 . A HETATM 3826 O O . HOH N 7 . ? -0.572 8.414 38.936 1.0 54.8 ? 417 HOH N O 1 417 . A HETATM 3827 O O . HOH N 7 . ? -4.616 20.548 48.810 1.0 55.19 ? 418 HOH N O 1 418 . A HETATM 3828 O O . HOH N 7 . ? 7.335 7.903 64.184 1.0 67.03 ? 419 HOH N O 1 419 . A HETATM 3829 O O . HOH N 7 . ? -0.283 20.148 58.376 1.0 50.08 ? 420 HOH N O 1 420 . A HETATM 3830 O O . HOH N 7 . ? -7.204 11.062 31.596 1.0 51.53 ? 421 HOH N O 1 421 . A HETATM 3831 O O . HOH N 7 . ? 5.400 15.036 47.198 1.0 41.48 ? 422 HOH N O 1 422 . A HETATM 3832 O O . HOH N 7 . ? -1.425 8.783 34.065 1.0 47.67 ? 423 HOH N O 1 423 . A HETATM 3833 O O . HOH N 7 . ? 7.521 6.150 27.942 1.0 45.14 ? 424 HOH N O 1 424 . A HETATM 3834 O O . HOH N 7 . ? 1.409 16.433 43.124 1.0 54.99 ? 425 HOH N O 1 425 . A HETATM 3835 O O . HOH N 7 . ? -4.033 18.644 37.186 1.0 52.02 ? 426 HOH N O 1 426 . A HETATM 3836 O O . HOH N 7 . ? 2.122 -2.784 43.560 1.0 51.94 ? 427 HOH N O 1 427 . A HETATM 3837 O O . HOH N 7 . ? 6.175 -3.888 31.865 1.0 62.95 ? 428 HOH N O 1 428 . A HETATM 3838 O O . HOH N 7 . ? -4.789 9.215 19.980 1.0 54.71 ? 429 HOH N O 1 429 . A HETATM 3839 O O . HOH N 7 . ? 1.187 19.645 60.949 1.0 60.2 ? 430 HOH N O 1 430 . A HETATM 3840 O O . HOH N 7 . ? -3.744 4.034 34.654 1.0 54.75 ? 431 HOH N O 1 431 . A HETATM 3841 O O . HOH N 7 . ? 21.746 6.498 36.610 1.0 63.05 ? 432 HOH N O 1 432 . A HETATM 3842 O O . HOH N 7 . ? 9.402 -5.198 46.775 1.0 56.69 ? 433 HOH N O 1 433 . A HETATM 3843 O O . HOH N 7 . ? -7.718 -10.284 35.421 1.0 59.34 ? 434 HOH N O 1 434 . A HETATM 3844 O O . HOH N 7 . ? -10.202 -6.591 47.401 1.0 64.48 ? 435 HOH N O 1 435 . A HETATM 3845 O O . HOH N 7 . ? 5.676 20.151 61.855 1.0 54.43 ? 436 HOH N O 1 436 . A HETATM 3846 O O . HOH N 7 . ? -17.057 20.090 50.049 1.0 64.75 ? 437 HOH N O 1 437 . A HETATM 3847 O O . HOH N 7 . ? -4.759 18.479 58.811 1.0 67.26 ? 438 HOH N O 1 438 . A HETATM 3848 O O . HOH O 7 . ? 1.365 30.976 -19.889 1.0 48.08 ? 701 HOH O O 1 701 . B HETATM 3849 O O . HOH O 7 . ? 3.266 54.298 2.947 1.0 75.56 ? 702 HOH O O 1 702 . B HETATM 3850 O O . HOH O 7 . ? 9.745 36.296 -12.772 1.0 58.62 ? 703 HOH O O 1 703 . B HETATM 3851 O O . HOH O 7 . ? 12.118 14.428 -0.227 1.0 54.1 ? 704 HOH O O 1 704 . B HETATM 3852 O O . HOH O 7 . ? -2.509 12.721 -6.666 1.0 46.12 ? 