data_0 # _entry.id 0 # _struct_asym.id A _struct_asym.entity_id 0 # _entity_poly.entity_id 0 _entity_poly.type polypeptide(L) _entity_poly.pdbx_strand_id A # _entity.id 0 _entity.type polymer # loop_ _entity_poly_seq.entity_id _entity_poly_seq.num _entity_poly_seq.mon_id 0 1 MET 0 2 PRO 0 3 SER 0 4 HIS 0 5 ASP 0 6 ILE 0 7 PHE 0 8 LYS 0 9 PRO 0 10 GLY 0 11 VAL 0 12 THR 0 13 HIS 0 14 SER 0 15 ASP 0 16 PHE 0 17 GLY 0 18 VAL 0 19 TYR 0 20 VAL 0 21 THR 0 22 HIS 0 23 GLN 0 24 ASN 0 25 ASP 0 26 GLN 0 27 ASN 0 28 LEU 0 29 SER 0 30 TRP 0 31 ILE 0 32 LEU 0 33 ARG 0 34 TYR 0 35 ASP 0 36 ARG 0 37 TRP 0 38 GLN 0 39 PRO 0 40 LEU 0 41 VAL 0 42 LYS 0 43 LEU 0 44 SER 0 45 LEU 0 46 VAL 0 47 VAL 0 48 ALA 0 49 VAL 0 50 ALA 0 51 THR 0 52 ILE 0 53 GLY 0 54 GLY 0 55 CYS 0 56 VAL 0 57 THR 0 58 LEU 0 59 ASP 0 60 ASN 0 61 ILE 0 62 ARG 0 63 ARG 0 64 ASP 0 65 PHE 0 66 LEU 0 67 LEU 0 68 CYS 0 69 PHE 0 70 GLU 0 71 GLY 0 72 ARG 0 73 PHE 0 74 ASP 0 75 ASP 0 76 SER 0 77 GLY 0 78 PHE 0 79 MET 0 80 ARG 0 81 PHE 0 82 PRO 0 83 SER 0 84 HIS 0 85 LYS 0 86 GLN 0 87 LEU 0 88 PRO 0 89 VAL 0 90 CYS 0 91 GLY 0 92 ALA 0 93 TYR 0 94 SER 0 95 LEU 0 96 SER 0 97 SER 0 98 THR 0 99 GLU 0 100 SER 0 101 ASN 0 102 SER 0 103 ILE 0 104 SER 0 105 PRO 0 106 GLU 0 107 SER 0 108 LYS 0 109 LEU 0 110 PHE 0 111 CYS 0 112 PRO 0 113 ASN 0 114 CYS 0 115 VAL 0 116 GLN 0 117 TRP 0 118 VAL 0 119 SER 0 120 LEU 0 121 ILE 0 122 LEU 0 123 ASN 0 124 ASN 0 125 ALA 0 126 THR 0 127 SER 0 128 TYR 0 129 PRO 0 130 LEU 0 131 LEU 0 132 GLY 0 133 CYS 0 134 SER 0 135 SER # loop_ _chem_comp.id _chem_comp.type _chem_comp.name ALA 'L-peptide linking' ALANINE ARG 'L-peptide linking' ARGININE ASN 'L-peptide linking' ASPARAGINE ASP 'L-peptide linking' 'ASPARTIC ACID' CYS 'L-peptide linking' CYSTEINE GLN 'L-peptide linking' GLUTAMINE GLU 'L-peptide linking' 'GLUTAMIC ACID' HIS 'L-peptide linking' HISTIDINE ILE 'L-peptide linking' ISOLEUCINE LEU 'L-peptide linking' LEUCINE LYS 'L-peptide linking' LYSINE MET 'L-peptide linking' METHIONINE PHE 'L-peptide linking' PHENYLALANINE PRO 'L-peptide linking' PROLINE SER 'L-peptide linking' SERINE THR 'L-peptide linking' THREONINE TRP 'L-peptide linking' TRYPTOPHAN TYR 'L-peptide linking' TYROSINE VAL 'L-peptide linking' VALINE GLY 'peptide linking' GLYCINE # 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.auth_seq_id _atom_site.auth_asym_id _atom_site.pdbx_PDB_model_num ATOM 1 N N . MET A 0 1 . -30.170 -24.557 59.824 1.00 56.24 1 A 1 ATOM 2 C CA . MET A 0 1 . -29.550 -23.216 59.855 1.00 56.24 1 A 1 ATOM 3 C C . MET A 0 1 . -28.617 -23.113 58.656 1.00 56.24 1 A 1 ATOM 4 C CB . MET A 0 1 . -28.764 -23.003 61.165 1.00 56.24 1 A 1 ATOM 5 O O . MET A 0 1 . -27.532 -23.671 58.733 1.00 56.24 1 A 1 ATOM 6 C CG . MET A 0 1 . -29.671 -22.888 62.395 1.00 56.24 1 A 1 ATOM 7 S SD . MET A 0 1 . -28.789 -22.974 63.974 1.00 56.24 1 A 1 ATOM 8 C CE . MET A 0 1 . -28.033 -21.326 64.059 1.00 56.24 1 A 1 ATOM 9 N N . PRO A 0 2 . -29.041 -22.534 57.523 1.00 61.56 2 A 1 ATOM 10 C CA . PRO A 0 2 . -28.175 -22.373 56.360 1.00 61.56 2 A 1 ATOM 11 C C . PRO A 0 2 . -27.364 -21.082 56.521 1.00 61.56 2 A 1 ATOM 12 C CB . PRO A 0 2 . -29.103 -22.348 55.136 1.00 61.56 2 A 1 ATOM 13 O O . PRO A 0 2 . -27.933 -19.995 56.586 1.00 61.56 2 A 1 ATOM 14 C CG . PRO A 0 2 . -30.525 -22.442 55.701 1.00 61.56 2 A 1 ATOM 15 C CD . PRO A 0 2 . -30.379 -22.087 57.178 1.00 61.56 2 A 1 ATOM 16 N N . SER A 0 3 . -26.045 -21.204 56.641 1.00 78.18 3 A 1 ATOM 17 C CA . SER A 0 3 . -25.119 -20.074 56.596 1.00 78.18 3 A 1 ATOM 18 C C . SER A 0 3 . -25.033 -19.578 55.156 1.00 78.18 3 A 1 ATOM 19 C CB . SER A 0 3 . -23.742 -20.498 57.119 1.00 78.18 3 A 1 ATOM 20 O O . SER A 0 3 . -24.582 -20.296 54.270 1.00 78.18 3 A 1 ATOM 21 O OG . SER A 0 3 . -23.312 -21.687 56.487 1.00 78.18 3 A 1 ATOM 22 N N . HIS A 0 4 . -25.532 -18.370 54.917 1.00 75.24 4 A 1 ATOM 23 C CA . HIS A 0 4 . -25.493 -17.727 53.614 1.00 75.24 4 A 1 ATOM 24 C C . HIS A 0 4 . -24.063 -17.257 53.329 1.00 75.24 4 A 1 ATOM 25 C CB . HIS A 0 4 . -26.522 -16.587 53.599 1.00 75.24 4 A 1 ATOM 26 O O . HIS A 0 4 . -23.589 -16.297 53.936 1.00 75.24 4 A 1 ATOM 27 C CG . HIS A 0 4 . -27.933 -17.079 53.821 1.00 75.24 4 A 1 ATOM 28 C CD2 . HIS A 0 4 . -28.653 -17.036 54.987 1.00 75.24 4 A 1 ATOM 29 N ND1 . HIS A 0 4 . -28.722 -17.707 52.886 1.00 75.24 4 A 1 ATOM 30 C CE1 . HIS A 0 4 . -29.888 -18.027 53.470 1.00 75.24 4 A 1 ATOM 31 N NE2 . HIS A 0 4 . -29.896 -17.637 54.753 1.00 75.24 4 A 1 ATOM 32 N N . ASP A 0 5 . -23.380 -17.959 52.426 1.00 73.47 5 A 1 ATOM 33 C CA . ASP A 0 5 . -22.058 -17.590 51.934 1.00 73.47 5 A 1 ATOM 34 C C . ASP A 0 5 . -22.138 -16.273 51.155 1.00 73.47 5 A 1 ATOM 35 C CB . ASP A 0 5 . -21.458 -18.726 51.091 1.00 73.47 5 A 1 ATOM 36 O O . ASP A 0 5 . -22.714 -16.168 50.070 1.00 73.47 5 A 1 ATOM 37 C CG . ASP A 0 5 . -20.976 -19.895 51.957 1.00 73.47 5 A 1 ATOM 38 O OD1 . ASP A 0 5 . -20.369 -19.616 53.017 1.00 73.47 5 A 1 ATOM 39 O OD2 . ASP A 0 5 . -21.218 -21.051 51.549 1.00 73.47 5 A 1 ATOM 40 N N . ILE A 0 6 . -21.561 -15.239 51.763 1.00 81.25 6 A 1 ATOM 41 C CA . ILE A 0 6 . -21.398 -13.900 51.206 1.00 81.25 6 A 1 ATOM 42 C C . ILE A 0 6 . -20.302 -13.981 50.139 1.00 81.25 6 A 1 ATOM 43 C CB . ILE A 0 6 . -21.091 -12.894 52.347 1.00 81.25 6 A 1 ATOM 44 O O . ILE A 0 6 . -19.120 -13.756 50.407 1.00 81.25 6 A 1 ATOM 45 C CG1 . ILE A 0 6 . -22.288 -12.805 53.326 1.00 81.25 6 A 1 ATOM 46 C CG2 . ILE A 0 6 . -20.762 -11.486 51.807 1.00 81.25 6 A 1 ATOM 47 C CD1 . ILE A 0 6 . -21.985 -12.050 54.627 1.00 81.25 6 A 1 ATOM 48 N N . PHE A 0 7 . -20.686 -14.300 48.906 1.00 74.35 7 A 1 ATOM 49 C CA . PHE A 0 7 . -19.834 -14.051 47.750 1.00 74.35 7 A 1 ATOM 50 C C . PHE A 0 7 . -19.709 -12.535 47.570 1.00 74.35 7 A 1 ATOM 51 C CB . PHE A 0 7 . -20.393 -14.750 46.502 1.00 74.35 7 A 1 ATOM 52 O O . PHE A 0 7 . -20.649 -11.872 47.139 1.00 74.35 7 A 1 ATOM 53 C CG . PHE A 0 7 . -19.999 -16.212 46.411 1.00 74.35 7 A 1 ATOM 54 C CD1 . PHE A 0 7 . -18.788 -16.571 45.786 1.00 74.35 7 A 1 ATOM 55 C CD2 . PHE A 0 7 . -20.817 -17.211 46.972 1.00 74.35 7 A 1 ATOM 56 C CE1 . PHE A 0 7 . -18.400 -17.921 45.716 1.00 74.35 7 A 1 ATOM 57 C CE2 . PHE A 0 7 . -20.429 -18.561 46.900 1.00 74.35 7 A 1 ATOM 58 C CZ . PHE A 0 7 . -19.222 -18.916 46.272 1.00 74.35 7 A 1 ATOM 59 N N . LYS A 0 8 . -18.551 -11.971 47.931 1.00 69.93 8 A 1 ATOM 60 C CA . LYS A 0 8 . -18.164 -10.606 47.555 1.00 69.93 8 A 1 ATOM 61 C C . LYS A 0 8 . -17.753 -10.619 46.077 1.00 69.93 8 A 1 ATOM 62 C CB . LYS A 0 8 . -16.997 -10.105 48.427 1.00 69.93 8 A 1 ATOM 63 O O . LYS A 0 8 . -16.692 -11.169 45.780 1.00 69.93 8 A 1 ATOM 64 C CG . LYS A 0 8 . -17.435 -9.645 49.824 1.00 69.93 8 A 1 ATOM 65 C CD . LYS A 0 8 . -16.224 -9.125 50.613 1.00 69.93 8 A 1 ATOM 66 C CE . LYS A 0 8 . -16.664 -8.595 51.982 1.00 69.93 8 A 1 ATOM 67 N NZ . LYS A 0 8 . -15.500 -8.145 52.787 1.00 69.93 8 A 1 ATOM 68 N N . PRO A 0 9 . -18.528 -10.035 45.146 1.00 69.21 9 A 1 ATOM 69 C CA . PRO A 0 9 . -18.053 -9.837 43.785 1.00 69.21 9 A 1 ATOM 70 C C . PRO A 0 9 . -16.893 -8.836 43.819 1.00 69.21 9 A 1 ATOM 71 C CB . PRO A 0 9 . -19.268 -9.353 42.988 1.00 69.21 9 A 1 ATOM 72 O O . PRO A 0 9 . -17.063 -7.666 44.162 1.00 69.21 9 A 1 ATOM 73 C CG . PRO A 0 9 . -20.139 -8.667 44.038 1.00 69.21 9 A 1 ATOM 74 C CD . PRO A 0 9 . -19.859 -9.464 45.309 1.00 69.21 9 A 1 ATOM 75 N N . GLY A 0 10 . -15.690 -9.320 43.515 1.00 68.48 10 A 1 ATOM 76 C CA . GLY A 0 10 . -14.532 -8.470 43.281 1.00 68.48 10 A 1 ATOM 77 C C . GLY A 0 10 . -14.763 -7.672 42.006 1.00 68.48 10 A 1 ATOM 78 O O . GLY A 0 10 . -14.826 -8.241 40.920 1.00 68.48 10 A 1 ATOM 79 N N . VAL A 0 11 . -14.911 -6.357 42.140 1.00 62.14 11 A 1 ATOM 80 C CA . VAL A 0 11 . -14.942 -5.423 41.013 1.00 62.14 11 A 1 ATOM 81 C C . VAL A 0 11 . -13.518 -5.319 40.469 1.00 62.14 11 A 1 ATOM 82 C CB . VAL A 0 11 . -15.522 -4.055 41.440 1.00 