705 HOH O O 1 705 . B HETATM 3853 O O . HOH O 7 . ? -7.142 7.025 8.215 1.0 41.69 ? 706 HOH O O 1 706 . B HETATM 3854 O O . HOH O 7 . ? 0.355 14.690 14.545 1.0 42.06 ? 707 HOH O O 1 707 . B HETATM 3855 O O . HOH O 7 . ? 3.198 15.712 15.308 1.0 41.81 ? 708 HOH O O 1 708 . B HETATM 3856 O O . HOH O 7 . ? -5.695 22.655 26.947 1.0 40.5 ? 709 HOH O O 1 709 . B HETATM 3857 O O . HOH O 7 . ? 8.109 25.818 11.778 1.0 41.18 ? 710 HOH O O 1 710 . B HETATM 3858 O O . HOH O 7 . ? -12.796 22.916 20.153 1.0 45.5 ? 711 HOH O O 1 711 . B HETATM 3859 O O . HOH O 7 . ? -6.197 25.848 -11.525 1.0 43.84 ? 712 HOH O O 1 712 . B HETATM 3860 O O . HOH O 7 . ? 4.808 48.212 16.993 1.0 68.09 ? 713 HOH O O 1 713 . B HETATM 3861 O O . HOH O 7 . ? 9.730 32.192 -10.337 1.0 50.23 ? 714 HOH O O 1 714 . B HETATM 3862 O O . HOH O 7 . ? -2.692 15.823 14.518 1.0 37.78 ? 715 HOH O O 1 715 . B HETATM 3863 O O . HOH O 7 . ? 3.087 19.915 13.066 1.0 33.73 ? 716 HOH O O 1 716 . B HETATM 3864 O O . HOH O 7 . ? -8.474 29.404 -9.913 1.0 48.01 ? 717 HOH O O 1 717 . B HETATM 3865 O O . HOH O 7 . ? -8.570 29.730 -4.939 1.0 40.76 ? 718 HOH O O 1 718 . B HETATM 3866 O O . HOH O 7 . ? 7.783 32.616 11.956 1.0 46.21 ? 719 HOH O O 1 719 . B HETATM 3867 O O . HOH O 7 . ? -8.203 29.728 12.234 1.0 40.82 ? 720 HOH O O 1 720 . B HETATM 3868 O O . HOH O 7 . ? 8.467 19.618 12.012 1.0 50.35 ? 721 HOH O O 1 721 . B HETATM 3869 O O . HOH O 7 . ? -6.928 16.460 -3.907 1.0 59.77 ? 722 HOH O O 1 722 . B HETATM 3870 O O . HOH O 7 . ? -8.833 18.706 9.290 1.0 41.26 ? 723 HOH O O 1 723 . B HETATM 3871 O O . HOH O 7 . ? 7.875 4.482 0.102 1.0 52.29 ? 724 HOH O O 1 724 . B HETATM 3872 O O . HOH O 7 . ? 4.030 25.326 14.518 1.0 37.35 ? 725 HOH O O 1 725 . B HETATM 3873 O O . HOH O 7 . ? -0.788 15.662 -10.486 1.0 49.18 ? 726 HOH O O 1 726 . B HETATM 3874 O O . HOH O 7 . ? -2.746 27.961 -10.289 1.0 38.53 ? 727 HOH O O 1 727 . B HETATM 3875 O O . HOH O 7 . ? 13.208 31.577 29.979 1.0 48.58 ? 728 HOH O O 1 728 . B HETATM 3876 O O . HOH O 7 . ? -0.048 17.577 25.824 1.0 47.55 ? 729 HOH O O 1 729 . B HETATM 3877 O O . HOH O 7 . ? -5.226 11.721 21.626 1.0 47.53 ? 730 HOH O O 1 730 . B HETATM 3878 O O . HOH O 7 . ? -2.766 33.428 -4.100 1.0 46.66 ? 