62.14 11 A 1 ATOM 83 O O . VAL A 0 11 . -12.754 -4.433 40.841 1.00 62.14 11 A 1 ATOM 84 C CG1 . VAL A 0 11 . -15.592 -3.065 40.269 1.00 62.14 11 A 1 ATOM 85 C CG2 . VAL A 0 11 . -16.948 -4.210 41.992 1.00 62.14 11 A 1 ATOM 86 N N . THR A 0 12 . -13.115 -6.264 39.624 1.00 60.75 12 A 1 ATOM 87 C CA . THR A 0 12 . -11.948 -6.070 38.763 1.00 60.75 12 A 1 ATOM 88 C C . THR A 0 12 . -12.372 -5.150 37.630 1.00 60.75 12 A 1 ATOM 89 C CB . THR A 0 12 . -11.349 -7.386 38.249 1.00 60.75 12 A 1 ATOM 90 O O . THR A 0 12 . -13.055 -5.561 36.694 1.00 60.75 12 A 1 ATOM 91 C CG2 . THR A 0 12 . -10.451 -8.015 39.313 1.00 60.75 12 A 1 ATOM 92 O OG1 . THR A 0 12 . -12.357 -8.314 37.932 1.00 60.75 12 A 1 ATOM 93 N N . HIS A 0 13 . -11.997 -3.881 37.771 1.00 60.79 13 A 1 ATOM 94 C CA . HIS A 0 13 . -12.125 -2.820 36.779 1.00 60.79 13 A 1 ATOM 95 C C . HIS A 0 13 . -11.223 -3.143 35.578 1.00 60.79 13 A 1 ATOM 96 C CB . HIS A 0 13 . -11.755 -1.502 37.483 1.00 60.79 13 A 1 ATOM 97 O O . HIS A 0 13 . -10.102 -2.656 35.456 1.00 60.79 13 A 1 ATOM 98 C CG . HIS A 0 13 . -12.238 -0.252 36.800 1.00 60.79 13 A 1 ATOM 99 C CD2 . HIS A 0 13 . -13.400 0.411 37.091 1.00 60.79 13 A 1 ATOM 100 N ND1 . HIS A 0 13 . -11.565 0.525 35.888 1.00 60.79 13 A 1 ATOM 101 C CE1 . HIS A 0 13 . -12.313 1.610 35.630 1.00 60.79 13 A 1 ATOM 102 N NE2 . HIS A 0 13 . -13.440 1.593 36.355 1.00 60.79 13 A 1 ATOM 103 N N . SER A 0 14 . -11.658 -4.071 34.730 1.00 61.06 14 A 1 ATOM 104 C CA . SER A 0 14 . -10.981 -4.369 33.473 1.00 61.06 14 A 1 ATOM 105 C C . SER A 0 14 . -11.551 -3.452 32.395 1.00 61.06 14 A 1 ATOM 106 C CB . SER A 0 14 . -11.093 -5.858 33.128 1.00 61.06 14 A 1 ATOM 107 O O . SER A 0 14 . -12.462 -3.835 31.666 1.00 61.06 14 A 1 ATOM 108 O OG . SER A 0 14 . -10.432 -6.635 34.114 1.00 61.06 14 A 1 ATOM 109 N N . ASP A 0 15 . -10.983 -2.248 32.281 1.00 65.53 15 A 1 ATOM 110 C CA . ASP A 0 15 . -11.304 -1.207 31.280 1.00 65.53 15 A 1 ATOM 111 C C . ASP A 0 15 . -11.071 -1.608 29.810 1.00 65.53 15 A 1 ATOM 112 C CB . ASP A 0 15 . -10.492 0.063 31.589 1.00 65.53 15 A 1 ATOM 113 O O . ASP A 0 15 . -11.102 -0.777 28.909 1.00 65.53 15 A 1 ATOM 114 C CG . ASP A 0 15 . -11.065 0.846 32.754 1.00 65.53 15 A 1 ATOM 115 O OD1 . ASP A 0 15 . -12.306 0.967 32.818 1.00 65.53 15 A 1 ATOM 116 O OD2 . ASP A 0 15 . -10.244 1.288 33.589 1.00 65.53 15 A 1 ATOM 117 N N . PHE A 0 16 . -10.854 -2.889 29.528 1.00 60.21 16 A 1 ATOM 118 C CA . PHE A 0 16 . -10.689 -3.414 28.174 1.00 60.21 16 A 1 ATOM 119 C C . PHE A 0 16 . -11.636 -4.586 27.901 1.00 60.21 16 A 1 ATOM 120 C CB . PHE A 0 16 . -9.201 -3.672 27.899 1.00 60.21 16 A 1 ATOM 121 O O . PHE A 0 16 . -11.302 -5.542 27.202 1.00 60.21 16 A 1 ATOM 122 C CG . PHE A 0 16 . -8.489 -2.432 27.395 1.00 60.21 16 A 1 ATOM 123 C CD1 . PHE A 0 16 . -8.494 -2.150 26.015 1.00 60.21 16 A 1 ATOM 124 C CD2 . PHE A 0 16 . -7.859 -1.544 28.287 1.00 60.21 16 A 1 ATOM 125 C CE1 . PHE A 0 16 . -7.859 -0.996 25.526 1.00 60.21 16 A 1 ATOM 126 C CE2 . PHE A 0 16 . -7.223 -0.389 27.797 1.00 60.21 16 A 1 ATOM 127 C CZ . PHE A 0 16 . -7.220 -0.117 26.418 1.00 60.21 16 A 1 ATOM 128 N N . GLY A 0 17 . -12.848 -4.519 28.455 1.00 54.42 17 A 1 ATOM 129 C CA . GLY A 0 17 . -13.939 -5.422 28.111 1.00 54.42 17 A 1 ATOM 130 C C . GLY A 0 17 . -14.526 -5.071 26.747 1.00 54.42 17 A 1 ATOM 131 O O . GLY A 0 17 . -15.541 -4.384 26.670 1.00 54.42 17 A 1 ATOM 132 N N . VAL A 0 18 . -13.907 -5.549 25.666 1.00 65.66 18 A 1 ATOM 133 C CA . VAL A 0 18 . -14.577 -5.647 24.362 1.00 65.66 18 A 1 ATOM 134 C C . VAL A 0 18 . -15.777 -6.574 24.562 1.00 65.66 18 A 1 ATOM 135 C CB . VAL A 0 18 . -13.622 -6.158 23.264 1.00 65.66 18 A 1 ATOM 136 O O . VAL A 0 18 . -15.629 -7.789 24.675 1.00 65.66 18 A 1 ATOM 137 C CG1 . VAL A 0 18 . -14.337 -6.328 21.916 1.00 65.66 18 A 1 ATOM 138 C CG2 . VAL A 0 18 . -12.461 -5.175 23.058 1.00 65.66 18 A 1 ATOM 139 N N . TYR A 0 19 . -16.960 -5.982 24.707 1.00 63.50 19 A 1 ATOM 140 C CA . TYR A 0 19 . -18.209 -6.689 24.953 1.00 63.50 19 A 1 ATOM 141 C C . TYR A 0 19 . -18.617 -7.401 23.658 1.00 63.50 19 A 1 ATOM 142 C CB . TYR A 0 19 . -19.251 -5.681 25.479 1.00 63.50 19 A 1 ATOM 143 O O . TYR A 0 19 . -19.219 -6.808 22.765 1.00 63.50 19 A 1 ATOM 144 C CG . TYR A 0 19 . -20.331 -6.275 26.363 1.00 63.50 19 A 1 ATOM 145 C CD1 . TYR A 0 19 . -21.557 -6.688 25.812 1.00 63.50 19 A 1 ATOM 146 C CD2 . TYR A 0 19 . -20.124 -6.368 27.753 1.00 63.50 19 A 1 ATOM 147 C CE1 . TYR A 0 19 . -22.577 -7.192 26.643 1.00 63.50 19 A 1 ATOM 148 C CE2 . TYR A 0 19 . -21.140 -6.869 28.591 1.00 63.50 19 A 1 ATOM 149 O OH . TYR A 0 19 . -23.360 -7.752 28.837 1.00 63.50 19 A 1 ATOM 150 C CZ . TYR A 0 19 . -22.371 -7.280 28.034 1.00 63.50 19 A 1 ATOM 151 N N . VAL A 0 20 . -18.216 -8.664 23.511 1.00 60.66 20 A 1 ATOM 152 C CA . VAL A 0 20 . -18.602 -9.500 22.368 1.00 60.66 20 A 1 ATOM 153 C C . VAL A 0 20 . -20.052 -9.943 22.581 1.00 60.66 20 A 1 ATOM 154 C CB . VAL A 0 20 . -17.631 -10.684 22.172 1.00 60.66 20 A 1 ATOM 155 O O . VAL A 0 20 . -20.325 -10.902 23.300 1.00 60.66 20 A 1 ATOM 156 C CG1 . VAL A 0 20 . -17.991 -11.488 20.917 1.00 60.66 20 A 1 ATOM 157 C CG2 . VAL A 0 20 . -16.182 -10.201 21.995 1.00 60.66 20 A 1 ATOM 158 N N . THR A 0 21 . -21.005 -9.200 22.018 1.00 71.49 21 A 1 ATOM 159 C CA . THR A 0 21 . -22.429 -9.561 22.042 1.00 71.49 21 A 1 ATOM 160 C C . THR A 0 21 . -22.685 -10.761 21.132 1.00 71.49 21 A 1 ATOM 161 C CB . THR A 0 21 . -23.329 -8.388 21.623 1.00 71.49 21 A 1 ATOM 162 O O . THR A 0 21 . -22.601 -10.650 19.913 1.00 71.49 21 A 1 ATOM 163 C CG2 . THR A 0 21 . -23.326 -7.271 22.660 1.00 71.49 21 A 1 ATOM 164 O OG1 . THR A 0 21 . -22.884 -7.826 20.412 1.00 71.49 21 A 1 ATOM 165 N N . HIS A 0 22 . -23.044 -11.890 21.741 1.00 65.74 22 A 1 ATOM 166 C CA . HIS A 0 22 . -23.248 -13.212 21.132 1.00 65.74 22 A 1 ATOM 167 C C . HIS A 0 22 . -24.597 -13.340 20.385 1.00 65.74 22 A 1 ATOM 168 C CB . HIS A 0 22 . -23.085 -14.239 22.269 1.00 65.74 22 A 1 ATOM 169 O O . HIS A 0 22 . -25.321 -14.332 20.517 1.00 65.74 22 A 1 ATOM 170 C CG . HIS A 0 22 . -22.769 -15.645 21.834 1.00 65.74 22 A 1 ATOM 171 C CD2 . HIS A 0 22 . -21.650 -16.364 22.156 1.00 65.74 22 A 1 ATOM 172 N ND1 . HIS A 0 22 . -23.562 -16.460 21.067 1.00 65.74 22 A 1 ATOM 173 C CE1 . HIS A 0 22 . -22.929 -17.634 20.912 1.00 65.74 22 A 1 ATOM 174 N NE2 . HIS A 0 22 . -21.770 -17.637 21.590 1.00 65.74 22 A 1 ATOM 175 N N . GLN A 0 23 . -25.006 -12.311 19.644 1.00 61.04 23 A 1 ATOM 176 C CA . GLN A 0 23 . -26.209 -12.368 18.816 1.00 61.04 23 A 1 ATOM 177 C C . GLN A 0 23 . -25.880 -11.844 17.421 1.00 61.04 23 A 1 ATOM 178 C CB . GLN A 0 23 . -27.401 -11.655 19.490 1.00 61.04 23 A 1 ATOM 179 O O . GLN A 0 23 . -25.685 -10.651 17.219 1.00 61.04 23 A 1 ATOM 180 C CG . GLN A 0 23 . -28.311 -12.666 20.216 1.00 61.04 23 A 1 ATOM 181 C CD . GLN A 0 23 . -29.541 -12.044 20.872 1.00 61.04 23 A 1 ATOM 182 N NE2 . GLN A 0 23 . -30.486 -12.847 21.315 1.00 61.04 23 A 1 ATOM 183 O OE1 . GLN A 0 23 . -29.690 -10.846 21.017 1.00 61.04 23 A 1 ATOM 184 N N . ASN A 0 24 . -25.865 -12.775 16.462 1.00 61.13 24 A 1 ATOM 185 C CA . ASN A 0 24 . -25.628 -12.571 15.029 1.00 61.13 24 A 1 ATOM 186 C C . ASN A 0 24 . -24.140 -12.471 14.594 1.00 61.13 24 A 1 ATOM 187 C CB . ASN A 0 24 . -26.596 -11.488 14.492 1.00 61.13 24 A 1 ATOM 188 O O . ASN A 0 24 . -23.740 -11.621 13.799 1.00 61.13 24 A 1 ATOM 189 C CG . ASN A 0 24 . -27.407 -11.930 13.295 1.00 61.13 24 A 1 ATOM 190 N ND2 . ASN A 0 24 . -27.969 -10.995 12.567 1.00 61.13 24 A 1 ATOM 191 O OD1 . ASN A 0 24 . -27.593 -13.102 13.018 1.00 61.13 24 A 1 ATOM 192 N N . ASP A 0 25 . -23.334 -13.414 15.097 1.00 61.98 25 A 1 ATOM 193 C CA . ASP A 0 25 . -21.860 -13.518 15.058 1.00 61.98 25 A 1 ATOM 194 C C . ASP A 0 25 . -21.147 -13.594 13.690 1.00 61.98 25 A 1 ATOM 195 C CB . ASP A 0 25 . -21.461 -14.764 15.882 1.00 61.98 25 A 1 ATOM 196 O O . ASP A 0 25 . -19.916 -13.626 13.649 1.00 61.98 25 A 1 ATOM 197 C CG . ASP A 0 25 . -21.338 -14.478 17.377 1.00 61.98 25 A 1 ATOM 198 O OD1 . ASP A 0 25 . -20.773 -13.418 17.720 1.00 61.98 25 A 1 ATOM 199 O OD2 . ASP A 0 25 . -21.829 -15.321 18.154 1.00 61.98 25 A 1 ATOM 200 N N . GLN A 0 26 . -21.836 -13.618 12.546 1.00 65.81 26 A 1 ATOM 201 C CA . GLN A 0 26 . -21.133 -13.831 11.267 1.00 65.81 26 A 1 ATOM 202 C C . GLN A 0 26 . -20.649 -12.549 10.573 1.00 65.81 26 A 1 ATOM 203 C CB . GLN A 0 26 . -21.929 -14.766 10.352 1.00 65.81 26 A 1 ATOM 204 O O . GLN A 0 26 . -19.690 -12.607 9.800 1.00 65.81 26 A 1 ATOM 205 C CG . GLN A 0 26 . -21.964 -16.183 10.958 1.00 65.81 26 A 1 ATOM 206 C CD . GLN A 0 26 . -22.351 -17.264 9.957 1.00 65.81 26 A 1 ATOM 207 N NE2 . GLN A 0 26 . -22.180 -18.522 10.305 1.00 65.81 26 A 1 ATOM 208 O OE1 . GLN A 0 26 . -22.791 -17.024 8.849 1.00 65.81 26 A 1 ATOM 209 N N . ASN A 0 27 . -21.218 -11.380 10.886 1.00 66.43 27 A 1 ATOM 210 C CA . ASN A 0 27 . -20.896 -10.153 10.141 1.00 66.43 27 A 1 ATOM 211 C C . ASN A 0 27 . -19.789 -9.296 10.781 1.00 66.43 27 A 1 ATOM 212 C CB . ASN A 0 27 . -22.196 -9.384 9.850 1.00 66.43 27 A 1 ATOM 213 O O . ASN A 0 27 . -19.036 -8.641 10.059 1.00 66.43 27 A 1 ATOM 214 C CG . ASN A 0 27 . -23.052 -10.071 8.792 1.00 66.43 27 A 1 ATOM 215 N ND2 . ASN A 0 27 . -24.212 -9.534 8.499 1.00 66.43 27 A 1 ATOM 216 O OD1 . ASN A 0 27 . -22.698 -11.080 8.208 1.00 66.43 27 A 1 ATOM 217 N N . LEU A 0 28 . -19.606 -9.344 12.106 1.00 66.00 28 A 1 ATOM 218 C CA . LEU A 0 28 . -18.582 -8.535 12.792 1.00 66.00 28 A 1 ATOM 219 C C . LEU A 0 28 . -17.142 -9.007 12.512 1.00 66.00 28 A 1 ATOM 220 C CB . LEU A 0 28 . -18.890 -8.500 14.301 1.00 66.00 28 A 1 ATOM 221 O O . LEU A 0 28 . -16.223 -8.189 12.476 1.00 66.00 28 A 1 ATOM 222 C CG . LEU A 0 28 . -19.988 -7.483 14.671 1.00 66.00 28 A 1 ATOM 223 C CD1 . LEU A 0 28 . -20.522 -7.770 16.072 1.00 66.00 28 A 1 ATOM 224 C CD2 . LEU A 0 28 . -19.452 -6.047 14.650 1.00 66.00 28 A 1 ATOM 225 N N . SER A 0 29 . -16.945 -10.303 12.230 1.00 71.74 29 A 1 ATOM 226 C CA . SER A 0 29 . -15.635 -10.877 11.865 1.00 71.74 29 A 1 ATOM 227 C C . SER A 0 29 . -15.002 -10.181 10.655 1.00 71.74 29 A 1 ATOM 228 C CB . SER A 0 29 . -15.794 -12.388 11.594 1.00 71.74 29 A 1 ATOM 229 O O . SER A 0 29 . -13.779 -10.061 10.581 1.00 71.74 29 A 1 ATOM 230 O OG . SER A 0 29 . -14.834 -12.918 10.680 1.00 71.74 29 A 1 ATOM 231 N N . TRP A 0 30 . -15.814 -9.730 9.697 1.00 74.32 30 A 1 ATOM 232 C CA . TRP A 0 30 . -15.304 -9.129 8.469 1.00 74.32 30 A 1 ATOM 233 C C . TRP A 0 30 . -14.793 -7.711 8.700 1.00 74.32 30 A 1 ATOM 234 C CB . TRP A 0 30 . -16.374 -9.217 7.382 1.00 74.32 30 A 1 ATOM 235 O O . TRP A 0 30 . -13.676 -7.407 8.290 1.00 74.32 30 A 1 ATOM 236 C CG . TRP A 0 30 . -16.621 -10.627 6.945 1.00 74.32 30 A 1 ATOM 237 C CD1 . TRP A 0 30 . -17.667 -11.403 7.306 1.00 74.32 30 A 1 ATOM 238 C CD2 . TRP A 0 30 . -15.780 -11.459 6.089 1.00 74.32 30 A 1 ATOM 239 C CE2 . TRP A 0 30 . -16.390 -12.744 5.970 1.00 74.32 30 A 1 ATOM 240 C CE3 . TRP A 0 30 . -14.563 -11.253 5.400 1.00 74.32 30 A 1 ATOM 241 N NE1 . TRP A 0 30 . -17.537 -12.651 6.732 1.00 74.32 30 A 1 ATOM 242 C CH2 . TRP A 0 30 . -14.620 -13.533 4.519 1.00 74.32 30 A 1 ATOM 243 C CZ2 . TRP A 0 30 . -15.826 -13.772 5.201 1.00 74.32 30 A 1 ATOM 244 C CZ3 . TRP A 0 30 . -13.991 -12.278 4.622 1.00 74.32 30 A 1 ATOM 245 N N . ILE A 0 31 . -15.547 -6.883 9.427 1.00 69.95 31 A 1 ATOM 246 C CA . ILE A 0 31 . -15.188 -5.479 9.683 1.00 69.95 31 A 1 ATOM 247 C C . ILE A 0 31 . -13.846 -5.393 10.424 1.00 69.95 31 A 1 ATOM 248 C CB . ILE A 0 31 . -16.336 -4.759 10.430 1.00 69.95 31 A 1 ATOM 249 O O . ILE A 0 31 . -12.938 -4.700 9.971 1.00 69.95 31 A 1 ATOM 250 C CG1 . ILE A 0 31 . -17.625 -4.783 9.568 1.00 69.95 31 A 1 ATOM 251 C CG2 . ILE A 0 31 . -15.936 -3.311 10.769 1.00 69.95 31 A 1 ATOM 252 C CD1 . ILE A 0 31 . -18.865 -4.203 10.258 1.00 69.95 31 A 1 ATOM 253 N N . LEU A 0 32 . -13.660 -6.199 11.476 1.00 70.41 32 A 1 ATOM 254 C CA . LEU A 0 32 . -12.406 -6.213 12.242 1.00 70.41 32 A 1 ATOM 255 C C . LEU A 0 32 . -11.201 -6.727 11.439 1.00 70.41 32 A 1 ATOM 256 C CB . LEU A 0 32 . -12.602 -7.058 13.512 1.00 70.41 32 A 1 ATOM 257 O O . LEU A 0 32 . -10.061 -6.354 11.730 1.00 70.41 32 A 1 ATOM 258 C CG . LEU A 0 32 . -13.430 -6.361 14.606 1.00 70.41 32 A 1 ATOM 259 C CD1 . LEU A 0 32 . -13.770 -7.375 15.699 1.00 70.41 32 A 1 ATOM 260 C CD2 . LEU A 0 32 . -12.662 -5.205 15.254 1.00 70.41 32 A 1 ATOM 261 N N . ARG A 0 33 . -11.412 -7.581 10.426 1.00 74.98 33 A 1 ATOM 262 C CA . ARG A 0 33 . -10.314 -8.006 9.546 1.00 74.98 33 A 1 ATOM 263 C C . ARG A 0 33 . -9.870 -6.878 8.624 1.00 74.98 33 A 1 ATOM 264 C CB . ARG A 0 33 . -10.662 -9.268 8.747 1.00 74.98 33 A 1 ATOM 265 O O . ARG A 0 33 . -8.670 -6.745 8.427 1.00 74.98 33 A 1 ATOM 266 C CG . ARG A 0 33 . -10.590 -10.536 9.608 1.00 74.98 33 A 1 ATOM 267 C CD . ARG A 0 33 . -10.820 -11.771 8.727 1.00 74.98 33 A 1 ATOM 268 N NE . ARG A 0 33 . -11.550 -12.825 9.451 1.00 74.98 33 A 1 ATOM 269 N NH1 . ARG A 0 33 . -10.703 -14.663 8.352 1.00 74.98 33 A 1 ATOM 270 N NH2 . ARG A 0 33 . -12.336 -14.903 9.865 1.00 74.98 33 A 1 ATOM 271 C CZ . ARG A 0 33 . -11.518 -14.123 9.221 1.00 74.98 33 A 1 ATOM 272 N N . TYR A 0 34 . -10.765 -6.048 8.093 1.00 76.28 34 A 1 ATOM 273 C CA . TYR A 0 34 . -10.355 -4.993 7.157 1.00 76.28 34 A 1 ATOM 274 C C . TYR A 0 34 . -9.453 -3.933 7.803 1.00 76.28 34 A 1 ATOM 275 C CB . TYR A 0 34 . -11.583 -4.382 6.475 1.00 76.28 34 A 1 ATOM 276 O O . TYR A 0 34 . -8.455 -3.536 7.190 1.00 76.28 34 A 1 ATOM 277 C CG . TYR A 0 34 . -12.139 -5.282 5.388 1.00 76.28 34 A 1 ATOM 278 C CD1 . TYR A 0 34 . -11.443 -5.414 4.170 1.00 76.28 34 A 1 ATOM 279 C CD2 . TYR A 0 34 . -13.331 -5.998 5.592 1.00 76.28 34 A 1 ATOM 280 C CE1 . TYR A 0 34 . -11.929 -6.275 3.167 1.00 76.28 34 A 1 ATOM 281 C CE2 . TYR A 0 34 . -13.807 -6.882 4.605 1.00 76.28 34 A 1 ATOM 282 O OH . TYR A 0 34 . -13.580 -7.859 2.433 1.00 76.28 34 A 1 ATOM 283 C CZ . TYR A 0 34 . -13.108 -7.018 3.390 1.00 76.28 34 A 1 ATOM 284 N N . ASP A 0 35 . -9.709 -3.572 9.062 1.00 79.39 35 A 1 ATOM 285 C CA . ASP A 0 35 . -8.928 -2.546 9.766 1.00 79.39 35 A 1 ATOM 286 C C . ASP A 0 35 . -7.447 -2.924 9.930 1.00 79.39 35 A 1 ATOM 287 C CB . ASP A 0 35 . -9.564 -2.270 11.137 1.00 79.39 35 A 1 ATOM 288 O O . ASP A 0 35 . -6.560 -2.074 9.837 1.00 79.39 35 A 1 ATOM 289 C CG . ASP A 0 35 . -10.883 -1.494 11.053 1.00 79.39 35 A 1 ATOM 290 O OD1 . ASP A 0 35 . -11.139 -0.880 9.993 1.00 79.39 35 A 1 ATOM 291 O OD2 . ASP A 0 35 . -11.608 -1.518 12.070 1.00 79.39 35 A 1 ATOM 292 N N . ARG A 0 36 . -7.137 -4.217 10.107 1.00 82.84 36 A 1 ATOM 293 C CA . ARG A 0 36 . -5.745 -4.680 10.255 1.00 82.84 36 A 1 ATOM 294 C C . ARG A 0 36 . -4.986 -4.799 8.939 1.00 82.84 36 A 1 ATOM 295 C CB . ARG A 0 36 . -5.696 -5.998 11.042 1.00 82.84 36 A 1 ATOM 296 O O . ARG A 0 36 . -3.758 -4.732 8.944 1.00 82.84 36 A 1 ATOM 297 C CG . ARG A 0 36 . -5.059 -5.761 12.415 1.00 82.84 36 A 1 ATOM 298 C CD . ARG A 0 36 . -4.972 -7.074 13.193 1.00 82.84 36 A 1 ATOM 299 N NE . ARG A 0 36 . -4.514 -6.841 14.574 1.00 82.84 36 A 1 ATOM 300 N NH1 . ARG A 0 36 . -4.485 -9.032 15.251 1.00 82.84 36 A 1 ATOM 301 N NH2 . ARG A 0 36 . -3.982 -7.419 16.709 1.00 82.84 36 A 1 ATOM 302 C CZ . ARG A 0 36 . -4.328 -7.761 15.501 1.00 82.84 36 A 1 ATOM 303 N N . TRP A 0 37 . -5.686 -4.989 7.824 1.00 84.17 37 A 1 ATOM 304 C CA . TRP A 0 37 . -5.049 -5.194 6.521 1.00 84.17 37 A 1 ATOM 305 C C . TRP A 0 37 . -4.775 -3.881 5.796 1.00 84.17 37 A 1 ATOM 306 C CB . TRP A 0 37 . -5.891 -6.147 5.675 1.00 84.17 37 A 1 ATOM 307 O O . TRP A 0 37 . -3.809 -3.800 5.040 1.00 84.17 37 A 1 ATOM 308 C CG . TRP A 0 37 . -5.807 -7.581 6.100 1.00 84.17 37 A 1 ATOM 309 C CD1 . TRP A 0 37 . -6.231 -8.085 7.279 1.00 84.17 37 A 1 ATOM 310 C CD2 . TRP A 0 37 . -5.164 -8.700 5.423 1.00 84.17 37 A 1 ATOM 311 C CE2 . TRP A 0 37 . -5.345 -9.874 6.216 1.00 84.17 37 A 1 ATOM 312 C CE3 . TRP A 0 37 . -4.402 -8.834 4.244 1.00 84.17 37 A 1 ATOM 313 N NE1 . TRP A 0 37 . -6.036 -9.445 7.321 1.00 84.17 37 A 1 ATOM 314 C CH2 . TRP A 0 37 . -4.083 -11.223 4.665 1.00 84.17 37 A 1 ATOM 315 C CZ2 . TRP A 0 37 . -4.832 -11.123 5.848 1.00 84.17 37 A 1 ATOM 316 C CZ3 . TRP A 0 37 . -3.863 -10.081 3.873 1.00 84.17 37 A 1 ATOM 317 N N . GLN A 0 38 . -5.552 -2.831 6.068 1.00 88.29 38 A 1 ATOM 318 C CA . GLN A 0 38 . -5.334 -1.511 5.479 1.00 88.29 38 A 1 ATOM 319 C C . GLN A 0 38 . -3.883 -0.989 5.619 1.00 88.29 38 A 1 ATOM 320 C CB . GLN A 0 38 . -6.361 -0.528 6.059 1.00 88.29 38 A 1 ATOM 321 O O . GLN A 0 38 . -3.325 -0.547 4.609 1.00 88.29 38 A 1 ATOM 322 C CG . GLN A 0 38 . -6.467 0.727 5.180 1.00 88.29 38 A 1 ATOM 323 C CD . GLN A 0 38 . -7.364 1.801 5.782 1.00 88.29 38 A 1 ATOM 324 N NE2 . GLN A 0 38 . -7.864 2.726 4.992 1.00 88.29 38 A 1 ATOM 325 O OE1 . GLN A 0 38 . -7.566 1.897 6.972 1.00 88.29 38 A 1 ATOM 326 N N . PRO A 0 39 . -3.221 -1.049 6.795 1.00 87.14 39 A 1 ATOM 327 C CA . PRO A 0 39 . -1.825 -0.624 6.912 1.00 87.14 39 A 1 ATOM 328 C C . PRO A 0 39 . -0.854 -1.540 6.155 1.00 87.14 39 A 1 ATOM 329 C CB . PRO A 0 39 . -1.529 -0.584 8.415 1.00 87.14 39 A 1 ATOM 330 O O . PRO A 0 39 . 0.095 -1.043 5.552 1.00 87.14 39 A 1 ATOM 331 C CG . PRO A 0 39 . -2.545 -1.549 9.021 1.00 87.14 39 A 1 ATOM 332 C CD . PRO A 0 39 . -3.755 -1.383 8.111 1.00 87.14 39 A 1 ATOM 333 N N . LEU A 0 40 . -1.111 -2.852 6.124 1.00 87.94 40 A 1 ATOM 334 C CA . LEU A 0 40 . -0.292 -3.822 5.388 1.00 87.94 40 A 1 ATOM 335 C C . LEU A 0 40 . -0.332 -3.569 3.879 1.00 87.94 40 A 1 ATOM 336 C CB . LEU A 0 40 . -0.767 -5.249 5.726 1.00 87.94 40 A 1 ATOM 337 O O . LEU A 0 40 . 0.719 -3.527 3.248 1.00 87.94 40 A 1 ATOM 338 C CG . LEU A 0 40 . -0.014 -5.852 6.923 1.00 87.94 40 A 1 ATOM 339 C CD1 . LEU A 0 40 . -0.854 -6.942 7.584 1.00 87.94 40 A 1 ATOM 340 C CD2 . LEU A 0 40 . 1.315 -6.464 6.472 1.00 87.94 40 A 1 ATOM 341 N N . VAL A 0 41 . -1.520 -3.327 3.318 1.00 86.59 41 A 1 ATOM 342 C CA . VAL A 0 41 . -1.693 -3.039 1.884 1.00 86.59 41 A 1 ATOM 343 C C . VAL A 0 41 . -1.004 -1.727 1.500 1.00 86.59 41 A 1 ATOM 344 C CB . VAL A 0 41 . -3.186 -3.023 1.506 1.00 86.59 41 A 1 ATOM 345 O O . VAL A 0 41 . -0.312 -1.661 0.480 1.00 86.59 41 A 1 ATOM 346 C CG1 . VAL A 0 41 . -3.410 -2.607 0.046 1.00 86.59 41 A 1 ATOM 347 C CG2 . VAL A 0 41 . -3.807 -4.416 1.682 1.00 86.59 41 A 1 ATOM 348 N N . LYS A 0 42 . -1.129 -0.687 2.338 1.00 86.98 42 A 1 ATOM 349 C CA . LYS A 0 42 . -0.416 0.585 2.130 1.00 86.98 42 A 1 ATOM 350 C C . LYS A 0 42 . 1.099 0.383 2.154 1.00 86.98 42 A 1 ATOM 351 C CB . LYS A 0 42 . -0.845 1.626 3.175 1.00 86.98 42 A 1 ATOM 352 O O . LYS A 0 42 . 1.782 0.870 1.257 1.00 86.98 42 A 1 ATOM 353 C CG . LYS A 0 42 . -2.234 2.208 2.875 1.00 86.98 42 A 1 ATOM 354 C CD . LYS A 0 42 . -2.641 3.225 3.951 1.00 86.98 42 A 1 ATOM 355 C CE . LYS A 0 42 . -4.029 3.800 3.636 1.00 86.98 42 A 1 ATOM 356 N NZ . LYS A 0 42 . -4.502 4.730 4.694 1.00 86.98 42 A 1 ATOM 357 N N . LEU A 0 43 . 1.614 -0.366 3.130 1.00 86.75 43 A 1 ATOM 358 C CA . LEU A 0 43 . 3.042 -0.659 3.238 1.00 86.75 43 A 1 ATOM 359 C C . LEU A 0 43 . 3.545 -1.447 2.022 1.00 86.75 43 A 1 ATOM 360 C CB . LEU A 0 43 . 3.305 -1.415 4.552 1.00 86.75 43 A 1 ATOM 361 O O . LEU A 0 43 . 4.550 -1.063 1.430 1.00 86.75 43 A 1 ATOM 362 C CG . LEU A 0 43 . 4.800 -1.642 4.847 1.00 86.75 43 A 1 ATOM 363 C CD1 . LEU A 0 43 . 5.512 -0.336 5.206 1.00 86.75 43 A 1 ATOM 364 C CD2 . LEU A 0 43 . 4.946 -2.612 6.019 1.00 86.75 43 A 1 ATOM 365 N N . SER A 0 44 . 2.828 -2.495 1.602 1.00 87.31 44 A 1 ATOM 366 C CA . SER A 0 44 . 3.223 -3.295 0.438 1.00 87.31 44 A 1 ATOM 367 C C . SER A 0 44 . 3.244 -2.477 -0.849 1.00 87.31 44 A 1 ATOM 368 C CB . SER A 0 44 . 2.321 -4.523 0.263 1.00 87.31 44 A 1 ATOM 369 O O . SER A 0 44 . 4.133 -2.668 -1.671 1.00 87.31 44 A 1 ATOM 370 O OG . SER A 0 44 . 0.951 -4.203 0.102 1.00 87.31 44 A 1 ATOM 371 N N . LEU A 0 45 . 2.311 -1.533 -1.011 1.00 87.43 45 A 1 ATOM 372 C CA . LEU A 0 45 . 2.276 -0.665 -2.183 1.00 87.43 45 A 1 ATOM 373 C C . LEU A 0 45 . 3.443 0.330 -2.185 1.00 87.43 45 A 1 ATOM 374 C CB . LEU A 0 45 . 0.906 0.025 -2.247 1.00 87.43 45 A 1 ATOM 375 O O . LEU A 0 45 . 4.085 0.507 -3.216 1.00 87.43 45 A 1 ATOM 376 C CG . LEU A 0 45 . 0.729 0.818 -3.559 1.00 87.43 45 A 1 ATOM 377 C CD1 . LEU A 0 45 . -0.551 0.391 -4.276 1.00 87.43 45 A 1 ATOM 378 C CD2 . LEU A 0 45 . 0.689 2.322 -3.282 1.00 87.43 45 A 1 ATOM 379 N N . VAL A 0 46 . 3.762 0.936 -1.037 1.00 85.44 46 A 1 ATOM 380 C CA . VAL A 0 46 . 4.932 1.822 -0.910 1.00 85.44 46 A 1 ATOM 381 C C . VAL A 0 46 . 6.222 1.063 -1.206 1.00 85.44 46 A 1 ATOM 382 C CB . VAL A 0 46 . 4.987 2.478 0.483 1.00 85.44 46 A 1 ATOM 383 O O . VAL A 0 46 . 7.050 1.563 -1.963 1.00 85.44 46 A 1 ATOM 384 C CG1 . VAL A 0 46 . 6.290 3.255 0.721 1.00 85.44 46 A 1 ATOM 385 C CG2 . VAL A 0 46 . 3.832 3.475 0.646 1.00 85.44 46 A 1 ATOM 386 N N . VAL A 0 47 . 6.374 -0.153 -0.672 1.00 84.81 47 A 1 ATOM 387 C CA . VAL A 0 47 . 7.537 -1.007 -0.952 1.00 84.81 47 A 1 ATOM 388 C C . VAL A 0 47 . 7.595 -1.361 -2.434 1.00 84.81 47 A 1 ATOM 389 C CB . VAL A 0 47 . 7.539 -2.270 -0.071 1.00 84.81 47 A 1 ATOM 390 O O . VAL A 0 47 . 8.634 -1.157 -3.042 1.00 84.81 47 A 1 ATOM 391 C CG1 . VAL A 0 47 . 8.655 -3.249 -0.460 1.00 84.81 47 A 1 ATOM 392 C CG2 . VAL A 0 47 . 7.759 -1.897 1.402 1.00 84.81 47 A 1 ATOM 393 N N . ALA A 0 48 . 6.492 -1.798 -3.046 1.00 86.61 48 A 1 ATOM 394 C CA . ALA A 0 48 . 6.463 -2.136 -4.467 1.00 86.61 48 A 1 ATOM 395 C C . ALA A 0 48 . 6.839 -0.939 -5.353 1.00 86.61 48 A 1 ATOM 396 C CB . ALA A 0 48 . 5.073 -2.677 -4.820 1.00 86.61 48 A 1 ATOM 397 O O . ALA A 0 48 . 7.662 -1.081 -6.254 1.00 86.61 48 A 1 ATOM 398 N N . VAL A 0 49 . 6.303 0.254 -5.076 1.00 84.87 49 A 1 ATOM 399 C CA . VAL A 0 49 . 6.647 1.465 -5.836 1.00 84.87 49 A 1 ATOM 400 C C . VAL A 0 49 . 8.094 1.887 -5.590 1.00 84.87 49 A 1 ATOM 401 C CB . VAL A 0 49 . 5.683 2.626 -5.533 1.00 84.87 49 A 1 ATOM 402 O O . VAL A 0 49 . 8.771 2.279 -6.536 1.00 84.87 49 A 1 ATOM 403 C CG1 . VAL A 0 49 . 6.122 3.891 -6.285 1.00 84.87 49 A 1 ATOM 404 C CG2 . VAL A 0 49 . 4.255 2.301 -5.992 1.00 84.87 49 A 1 ATOM 405 N N . ALA A 0 50 . 8.595 1.783 -4.359 1.00 83.76 50 A 1 ATOM 406 C CA . ALA A 0 50 . 9.992 2.069 -4.047 1.00 83.76 50 A 1 ATOM 407 C C . ALA A 0 50 . 10.941 1.071 -4.722 1.00 83.76 50 A 1 ATOM 408 C CB . ALA A 0 50 . 10.176 2.070 -2.527 1.00 83.76 50 A 1 ATOM 409 O O . ALA A 0 50 . 11.979 1.477 -5.231 1.00 83.76 50 A 1 ATOM 410 N N . THR A 0 51 . 10.579 -0.212 -4.780 1.00 84.70 51 A 1 ATOM 411 C CA . THR A 0 51 . 11.345 -1.237 -5.489 1.00 84.70 51 A 1 ATOM 412 C C . THR A 0 51 . 11.320 -0.976 -6.986 1.00 84.70 51 A 1 ATOM 413 C CB . THR A 0 51 . 10.837 -2.653 -5.178 1.00 84.70 51 A 1 ATOM 414 O O . THR A 0 51 . 12.382 -0.900 -7.578 1.00 84.70 51 A 1 ATOM 415 C CG2 . THR A 0 51 . 11.703 -3.736 -5.818 1.00 84.70 51 A 1 ATOM 416 O OG1 . THR A 0 51 . 10.883 -2.893 -3.792 1.00 84.70 51 A 1 ATOM 417 N N . ILE A 0 52 . 10.157 -0.748 -7.600 1.00 84.23 52 A 1 ATOM 418 C CA . ILE A 0 52 . 10.065 -0.475 -9.042 1.00 84.23 52 A 1 ATOM 419 C C . ILE A 0 52 . 10.789 0.833 -9.390 1.00 84.23 52 A 1 ATOM 420 C CB . ILE A 0 52 . 8.588 -0.468 -9.500 1.00 84.23 52 A 1 ATOM 421 O O . ILE A 0 52 . 11.610 0.855 -10.300 1.00 84.23 52 A 1 ATOM 422 C CG1 . ILE A 0 52 . 7.955 -1.872 -9.338 1.00 84.23 52 A 1 ATOM 423 C CG2 . ILE A 0 52 . 8.468 -0.023 -10.971 1.00 84.23 52 A 1 ATOM 424 C CD1 . ILE A 0 52 . 6.421 -1.857 -9.373 1.00 84.23 52 A 1 ATOM 425 N N . GLY A 0 53 . 10.548 1.912 -8.642 1.00 80.97 53 A 1 ATOM 426 C CA . GLY A 0 53 . 11.206 3.203 -8.854 1.00 80.97 53 A 1 ATOM 427 C C . GLY A 0 53 . 12.715 3.147 -8.607 1.00 80.97 53 A 1 ATOM 428 O O . GLY A 0 53 . 