731 HOH O O 1 731 . B HETATM 3879 O O . HOH O 7 . ? -12.559 30.623 28.850 1.0 57.25 ? 732 HOH O O 1 732 . B HETATM 3880 O O . HOH O 7 . ? 9.587 11.790 -3.822 1.0 52.09 ? 733 HOH O O 1 733 . B HETATM 3881 O O . HOH O 7 . ? -14.120 20.356 18.647 1.0 54.22 ? 734 HOH O O 1 734 . B HETATM 3882 O O . HOH O 7 . ? 0.302 16.134 11.807 1.0 46.42 ? 735 HOH O O 1 735 . B HETATM 3883 O O . HOH O 7 . ? -6.043 19.917 20.101 1.0 37.13 ? 736 HOH O O 1 736 . B HETATM 3884 O O . HOH O 7 . ? 3.397 18.116 16.333 1.0 46.65 ? 737 HOH O O 1 737 . B HETATM 3885 O O . HOH O 7 . ? -3.425 35.215 -8.099 1.0 51.75 ? 738 HOH O O 1 738 . B HETATM 3886 O O . HOH O 7 . ? 1.470 18.823 17.899 1.0 38.3 ? 739 HOH O O 1 739 . B HETATM 3887 O O . HOH O 7 . ? 11.768 17.894 -6.832 1.0 37.43 ? 740 HOH O O 1 740 . B HETATM 3888 O O . HOH O 7 . ? 18.208 25.727 -5.779 1.0 46.86 ? 741 HOH O O 1 741 . B HETATM 3889 O O . HOH O 7 . ? -11.883 24.628 7.959 1.0 55.77 ? 742 HOH O O 1 742 . B HETATM 3890 O O . HOH O 7 . ? -1.301 31.323 -11.441 1.0 52.7 ? 743 HOH O O 1 743 . B HETATM 3891 O O . HOH O 7 . ? -7.348 19.364 -9.399 1.0 46.42 ? 744 HOH O O 1 744 . B HETATM 3892 O O . HOH O 7 . ? 5.598 20.458 -14.585 1.0 43.67 ? 745 HOH O O 1 745 . B HETATM 3893 O O . HOH O 7 . ? 9.261 34.654 20.436 1.0 57.66 ? 746 HOH O O 1 746 . B HETATM 3894 O O . HOH O 7 . ? 7.229 29.590 -12.986 1.0 38.22 ? 747 HOH O O 1 747 . B HETATM 3895 O O . HOH O 7 . ? 16.203 24.350 34.945 1.0 50.14 ? 748 HOH O O 1 748 . B HETATM 3896 O O . HOH O 7 . ? -16.924 29.945 22.869 1.0 50.22 ? 749 HOH O O 1 749 . B HETATM 3897 O O . HOH O 7 . ? 4.973 36.128 -7.733 1.0 50.55 ? 750 HOH O O 1 750 . B HETATM 3898 O O . HOH O 7 . ? -3.419 12.009 15.770 1.0 38.98 ? 751 HOH O O 1 751 . B HETATM 3899 O O . HOH O 7 . ? -2.477 15.552 -8.575 1.0 51.5 ? 752 HOH O O 1 752 . B HETATM 3900 O O . HOH O 7 . ? 9.285 17.664 10.565 1.0 54.2 ? 753 HOH O O 1 753 . B HETATM 3901 O O . HOH O 7 . ? 13.808 19.953 4.914 1.0 41.87 ? 754 HOH O O 1 754 . B HETATM 3902 O O . HOH O 7 . ? 1.678 5.497 5.325 1.0 52.05 ? 755 HOH O O 1 755 . B HETATM 3903 O O . HOH O 7 . ? -0.872 17.960 -11.342 1.0 54.8 ? 756 HOH O O 1 756 . B HETATM 3904 O O . HOH O 7 . ? 11.639 18.648 6.347 1.0 54.14 ? 