13.487 3.696 -9.390 1.00 80.97 53 A 1 ATOM 429 N N . GLY A 0 54 . 13.135 2.428 -7.565 1.00 80.39 54 A 1 ATOM 430 C CA . GLY A 0 54 . 14.538 2.171 -7.252 1.00 80.39 54 A 1 ATOM 431 C C . GLY A 0 54 . 15.222 1.318 -8.319 1.00 80.39 54 A 1 ATOM 432 O O . GLY A 0 54 . 16.334 1.642 -8.734 1.00 80.39 54 A 1 ATOM 433 N N . CYS A 0 55 . 14.541 0.289 -8.828 1.00 71.38 55 A 1 ATOM 434 C CA . CYS A 0 55 . 15.002 -0.540 -9.939 1.00 71.38 55 A 1 ATOM 435 C C . CYS A 0 55 . 15.165 0.283 -11.220 1.00 71.38 55 A 1 ATOM 436 C CB . CYS A 0 55 . 14.038 -1.715 -10.163 1.00 71.38 55 A 1 ATOM 437 O O . CYS A 0 55 . 16.173 0.122 -11.896 1.00 71.38 55 A 1 ATOM 438 S SG . CYS A 0 55 . 14.241 -2.975 -8.866 1.00 71.38 55 A 1 ATOM 439 N N . VAL A 0 56 . 14.250 1.216 -11.514 1.00 65.37 56 A 1 ATOM 440 C CA . VAL A 0 56 . 14.371 2.113 -12.679 1.00 65.37 56 A 1 ATOM 441 C C . VAL A 0 56 . 15.595 3.026 -12.553 1.00 65.37 56 A 1 ATOM 442 C CB . VAL A 0 56 . 13.078 2.929 -12.883 1.00 65.37 56 A 1 ATOM 443 O O . VAL A 0 56 . 16.290 3.268 -13.534 1.00 65.37 56 A 1 ATOM 444 C CG1 . VAL A 0 56 . 13.215 4.013 -13.961 1.00 65.37 56 A 1 ATOM 445 C CG2 . VAL A 0 56 . 11.920 2.026 -13.330 1.00 65.37 56 A 1 ATOM 446 N N . THR A 0 57 . 15.924 3.506 -11.351 1.00 61.31 57 A 1 ATOM 447 C CA . THR A 0 57 . 17.162 4.284 -11.148 1.00 61.31 57 A 1 ATOM 448 C C . THR A 0 57 . 18.424 3.422 -11.139 1.00 61.31 57 A 1 ATOM 449 C CB . THR A 0 57 . 17.094 5.134 -9.877 1.00 61.31 57 A 1 ATOM 450 O O . THR A 0 57 . 19.505 3.902 -11.478 1.00 61.31 57 A 1 ATOM 451 C CG2 . THR A 0 57 . 16.116 6.293 -10.072 1.00 61.31 57 A 1 ATOM 452 O OG1 . THR A 0 57 . 16.654 4.406 -8.753 1.00 61.31 57 A 1 ATOM 453 N N . LEU A 0 58 . 18.288 2.142 -10.792 1.00 58.12 58 A 1 ATOM 454 C CA . LEU A 0 58 . 19.350 1.145 -10.859 1.00 58.12 58 A 1 ATOM 455 C C . LEU A 0 58 . 19.479 0.517 -12.246 1.00 58.12 58 A 1 ATOM 456 C CB . LEU A 0 58 . 19.126 0.071 -9.777 1.00 58.12 58 A 1 ATOM 457 O O . LEU A 0 58 . 20.289 -0.384 -12.388 1.00 58.12 58 A 1 ATOM 458 C CG . LEU A 0 58 . 19.611 0.488 -8.383 1.00 58.12 58 A 1 ATOM 459 C CD1 . LEU A 0 58 . 19.012 -0.432 -7.323 1.00 58.12 58 A 1 ATOM 460 C CD2 . LEU A 0 58 . 21.129 0.377 -8.275 1.00 58.12 58 A 1 ATOM 461 N N . ASP A 0 59 . 18.774 0.988 -13.277 1.00 53.31 59 A 1 ATOM 462 C CA . ASP A 0 59 . 18.850 0.420 -14.633 1.00 53.31 59 A 1 ATOM 463 C C . ASP A 0 59 . 20.216 0.666 -15.319 1.00 53.31 59 A 1 ATOM 464 C CB . ASP A 0 59 . 17.647 0.919 -15.454 1.00 53.31 59 A 1 ATOM 465 O O . ASP A 0 59 . 20.490 0.182 -16.414 1.00 53.31 59 A 1 ATOM 466 C CG . ASP A 0 59 . 17.182 -0.045 -16.554 1.00 53.31 59 A 1 ATOM 467 O OD1 . ASP A 0 59 . 17.473 -1.260 -16.457 1.00 53.31 59 A 1 ATOM 468 O OD2 . ASP A 0 59 . 16.475 0.440 -17.466 1.00 53.31 59 A 1 ATOM 469 N N . ASN A 0 60 . 21.143 1.356 -14.639 1.00 57.07 60 A 1 ATOM 470 C CA . ASN A 0 60 . 22.567 1.345 -14.994 1.00 57.07 60 A 1 ATOM 471 C C . ASN A 0 60 . 23.377 0.230 -14.292 1.00 57.07 60 A 1 ATOM 472 C CB . ASN A 0 60 . 23.149 2.743 -14.747 1.00 57.07 60 A 1 ATOM 473 O O . ASN A 0 60 . 24.562 0.033 -14.555 1.00 57.07 60 A 1 ATOM 474 C CG . ASN A 0 60 . 24.376 3.000 -15.604 1.00 57.07 60 A 1 ATOM 475 N ND2 . ASN A 0 60 . 25.228 3.910 -15.193 1.00 57.07 60 A 1 ATOM 476 O OD1 . ASN A 0 60 . 24.579 2.444 -16.667 1.00 57.07 60 A 1 ATOM 477 N N . ILE A 0 61 . 22.759 -0.518 -13.383 1.00 52.86 61 A 1 ATOM 478 C CA . ILE A 0 61 . 23.343 -1.607 -12.603 1.00 52.86 61 A 1 ATOM 479 C C . ILE A 0 61 . 22.628 -2.908 -12.979 1.00 52.86 61 A 1 ATOM 480 C CB . ILE A 0 61 . 23.372 -1.313 -11.082 1.00 52.86 61 A 1 ATOM 481 O O . ILE A 0 61 . 21.847 -3.471 -12.225 1.00 52.86 61 A 1 ATOM 482 C CG1 . ILE A 0 61 . 23.862 0.131 -10.809 1.00 52.86 61 A 1 ATOM 483 C CG2 . ILE A 0 61 . 24.277 -2.360 -10.397 1.00 52.86 61 A 1 ATOM 484 C CD1 . ILE A 0 61 . 24.321 0.433 -9.375 1.00 52.86 61 A 1 ATOM 485 N N . ARG A 0 62 . 23.012 -3.411 -14.155 1.00 55.00 62 A 1 ATOM 486 C CA . ARG A 0 62 . 22.892 -4.809 -14.598 1.00 55.00 62 A 1 ATOM 487 C C . ARG A 0 62 . 21.463 -5.312 -14.862 1.00 55.00 62 A 1 ATOM 488 C CB . ARG A 0 62 . 23.648 -5.736 -13.625 1.00 55.00 62 A 1 ATOM 489 O O . ARG A 0 62 . 20.698 -5.607 -13.953 1.00 55.00 62 A 1 ATOM 490 C CG . ARG A 0 62 . 25.145 -5.407 -13.541 1.00 55.00 62 A 1 ATOM 491 C CD . ARG A 0 62 . 25.842 -6.390 -12.601 1.00 55.00 62 A 1 ATOM 492 N NE . ARG A 0 62 . 27.308 -6.222 -12.637 1.00 55.00 62 A 1 ATOM 493 N NH1 . ARG A 0 62 . 27.807 -8.033 -11.329 1.00 55.00 62 A 1 ATOM 494 N NH2 . ARG A 0 62 . 29.464 -6.822 -12.211 1.00 55.00 62 A 1 ATOM 495 C CZ . ARG A 0 62 . 28.183 -7.022 -12.060 1.00 55.00 62 A 1 ATOM 496 N N . ARG A 0 63 . 21.216 -5.568 -16.154 1.00 58.61 63 A 1 ATOM 497 C CA . ARG A 0 63 . 20.106 -6.307 -16.803 1.00 58.61 63 A 1 ATOM 498 C C . ARG A 0 63 . 19.570 -7.565 -16.095 1.00 58.61 63 A 1 ATOM 499 C CB . ARG A 0 63 . 20.608 -6.759 -18.193 1.00 58.61 63 A 1 ATOM 500 O O . ARG A 0 63 . 18.548 -8.090 -16.521 1.00 58.61 63 A 1 ATOM 501 C CG . ARG A 0 63 . 20.477 -5.685 -19.274 1.00 58.61 63 A 1 ATOM 502 C CD . ARG A 0 63 . 20.988 -6.237 -20.610 1.00 58.61 63 A 1 ATOM 503 N NE . ARG A 0 63 . 20.878 -5.227 -21.677 1.00 58.61 63 A 1 ATOM 504 N NH1 . ARG A 0 63 . 21.568 -6.549 -23.422 1.00 58.61 63 A 1 ATOM 505 N NH2 . ARG A 0 63 . 20.986 -4.425 -23.800 1.00 58.61 63 A 1 ATOM 506 C CZ . ARG A 0 63 . 21.145 -5.405 -22.957 1.00 58.61 63 A 1 ATOM 507 N N . ASP A 0 64 . 20.222 -8.063 -15.054 1.00 57.48 64 A 1 ATOM 508 C CA . ASP A 0 64 . 19.926 -9.364 -14.457 1.00 57.48 64 A 1 ATOM 509 C C . ASP A 0 64 . 18.672 -9.342 -13.565 1.00 57.48 64 A 1 ATOM 510 C CB . ASP A 0 64 . 21.170 -9.858 -13.699 1.00 57.48 64 A 1 ATOM 511 O O . ASP A 0 64 . 18.017 -10.370 -13.410 1.00 57.48 64 A 1 ATOM 512 C CG . ASP A 0 64 . 22.427 -9.944 -14.582 1.00 57.48 64 A 1 ATOM 513 O OD1 . ASP A 0 64 . 22.292 -10.208 -15.798 1.00 57.48 64 A 1 ATOM 514 O OD2 . ASP A 0 64 . 23.528 -9.681 -14.041 1.00 57.48 64 A 1 ATOM 515 N N . PHE A 0 65 . 18.277 -8.185 -13.015 1.00 51.43 65 A 1 ATOM 516 C CA . PHE A 0 65 . 17.095 -8.101 -12.141 1.00 51.43 65 A 1 ATOM 517 C C . PHE A 0 65 . 15.753 -8.173 -12.890 1.00 51.43 65 A 1 ATOM 518 C CB . PHE A 0 65 . 17.181 -6.849 -11.255 1.00 51.43 65 A 1 ATOM 519 O O . PHE A 0 65 . 14.768 -8.644 -12.320 1.00 51.43 65 A 1 ATOM 520 C CG . PHE A 0 65 . 17.956 -7.081 -9.972 1.00 51.43 65 A 1 ATOM 521 C CD1 . PHE A 0 65 . 17.314 -7.682 -8.872 1.00 51.43 65 A 1 ATOM 522 C CD2 . PHE A 0 65 . 19.313 -6.721 -9.877 1.00 51.43 65 A 1 ATOM 523 C CE1 . PHE A 0 65 . 18.022 -7.920 -7.681 1.00 51.43 65 A 1 ATOM 524 C CE2 . PHE A 0 65 . 20.022 -6.959 -8.685 1.00 51.43 65 A 1 ATOM 525 C CZ . PHE A 0 65 . 19.377 -7.558 -7.587 1.00 51.43 65 A 1 ATOM 526 N N . LEU A 0 66 . 15.704 -7.754 -14.160 1.00 50.92 66 A 1 ATOM 527 C CA . LEU A 0 66 . 14.478 -7.752 -14.973 1.00 50.92 66 A 1 ATOM 528 C C . LEU A 0 66 . 14.009 -9.169 -15.338 1.00 50.92 66 A 1 ATOM 529 C CB . LEU A 0 66 . 14.708 -6.878 -16.225 1.00 50.92 66 A 1 ATOM 530 O O . LEU A 0 66 . 12.809 -9.438 -15.352 1.00 50.92 66 A 1 ATOM 531 C CG . LEU A 0 66 . 14.115 -5.465 -16.066 1.00 50.92 66 A 1 ATOM 532 C CD1 . LEU A 0 66 . 14.781 -4.485 -17.029 1.00 50.92 66 A 1 ATOM 533 C CD2 . LEU A 0 66 . 12.610 -5.473 -16.348 1.00 50.92 66 A 1 ATOM 534 N N . LEU A 0 67 . 14.944 -10.104 -15.526 1.00 55.85 67 A 1 ATOM 535 C CA . LEU A 0 67 . 14.627 -11.491 -15.885 1.00 55.85 67 A 1 ATOM 536 C C . LEU A 0 67 . 13.879 -12.259 -14.785 1.00 55.85 67 A 1 ATOM 537 C CB . LEU A 0 67 . 15.929 -12.211 -16.282 1.00 55.85 67 A 1 ATOM 538 O O . LEU A 0 67 . 13.221 -13.254 -15.080 1.00 55.85 67 A 1 ATOM 539 C CG . LEU A 0 67 . 16.319 -11.952 -17.748 1.00 55.85 67 A 1 ATOM 540 C CD1 . LEU A 0 67 . 17.793 -12.296 -17.965 1.00 55.85 67 A 1 ATOM 541 C CD2 . LEU A 0 67 . 15.484 -12.808 -18.707 1.00 55.85 67 A 1 ATOM 542 N N . CYS A 0 68 . 