757 HOH O O 1 757 . B HETATM 3905 O O . HOH O 7 . ? -9.880 21.200 9.675 1.0 40.24 ? 758 HOH O O 1 758 . B HETATM 3906 O O . HOH O 7 . ? 9.793 23.122 -9.737 1.0 35.39 ? 759 HOH O O 1 759 . B HETATM 3907 O O . HOH O 7 . ? -10.010 29.702 -7.774 1.0 54.55 ? 760 HOH O O 1 760 . B HETATM 3908 O O . HOH O 7 . ? 13.356 24.231 7.966 1.0 41.22 ? 761 HOH O O 1 761 . B HETATM 3909 O O . HOH O 7 . ? -15.086 34.003 17.534 1.0 51.97 ? 762 HOH O O 1 762 . B HETATM 3910 O O . HOH O 7 . ? 10.077 31.421 28.605 1.0 45.92 ? 763 HOH O O 1 763 . B HETATM 3911 O O . HOH O 7 . ? -11.894 28.435 -8.252 1.0 60.7 ? 764 HOH O O 1 764 . B HETATM 3912 O O . HOH O 7 . ? 8.326 6.496 7.049 1.0 58.59 ? 765 HOH O O 1 765 . B HETATM 3913 O O . HOH O 7 . ? 8.665 31.436 29.997 1.0 54.05 ? 766 HOH O O 1 766 . B HETATM 3914 O O . HOH O 7 . ? 0.768 16.040 17.619 1.0 60.68 ? 767 HOH O O 1 767 . B HETATM 3915 O O . HOH O 7 . ? 12.978 24.105 11.583 1.0 46.42 ? 768 HOH O O 1 768 . B HETATM 3916 O O . HOH O 7 . ? -11.765 26.880 6.068 1.0 53.68 ? 769 HOH O O 1 769 . B HETATM 3917 O O . HOH O 7 . ? -11.039 11.719 14.950 1.0 49.07 ? 770 HOH O O 1 770 . B HETATM 3918 O O . HOH O 7 . ? -7.828 53.356 -0.647 1.0 57.75 ? 771 HOH O O 1 771 . B HETATM 3919 O O . HOH O 7 . ? 8.607 37.554 16.503 1.0 58.32 ? 772 HOH O O 1 772 . B HETATM 3920 O O . HOH O 7 . ? -1.587 13.762 17.197 1.0 46.42 ? 773 HOH O O 1 773 . B HETATM 3921 O O . HOH O 7 . ? 11.652 24.537 -9.768 1.0 43.06 ? 774 HOH O O 1 774 . B HETATM 3922 O O . HOH O 7 . ? 5.681 11.067 9.999 1.0 56.56 ? 775 HOH O O 1 775 . B HETATM 3923 O O . HOH O 7 . ? 5.150 29.615 -14.475 1.0 47.05 ? 776 HOH O O 1 776 . B HETATM 3924 O O . HOH O 7 . ? -3.962 9.429 17.510 1.0 34.83 ? 777 HOH O O 1 777 . B HETATM 3925 O O . HOH O 7 . ? 8.013 7.421 9.263 1.0 58.83 ? 778 HOH O O 1 778 . B HETATM 3926 O O . HOH O 7 . ? -2.887 36.478 -3.524 1.0 64.29 ? 779 HOH O O 1 779 . B HETATM 3927 O O . HOH O 7 . ? -7.742 12.146 23.458 1.0 51.78 ? 780 HOH O O 1 780 . B HETATM 3928 O O . HOH O 7 . ? 4.365 21.002 -17.211 1.0 41.64 ? 781 HOH O O 1 781 . B HETATM 3929 O O . HOH O 7 . ? -1.402 16.697 -14.397 1.0 66.92 ? 782 HOH O O 1 782 . B HETATM 3930 O O . HOH O 7 . ? 6.079 33.043 30.105 1.0 51.68 ? 783 HOH O O 1 783 . B #