13.919 -11.801 -13.532 1.00 54.04 68 A 1 ATOM 543 C CA . CYS A 0 68 . 13.165 -12.439 -12.451 1.00 54.04 68 A 1 ATOM 544 C C . CYS A 0 68 . 11.663 -12.111 -12.476 1.00 54.04 68 A 1 ATOM 545 C CB . CYS A 0 68 . 13.800 -12.069 -11.106 1.00 54.04 68 A 1 ATOM 546 O O . CYS A 0 68 . 10.887 -12.853 -11.875 1.00 54.04 68 A 1 ATOM 547 S SG . CYS A 0 68 . 15.333 -13.019 -10.886 1.00 54.04 68 A 1 ATOM 548 N N . PHE A 0 69 . 11.240 -11.037 -13.152 1.00 49.41 69 A 1 ATOM 549 C CA . PHE A 0 69 . 9.827 -10.636 -13.211 1.00 49.41 69 A 1 ATOM 550 C C . PHE A 0 69 . 9.119 -11.019 -14.512 1.00 49.41 69 A 1 ATOM 551 C CB . PHE A 0 69 . 9.692 -9.140 -12.901 1.00 49.41 69 A 1 ATOM 552 O O . PHE A 0 69 . 7.893 -10.992 -14.561 1.00 49.41 69 A 1 ATOM 553 C CG . PHE A 0 69 . 9.466 -8.879 -11.426 1.00 49.41 69 A 1 ATOM 554 C CD1 . PHE A 0 69 . 8.171 -9.010 -10.889 1.00 49.41 69 A 1 ATOM 555 C CD2 . PHE A 0 69 . 10.542 -8.542 -10.585 1.00 49.41 69 A 1 ATOM 556 C CE1 . PHE A 0 69 . 7.949 -8.794 -9.518 1.00 49.41 69 A 1 ATOM 557 C CE2 . PHE A 0 69 . 10.319 -8.325 -9.213 1.00 49.41 69 A 1 ATOM 558 C CZ . PHE A 0 69 . 9.024 -8.450 -8.680 1.00 49.41 69 A 1 ATOM 559 N N . GLU A 0 70 . 9.854 -11.433 -15.544 1.00 49.50 70 A 1 ATOM 560 C CA . GLU A 0 70 . 9.287 -11.748 -16.862 1.00 49.50 70 A 1 ATOM 561 C C . GLU A 0 70 . 8.578 -13.117 -16.937 1.00 49.50 70 A 1 ATOM 562 C CB . GLU A 0 70 . 10.373 -11.530 -17.926 1.00 49.50 70 A 1 ATOM 563 O O . GLU A 0 70 . 8.162 -13.569 -17.997 1.00 49.50 70 A 1 ATOM 564 C CG . GLU A 0 70 . 9.792 -11.467 -19.353 1.00 49.50 70 A 1 ATOM 565 C CD . GLU A 0 70 . 10.543 -10.530 -20.311 1.00 49.50 70 A 1 ATOM 566 O OE1 . GLU A 0 70 . 10.052 -10.375 -21.452 1.00 49.50 70 A 1 ATOM 567 O OE2 . GLU A 0 70 . 11.591 -9.964 -19.921 1.00 49.50 70 A 1 ATOM 568 N N . GLY A 0 71 . 8.371 -13.791 -15.806 1.00 44.74 71 A 1 ATOM 569 C CA . GLY A 0 71 . 7.613 -15.034 -15.759 1.00 44.74 71 A 1 ATOM 570 C C . GLY A 0 71 . 6.374 -14.922 -14.881 1.00 44.74 71 A 1 ATOM 571 O O . GLY A 0 71 . 6.513 -14.956 -13.662 1.00 44.74 71 A 1 ATOM 572 N N . ARG A 0 72 . 5.184 -14.991 -15.501 1.00 47.10 72 A 1 ATOM 573 C CA . ARG A 0 72 . 3.892 -15.448 -14.919 1.00 47.10 72 A 1 ATOM 574 C C . ARG A 0 72 . 2.845 -14.406 -14.487 1.00 47.10 72 A 1 ATOM 575 C CB . ARG A 0 72 . 4.064 -16.514 -13.814 1.00 47.10 72 A 1 ATOM 576 O O . ARG A 0 72 . 2.215 -14.588 -13.449 1.00 47.10 72 A 1 ATOM 577 C CG . ARG A 0 72 . 4.942 -17.718 -14.162 1.00 47.10 72 A 1 ATOM 578 C CD . ARG A 0 72 . 4.969 -18.618 -12.931 1.00 47.10 72 A 1 ATOM 579 N NE . ARG A 0 72 . 5.876 -19.757 -13.129 1.00 47.10 72 A 1 ATOM 580 N NH1 . ARG A 0 72 . 5.075 -21.040 -11.410 1.00 47.10 72 A 1 ATOM 581 N NH2 . ARG A 0 72 . 6.774 -21.788 -12.655 1.00 47.10 72 A 1 ATOM 582 C CZ . ARG A 0 72 . 5.904 -20.852 -12.400 1.00 47.10 72 A 1 ATOM 583 N N . PHE A 0 73 . 2.547 -13.407 -15.317 1.00 47.00 73 A 1 ATOM 584 C CA . PHE A 0 73 . 1.255 -12.693 -15.227 1.00 47.00 73 A 1 ATOM 585 C C . PHE A 0 73 . 0.356 -12.878 -16.459 1.00 47.00 73 A 1 ATOM 586 C CB . PHE A 0 73 . 1.445 -11.238 -14.778 1.00 47.00 73 A 1 ATOM 587 O O . PHE A 0 73 . -0.555 -12.092 -16.696 1.00 47.00 73 A 1 ATOM 588 C CG . PHE A 0 73 . 1.553 -11.102 -13.273 1.00 47.00 73 A 1 ATOM 589 C CD1 . PHE A 0 73 . 0.396 -11.190 -12.474 1.00 47.00 73 A 1 ATOM 590 C CD2 . PHE A 0 73 . 2.806 -10.898 -12.668 1.00 47.00 73 A 1 ATOM 591 C CE1 . PHE A 0 73 . 0.490 -11.062 -11.076 1.00 47.00 73 A 1 ATOM 592 C CE2 . PHE A 0 73 . 2.900 -10.768 -11.271 1.00 47.00 73 A 1 ATOM 593 C CZ . PHE A 0 73 . 1.743 -10.847 -10.476 1.00 47.00 73 A 1 ATOM 594 N N . ASP A 0 74 . 0.560 -13.962 -17.201 1.00 48.61 74 A 1 ATOM 595 C CA . ASP A 0 74 . -0.364 -14.403 -18.240 1.00 48.61 74 A 1 ATOM 596 C C . ASP A 0 74 . -1.405 -15.343 -17.627 1.00 48.61 74 A 1 ATOM 597 C CB . ASP A 0 74 . 0.410 -15.077 -19.383 1.00 48.61 74 A 1 ATOM 598 O O . ASP A 0 74 . -1.268 -16.555 -17.739 1.00 48.61 74 A 1 ATOM 599 C CG . ASP A 0 74 . 1.392 -14.128 -20.060 1.00 48.61 74 A 1 ATOM 600 O OD1 . ASP A 0 74 . 0.959 -13.020 -20.449 1.00 48.61 74 A 1 ATOM 601 O OD2 . ASP A 0 74 . 2.576 -14.521 -20.157 1.00 48.61 74 A 1 ATOM 602 N N . ASP A 0 75 . -2.396 -14.807 -16.906 1.00 46.24 75 A 1 ATOM 603 C CA . ASP A 0 75 . -3.772 -15.307 -17.045 1.00 46.24 75 A 1 ATOM 604 C C . ASP A 0 75 . -4.831 -14.537 -16.238 1.00 46.24 75 A 1 ATOM 605 C CB . ASP A 0 75 . -3.934 -16.829 -16.773 1.00 46.24 75 A 1 ATOM 606 O O . ASP A 0 75 . -4.651 -14.164 -15.080 1.00 46.24 75 A 1 ATOM 607 C CG . ASP A 0 75 . -4.101 -17.642 -18.072 1.00 46.24 75 A 1 ATOM 608 O OD1 . ASP A 0 75 . -4.704 -17.079 -19.020 1.00 46.24 75 A 1 ATOM 609 O OD2 . ASP A 0 75 . -3.776 -18.851 -18.063 1.00 46.24 75 A 1 ATOM 610 N N . SER A 0 76 . -6.000 -14.418 -16.880 1.00 50.75 76 A 1 ATOM 611 C CA . SER A 0 76 . -7.327 -14.135 -16.311 1.00 50.75 76 A 1 ATOM 612 C C . SER A 0 76 . -7.618 -12.713 -15.785 1.00 50.75 76 A 1 ATOM 613 C CB . SER A 0 76 . -7.706 -15.257 -15.343 1.00 50.75 76 A 1 ATOM 614 O O . SER A 0 76 . -7.853 -12.479 -14.600 1.00 50.75 76 A 1 ATOM 615 O OG . SER A 0 76 . -8.971 -15.000 -14.777 1.00 50.75 76 A 1 ATOM 616 N N . GLY A 0 77 . -7.726 -11.790 -16.745 1.00 53.96 77 A 1 ATOM 617 C CA . GLY A 0 77 . -8.636 -10.636 -16.805 1.00 53.96 77 A 1 ATOM 618 C C . GLY A 0 77 . -9.275 -10.100 -15.522 1.00 53.96 77 A 1 ATOM 619 O O . GLY A 0 77 . -10.303 -10.604 -15.095 1.00 53.96 77 A 1 ATOM 620 N N . PHE A 0 78 . -8.789 -8.957 -15.034 1.00 43.47 78 A 1 ATOM 621 C CA . PHE A 0 78 . -9.576 -8.046 -14.202 1.00 43.47 78 A 1 ATOM 622 C C . PHE A 0 78 . -9.138 -6.585 -14.396 1.00 43.47 78 A 1 ATOM 623 C CB . PHE A 0 78 . -9.547 -8.477 -12.719 1.00 43.47 78 A 1 ATOM 624 O O . PHE A 0 78 . -7.956 -6.281 -14.508 1.00 43.47 78 A 1 ATOM 625 C CG . PHE A 0 78 . -10.776 -9.270 -12.299 1.00 43.47 78 A 1 ATOM 626 C CD1 . PHE A 0 78 . -11.977 -8.604 -11.978 1.00 43.47 78 A 1 ATOM 627 C CD2 . PHE A 0 78 . -10.740 -10.677 -12.274 1.00 43.47 78 A 1 ATOM 628 C CE1 . PHE A 0 78 . -13.134 -9.341 -11.662 1.00 43.47 78 A 1 ATOM 629 C CE2 . PHE A 0 78 . -11.900 -11.414 -11.978 1.00 43.47 78 A 1 ATOM 630 C CZ . PHE A 0 78 . -13.098 -10.747 -11.672 1.00 43.47 78 A 1 ATOM 631 N N . MET A 0 79 . -10.142 -5.699 -14.370 1.00 40.78 79 A 1 ATOM 632 C CA . MET A 0 79 . -10.078 -4.236 -14.207 1.00 40.78 79 A 1 ATOM 633 C C . MET A 0 79 . -9.642 -3.413 -15.436 1.00 40.78 79 A 1 ATOM 634 C CB . MET A 0 79 . -9.323 -3.868 -12.921 1.00 40.78 79 A 1 ATOM 635 O O . MET A 0 79 . -8.497 -3.012 -15.621 1.00 40.78 79 A 1 ATOM 636 C CG . MET A 0 79 . -9.908 -4.516 -11.654 1.00 40.78 79 A 1 ATOM 637 S SD . MET A 0 79 . -11.351 -3.701 -10.933 1.00 40.78 79 A 1 ATOM 638 C CE . MET A 0 79 . -11.596 -4.784 -9.496 1.00 40.78 79 A 1 ATOM 639 N N . ARG A 0 80 . -10.644 -3.070 -16.252 1.00 53.80 80 A 1 ATOM 640 C CA . ARG A 0 80 . -10.587 -2.060 -17.316 1.00 53.80 80 A 1 ATOM 641 C C . ARG A 0 80 . -10.407 -0.668 -16.684 1.00 53.80 80 A 1 ATOM 642 C CB . ARG A 0 80 . -11.899 -2.207 -18.118 1.00 53.80 80 A 1 ATOM 643 O O . ARG A 0 80 . -11.363 -0.112 -16.150 1.00 53.80 80 A 1 ATOM 644 C CG . ARG A 0 80 . -11.913 -1.572 -19.516 1.00 53.80 80 A 1 ATOM 645 C CD . ARG A 0 80 . -13.283 -1.853 -20.159 1.00 53.80 80 A 1 ATOM 646 N NE . ARG A 0 80 . -13.310 -1.560 -21.606 1.00 53.80 80 A 1 ATOM 647 N NH1 . ARG A 0 80 . -15.451 -2.299 -22.010 1.00 53.80 80 A 1 ATOM 648 N NH2 . ARG A 0 80 . -14.201 -1.577 -23.706 1.00 53.80 80 A 1 ATOM 649 C CZ . ARG A 0 80 . -14.316 -1.810 -22.429 1.00 53.80 80 A 1 ATOM 650 N N . PHE A 0 81 . -9.195 -0.114 -16.717 1.00 49.87 81 A 1 ATOM 651 C CA . PHE A 0 81 . -8.924 1.241 -16.222 1.00 49.87 81 A 1 ATOM 652 C C . PHE A 0 81 . -9.613 2.315 -17.091 1.00 49.87 81 A 1 ATOM 653 C CB . PHE A 0 81 . -7.411 1.492 -16.119 1.00 49.87 81 A 1 ATOM 654 O O . PHE A 0 81 . -9.666 2.175 -18.317 1.00 49.87 81 A 1 ATOM 655 C CG . PHE A 0 81 . -6.814 1.059 -14.794 1.00 49.87 81 A 1 ATOM 656 C CD1 . PHE A 0 81 . -6.755 1.972 -13.721 1.00 49.87 81 A 1 ATOM 657 C CD2 . PHE A 0 81 . -6.327 -0.250 -14.620 1.00 49.87 81 A 1 ATOM 658 C CE1 . PHE A 0 81 . -6.212 1.579 -12.485 1.00 49.87 81 A 1 ATOM 659 C CE2 . PHE A 0 81 . -5.777 -0.639 -13.386 1.00 49.87 81 A 1 ATOM 660 C CZ . PHE A 0 81 . -5.719 0.274 -12.319 1.00 49.87 81 A 1 ATOM 661 N N . PRO A 0 82 . -10.143 3.397 -16.487 1.00 49.81 82 A 1 ATOM 662 C CA . PRO A 0 82 . -10.864 4.440 -17.209 1.00 49.81 82 A 1 ATOM 663 C C . PRO A 0 82 . -9.932 5.245 -18.123 1.00 49.81 82 A 1 ATOM 664 C CB . PRO A 0 82 . -11.544 5.299 -16.137 1.00 49.81 82 A 1 ATOM 665 O O . PRO A 0 82 . -8.968 5.876 -17.683 1.00 49.81 82 A 1 ATOM 666 C CG . PRO A 0 82 . -10.676 5.088 -14.898 1.00 49.81 82 A 1 ATOM 667 C CD . PRO A 0 82 . -10.170 3.658 -15.057 1.00 49.81 82 A 1 ATOM 668 N N . SER A 0 83 . -10.270 5.257 -19.414 1.00 54.97 83 A 1 ATOM 669 C CA . SER A 0 83 . -9.598 6.024 -20.460 1.00 54.97 83 A 1 ATOM 670 C C . SER A 0 83 . -9.828 7.525 -20.256 1.00 54.97 83 A 1 ATOM 671 C CB . SER A 0 83 . -10.128 5.573 -21.832 1.00 54.97 83 A 1 ATOM 672 O O . SER A 0 83 . -10.830 8.072 -20.722 1.00 54.97 83 A 1 ATOM 673 O OG . SER A 0 83 . -11.523 5.801 -21.932 1.00 54.97 83 A 1 ATOM 674 N N . HIS A 0 84 . -8.920 8.215 -19.572 1.00 48.46 84 A 1 ATOM 675 C CA . HIS A 0 84 . -8.940 9.673 -19.519 1.00 48.46 84 A 1 ATOM 676 C C . HIS A 0 84 . -7.723 10.237 -20.253 1.00 48.46 84 A 1 ATOM 677 C CB . HIS A 0 84 . -9.211 10.221 -18.117 1.00 48.46 84 A 1 ATOM 678 O O . HIS A 0 84 . -6.568 9.934 -19.979 1.00 48.46 84 A 1 ATOM 679 C CG . HIS A 0 84 . -8.254 9.776 -17.055 1.00 48.46 84 A 1 ATOM 680 C CD2 . HIS A 0 84 . -7.524 10.598 -16.240 1.00 48.46 84 A 1 ATOM 681 N ND1 . HIS A 0 84 . -8.004 8.478 -16.663 1.00 48.46 84 A 1 ATOM 682 C CE1 . HIS A 0 84 . -7.127 8.522 -15.651 1.00 48.46 84 A 1 ATOM 683 N NE2 . HIS A 0 84 . -6.815 9.791 -15.349 1.00 48.46 84 A 1 ATOM 684 N N . LYS A 0 85 . -8.095 10.980 -21.293 1.00 46.62 85 A 1 ATOM 685 C CA . LYS A 0 85 . -7.329 11.704 -22.299 1.00 46.62 85 A 1 ATOM 686 C C . LYS A 0 85 . -5.964 12.195 -21.804 1.00 46.62 85 A 1 ATOM 687 C CB . LYS A 0 85 . -8.211 12.898 -22.715 1.00 46.62 85 A 1 ATOM 688 O O . LYS A 0 85 . -5.887 12.945 -20.843 1.00 46.62 85 A 1 ATOM 689 C CG . LYS A 0 85 . -9.519 12.455 -23.405 1.00 46.62 85 A 1 ATOM 690 C CD . LYS A 0 85 . -10.516 13.613 -23.535 1.00 46.62 85 A 1 ATOM 691 C CE . LYS A 0 85 . -11.791 13.124 -24.238 1.00 46.62 85 A 1 ATOM 692 N NZ . LYS A 0 85 . -12.812 14.199 -24.336 1.00 46.62 85 A 1 ATOM 693 N N . GLN A 0 86 . -4.945 11.837 -22.586 1.00 56.35 86 A 1 ATOM 694 C CA . GLN A 0 86 . -3.632 12.481 -22.652 1.00 56.35 86 A 1 ATOM 695 C C . GLN A 0 86 . -2.886 12.515 -21.312 1.00 56.35 86 A 1 ATOM 696 C CB . GLN A 0 86 . -3.757 13.853 -23.341 1.00 56.35 86 A 1 ATOM 697 O O . GLN A 0 86 . -2.760 13.547 -20.662 1.00 56.35 86 A 1 ATOM 698 C CG . GLN A 0 86 . -4.339 13.734 -24.764 1.00 56.35 86 A 1 ATOM 699 C CD . GLN A 0 86 . -4.435 15.069 -25.494 1.00 56.35 86 A 1 ATOM 700 N NE2 . GLN A 0 86 . -5.005 15.094 -26.680 1.00 56.35 86 A 1 ATOM 701 O OE1 . GLN A 0 86 . -4.021 16.114 -25.035 1.00 56.35 86 A 1 ATOM 702 N N . LEU A 0 87 . -2.329 11.358 -20.941 1.00 51.65 87 A 1 ATOM 703 C CA . LEU A 0 87 . -1.194 11.304 -20.025 1.00 51.65 87 A 1 ATOM 704 C C . LEU A 0 87 . -0.084 12.211 -20.587 1.00 51.65 87 A 1 ATOM 705 C CB . LEU A 0 87 . -0.701 9.848 -19.911 1.00 51.65 87 A 1 ATOM 706 O O . LEU A 0 87 . 0.317 12.008 -21.738 1.00 51.65 87 A 1 ATOM 707 C CG . LEU A 0 87 . -1.474 9.038 -18.857 1.00 51.65 87 A 1 ATOM 708 C CD1 . LEU A 0 87 . -1.433 7.547 -19.187 1.00 51.65 87 A 1 ATOM 709 C CD2 . LEU A 0 87 . -0.865 9.242 -17.466 1.00 51.65 87 A 1 ATOM 710 N N . PRO A 0 88 . 0.403 13.211 -19.831 1.00 51.33 88 A 1 ATOM 711 C CA . PRO A 0 88 . 1.538 14.002 -20.264 1.00 51.33 88 A 1 ATOM 712 C C . PRO A 0 88 . 2.726 13.061 -20.458 1.00 51.33 88 A 1 ATOM 713 C CB . PRO A 0 88 . 1.758 15.067 -19.185 1.00 51.33 88 A 1 ATOM 714 O O . PRO A 0 88 . 3.136 12.351 -19.540 1.00 51.33 88 A 1 ATOM 715 C CG . PRO A 0 88 . 1.103 14.470 -17.940 1.00 51.33 88 A 1 ATOM 716 C CD . PRO A 0 88 . -0.021 13.601 -18.497 1.00 51.33 88 A 1 ATOM 717 N N . VAL A 0 89 . 3.235 13.027 -21.689 1.00 55.30 89 A 1 ATOM 718 C CA . VAL A 0 89 . 4.447 12.300 -22.054 1.00 55.30 89 A 1 ATOM 719 C C . VAL A 0 89 . 5.552 12.771 -21.115 1.00 55.30 89 A 1 ATOM 720 C CB . VAL A 0 89 . 4.800 12.561 -23.535 1.00 55.30 89 A 1 ATOM 721 O O . VAL A 0 89 . 5.896 13.952 -21.104 1.00 55.30 89 A 1 ATOM 722 C CG1 . VAL A 0 89 . 6.135 11.929 -23.947 1.00 55.30 89 A 1 ATOM 723 C CG2 . VAL A 0 89 . 3.709 11.995 -24.456 1.00 55.30 89 A 1 ATOM 724 N N . CYS A 0 90 . 6.088 11.851 -20.310 1.00 48.80 90 A 1 ATOM 725 C CA . CYS A 0 90 . 7.302 12.068 -19.536 1.00 48.80 90 A 1 ATOM 726 C C . CYS A 0 90 . 8.453 12.314 -20.518 1.00 48.80 90 A 1 ATOM 727 C CB . CYS A 0 90 . 7.583 10.843 -18.647 1.00 48.80 90 A 1 ATOM 728 O O . CYS A 0 90 . 9.155 11.384 -20.909 1.00 48.80 90 A 1 ATOM 729 S SG . CYS A 0 90 . 6.483 10.788 -17.205 1.00 48.80 90 A 1 ATOM 730 N N . GLY A 0 91 . 8.632 13.563 -20.946 1.00 47.35 91 A 1 ATOM 731 C CA . GLY A 0 91 . 9.864 13.993 -21.583 1.00 47.35 91 A 1 ATOM 732 C C . GLY A 0 91 . 10.984 13.756 -20.583 1.00 47.35 91 A 1 ATOM 733 O O . GLY A 0 91 . 10.999 14.369 -19.518 1.00 47.35 91 A 1 ATOM 734 N N . ALA A 0 92 . 11.873 12.815 -20.887 1.00 51.23 92 A 1 ATOM 735 C CA . ALA A 0 92 . 13.079 12.591 -20.115 1.00 51.23 92 A 1 ATOM 736 C C . ALA A 0 92 . 13.863 13.909 -20.083 1.00 51.23 92 A 1 ATOM 737 C CB . ALA A 0 92 . 13.864 11.443 -20.763 1.00 51.23 92 A 1 ATOM 738 O O . ALA A 0 92 . 14.476 14.303 -21.076 1.00 51.23 92 A 1 ATOM 739 N N . TYR A 0 93 . 13.798 14.623 -18.959 1.00 49.87 93 A 1 ATOM 740 C CA . TYR A 0 93 . 14.634 15.786 -18.708 1.00 49.87 93 A 1 ATOM 741 C C . TYR A 0 93 . 16.072 15.279 -18.636 1.00 49.87 93 A 1 ATOM 742 C CB . TYR A 0 93 . 14.201 16.514 -17.425 1.00 49.87 93 A 1 ATOM 743 O O . TYR A 0 93 . 16.553 14.848 -17.591 1.00 49.87 93 A 1 ATOM 744 C CG . TYR A 0 93 . 12.730 16.878 -17.382 1.00 49.87 93 A 1 ATOM 745 C CD1 . TYR A 0 93 . 12.265 18.067 -17.976 1.00 49.87 93 A 1 ATOM 746 C CD2 . TYR A 0 93 . 11.822 16.001 -16.756 1.00 49.87 93 A 1 ATOM 747 C CE1 . TYR A 0 93 . 10.890 18.376 -17.953 1.00 49.87 93 A 1 ATOM 748 C CE2 . TYR A 0 93 . 10.449 16.303 -16.736 1.00 49.87 93 A 1 ATOM 749 O OH . TYR A 0 93 . 8.651 17.767 -17.313 1.00 49.87 93 A 1 ATOM 750 C CZ . TYR A 0 93 . 9.980 17.487 -17.337 1.00 49.87 93 A 1 ATOM 751 N N . SER A 0 94 . 16.744 15.274 -19.783 1.00 50.38 94 A 1 ATOM 752 C CA . SER A 0 94 . 18.186 15.124 -19.844 1.00 50.38 94 A 1 ATOM 753 C C . SER A 0 94 . 18.746 16.382 -19.200 1.00 50.38 94 A 1 ATOM 754 C CB . SER A 0 94 . 18.653 14.959 -21.292 1.00 50.38 94 A 1 ATOM 755 O O . SER A 0 94 . 18.827 17.430 -19.836 1.00 50.38 94 A 1 ATOM 756 O OG . SER A 0 94 . 18.085 13.784 -21.838 1.00 50.38 94 A 1 ATOM 757 N N . LEU A 0 95 . 19.042 16.308 -17.902 1.00 52.74 95 A 1 ATOM 758 C CA . LEU A 0 95 . 19.873 17.294 -17.231 1.00 52.74 95 A 1 ATOM 759 C C . LEU A 0 95 . 21.233 17.220 -17.919 1.00 52.74 95 A 1 ATOM 760 C CB . LEU A 0 95 . 19.931 17.000 -15.713 1.00 52.74 95 A 1 ATOM 761 O O . LEU A 0 95 . 22.079 16.399 -17.570 1.00 52.74 95 A 1 ATOM 762 C CG . LEU A 0 95 . 19.041 17.941 -14.872 1.00 52.74 95 A 1 ATOM 763 C CD1 . LEU A 0 95 . 18.133 17.155 -13.926 1.00 52.74 95 A 1 ATOM 764 C CD2 . LEU A 0 95 . 19.899 18.888 -14.028 1.00 52.74 95 A 1 ATOM 765 N N . SER A 0 96 . 21.409 18.041 -18.955 1.00 52.82 96 A 1 ATOM 766 C CA . SER A 0 96 . 22.718 18.359 -19.493 1.00 52.82 96 A 1 ATOM 767 C C . SER A 0 96 . 23.532 18.869 -18.313 1.00 52.82 96 A 1 ATOM 768 C CB . SER A 0 96 . 22.619 19.399 -20.614 1.00 52.82 96 A 1 ATOM 769 O O . SER A 0 96 . 23.264 19.941 -17.770 1.00 52.82 96 A 1 ATOM 770 O OG . SER A 0 96 . 21.950 20.560 -20.164 1.00 52.82 96 A 1 ATOM 771 N N . SER A 0 97 . 24.438 18.015 -17.855 1.00 52.35 97 A 1 ATOM 772 C CA . SER A 0 97 . 25.403 18.282 -16.809 1.00 52.35 97 A 1 ATOM 773 C C . SER A 0 97 . 26.254 19.466 -17.256 1.00 52.35 97 A 1 ATOM 774 C CB . SER A 0 97 . 26.227 17.002 -16.613 1.00 52.35 97 A 1 ATOM 775 O O . SER A 0 97 . 27.224 19.313 -17.991 1.00 52.35 97 A 1 ATOM 776 O OG . SER A 0 97 . 27.340 17.202 -15.773 1.00 52.35 97 A 1 ATOM 777 N N . THR A 0 98 . 25.850 20.674 -16.869 1.00 59.03 98 A 1 ATOM 778 C CA . THR A 0 98 . 26.735 21.829 -16.930 1.00 59.03 98 A 1 ATOM 779 C C . THR A 0 98 . 27.670 21.711 -15.740 1.00 59.03 98 A 1 ATOM 780 C CB . THR A 0 98 . 26.004 23.174 -16.974 1.00 59.03 98 A 1 ATOM 781 O O . THR A 0 98 . 27.316 22.000 -14.596 1.00 59.03 98 A 1 ATOM 782 C CG2 . THR A 0 98 . 26.906 24.249 -17.583 1.00 59.03 98 A 1 ATOM 783 O OG1 . THR A 0 98 . 24.863 23.093 -17.797 1.00 59.03 98 A 1 ATOM 784 N N . GLU A 0 99 . 28.840 21.176 -16.056 1.00 53.22 99 A 1 ATOM 785 C CA . GLU A 0 99 . 30.070 21.122 -15.284 1.00 53.22 99 A 1 ATOM 786 C C . GLU A 0 99 . 30.187 22.299 -14.297 1.00 53.22 99 A 1 ATOM 787 C CB . GLU A 0 99 . 31.188 21.112 -16.342 1.00 53.22 99 A 1 ATOM 788 O O . GLU A 0 99 . 30.551 23.419 -14.639 1.00 53.22 99 A 1 ATOM 789 C CG . GLU A 0 99 . 32.469 20.429 -15.872 1.00 53.22 99 A 1 ATOM 790 C CD . GLU A 0 99 . 33.568 20.539 -16.941 1.00 53.22 99 A 1 ATOM 791 O OE1 . GLU A 0 99 . 34.727 20.769 -16.529 1.00 53.22 99 A 1 ATOM 792 O OE2 . GLU A 0 99 . 33.249 20.392 -18.143 1.00 53.22 99 A 1 ATOM 793 N N . SER A 0 100 . 29.801 22.066 -13.046 1.00 62.85 100 A 1 ATOM 794 C CA . SER A 0 100 . 30.045 22.982 -11.935 1.00 62.85 100 A 1 ATOM 795 C C . SER A 0 100 . 30.243 22.131 -10.691 1.00 62.85 100 A 1 ATOM 796 C CB . SER A 0 100 . 28.970 24.069 -11.798 1.00 62.85 100 A 1 ATOM 797 O O . SER A 0 100 . 29.322 21.717 -9.992 1.00 62.85 100 A 1 ATOM 798 O OG . SER A 0 100 . 27.665 23.582 -12.024 1.00 62.85 100 A 1 ATOM 799 N N . ASN A 0 101 . 31.511 21.791 -10.492 1.00 63.90 101 A 1 ATOM 800 C CA . ASN A 0 101 . 32.026 21.079 -9.341 1.00 63.90 101 A 1 ATOM 801 C C . ASN A 0 101 . 31.720 21.879 -8.070 1.00 63.90 101 A 1 ATOM 802 C CB . ASN A 0 101 . 33.550 20.933 -9.546 1.00 63.90 101 A 1 ATOM 803 O O . ASN A 0 101 . 32.392 22.870 -7.804 1.00 63.90 101 A 1 ATOM 804 C CG . ASN A 0 101 . 33.899 20.093 -10.758 1.00 63.90 101 A 1 ATOM 805 N ND2 . ASN A 0 101 . 34.769 20.563 -11.623 1.00 63.90 101 A 1 ATOM 806 O OD1 . ASN A 0 101 . 33.371 19.015 -10.945 1.00 63.90 101 A 1 ATOM 807 N N . SER A 0 102 . 30.710 21.491 -7.294 1.00 64.93 102 A 1 ATOM 808 C CA . SER A 0 102 . 30.718 21.582 -5.824 1.00 64.93 102 A 1 ATOM 809 C C . SER A 0 102 . 29.355 21.193 -5.242 1.00 64.93 102 A 1 ATOM 810 C CB . SER A 0 102 . 31.128 22.967 -5.270 1.00 64.93 102 A 1 ATOM 811 O O . SER A 0 102 . 28.353 21.817 -5.558 1.00 64.93 102 A 1 ATOM 812 O OG . SER A 0 102 . 30.463 24.048 -5.878 1.00 64.93 102 A 1 ATOM 813 N N . ILE A 0 103 . 29.373 20.208 -4.325 1.00 53.06 103 A 1 ATOM 814 C CA . ILE A 0 103 . 28.392 19.992 -3.235 1.00 53.06 103 A 1 ATOM 815 C C . ILE A 0 103 . 26.986 19.563 -3.725 1.00 53.06 103 A 1 ATOM 816 C CB . ILE A 0 103 . 28.355 21.286 -2.370 1.00 53.06 103 A 1 ATOM 817 O O . ILE A 0 103 . 26.290 20.313 -4.386 1.00 53.06 103 A 1 ATOM 818 C CG1 . ILE A 0 103 . 29.753 21.720 -1.846 1.00 53.06 103 A 1 ATOM 819 C CG2 . ILE A 0 103 . 27.407 21.139 -1.170 1.00 53.06 103 A 1 ATOM 820 C CD1 . ILE A 0 103 . 29.821 23.210 -1.483 1.00 53.06 103 A 1 ATOM 821 N N . SER A 0 104 . 26.386 18.413 -3.423 1.00 56.60 104 A 1 ATOM 822 C CA . SER A 0 104 . 26.585 17.287 -2.506 1.00 56.60 104 A 1 ATOM 823 C C . SER A 0 104 . 25.716 16.134 -3.075 1.00 56.60 104 A 1 ATOM 824 C CB . SER A 0 104 . 26.032 17.683 -1.130 1.00 56.60 104 A 1 ATOM 825 O O . SER A 0 104 . 24.620 16.419 -3.568 1.00 56.60 104 A 1 ATOM 826 O OG . SER A 0 104 . 25.972 16.567 -0.272 1.00 56.60 104 A 1 ATOM 827 N N . PRO A 0 105 . 26.155 14.862 -3.071 1.00 57.02 105 A 1 ATOM 828 C CA . PRO A 0 105 . 25.564 13.796 -3.897 1.00 57.02 105 A 1 ATOM 829 C C . PRO A 0 105 . 24.199 13.210 -3.468 1.00 57.02 105 A 1 ATOM 830 C CB . PRO A 0 105 . 26.661 12.724 -4.010 1.00 57.02 105 A 1 ATOM 831 O O . PRO A 0 105 . 23.785 12.216 -4.054 1.00 57.02 105 A 1 ATOM 832 C CG . PRO A 0 105 . 27.489 12.917 -2.743 1.00 57.02 105 A 1 ATOM 833 C CD . PRO A 0 105 . 27.427 14.424 -2.517 1.00 57.02 105 A 1 ATOM 834 N N . GLU A 0 106 . 23.455 13.778 -2.514 1.00 58.65 106 A 1 ATOM 835 C CA . GLU A 0 106 . 22.361 13.017 -1.868 1.00 58.65 106 A 1 ATOM 836 C C . GLU A 0 106 . 20.904 13.456 -2.107 1.00 58.65 106 A 1 ATOM 837 C CB . GLU A 0 106 . 22.674 12.821 -0.377 1.00 58.65 106 A 1 ATOM 838 O O . GLU A 0 106 . 20.018 12.937 -1.436 1.00 58.65 106 A 1 ATOM 839 C CG . GLU A 0 106 . 23.829 11.831 -0.171 1.00 58.65 106 A 1 ATOM 840 C CD . GLU A 0 106 . 23.650 11.069 1.147 1.00 58.65 106 A 1 ATOM 841 O OE1 . GLU A 0 106 . 23.672 9.819 1.099 1.00 58.65 106 A 1 ATOM 842 O OE2 . GLU A 0 106 . 23.484 11.750 2.184 1.00 58.65 106 A 1 ATOM 843 N N . SER A 0 107 . 20.564 14.362 -3.032 1.00 50.99 107 A 1 ATOM 844 C CA . SER A 0 107 . 19.201 14.939 -2.962 1.00 50.99 107 A 1 ATOM 845 C C . SER A 0 107 . 18.452 15.240 -4.258 1.00 50.99 107 A 1 ATOM 846 C CB . SER A 0 107 . 19.217 16.132 -1.999 1.00 50.99 107 A 1 ATOM 847 O O . SER A 0 107 . 17.791 16.269 -4.322 1.00 50.99 107 A 1 ATOM 848 O OG . SER A 0 107 . 20.044 17.167 -2.494 1.00 50.99 107 A 1 ATOM 849 N N . LYS A 0 108 . 18.449 14.372 -5.286 1.00 55.85 108 A 1 ATOM 850 C CA . LYS A 0 108 . 17.543 14.576 -6.454 1.00 55.85 108 A 1 ATOM 851 C C . LYS A 0 108 . 16.938 13.309 -7.086 1.00 55.85 108 A 1 ATOM 852 C CB . LYS A 0 108 . 18.190 15.509 -7.511 1.00 55.85 108 A 1 ATOM 853 O O . LYS A 0 108 . 16.647 13.304 -8.275 1.00 55.85 108 A 1 ATOM 854 C CG . LYS A 0 108 . 18.427 16.935 -6.990 1.00 55.85 108 A 1 ATOM 855 C CD . LYS A 0 108 . 18.877 17.936 -8.047 1.00 55.85 108 A 1 ATOM 856 C CE . LYS A 0 108 . 19.106 19.272 -7.326 1.00 55.85 108 A 1 ATOM 857 N NZ . LYS A 0 108 . 19.706 20.285 -8.226 1.00 55.85 108 A 1 ATOM 858 N N . LEU A 0 109 . 16.707 12.240 -6.320 1.00 56.10 109 A 1 ATOM 859 C CA . LEU A 0 109 . 16.239 10.951 -6.871 1.00 56.10 109 A 1 ATOM 860 C C . LEU A 0 109 . 14.720 10.797 -7.064 1.00 56.10 109 A 1 ATOM 861 C CB . LEU A 0 109 . 16.863 9.793 -6.069 1.00 56.10 109 A 1 ATOM 862 O O . LEU A 0 109 . 14.262 9.708 -7.393 1.00 56.10 109 A 1 ATOM 863 C CG . LEU A 0 109 . 18.227 9.377 -6.647 1.00 56.10 109 A 1 ATOM 864 C CD1 . LEU A 0 109 . 19.024 8.621 -5.591 1.00 56.10 109 A 1 ATOM 865 C CD2 . LEU A 0 109 . 18.074 8.471 -7.871 1.00 56.10 109 A 1 ATOM 866 N N . PHE A 0 110 . 13.922 11.856 -6.922 1.00 60.89 110 A 1 ATOM 867 C CA . PHE A 0 110 . 12.489 11.761 -7.201 1.00 60.89 110 A 1 ATOM 868 C C . PHE A 0 110 . 12.109 12.571 -8.433 1.00 60.89 110 A 1 ATOM 869 C CB . PHE A 0 110 . 11.670 12.073 -5.947 1.00 60.89 110 A 1 ATOM 870 O O . PHE A 0 110 . 12.059 13.799 -8.406 1.00 60.89 110 A 1 ATOM 871 C CG . PHE A 0 110 . 11.522 10.848 -5.062 1.00 60.89 110 A 1 ATOM 872 C CD1 . PHE A 0 110 . 10.503 9.911 -5.325 1.00 60.89 110 A 1 ATOM 873 C CD2 . PHE A 0 110 . 12.441 10.601 -4.024 1.00 60.89 110 A 1 ATOM 874 C CE1 . PHE A 0 110 . 10.397 8.741 -4.551 1.00 60.89 110 A 1 ATOM 875 C CE2 . PHE A 0 110 . 12.335 9.432 -3.250 1.00 60.89 110 A 1 ATOM 876 C CZ . PHE A 0 110 . 11.314 8.502 -3.513 1.00 60.89 110 A 1 ATOM 877 N N . CYS A 0 111 . 11.790 11.858 -9.516 1.00 71.02 111 A 1 ATOM 878 C CA . CYS A 0 111 . 11.040 12.435 -10.621 1.00 71.02 111 A 1 ATOM 879 C C . CYS A 0 111 . 9.708 12.969 -10.055 1.00 71.02 111 A 1 ATOM 880 C CB . CYS A 0 111 . 10.829 11.364 -11.701 1.00 71.02 111 A 1 ATOM 881 O O . CYS A 0 111 . 8.980 12.195 -9.421 1.00 71.02 111 A 1 ATOM 882 S SG . CYS A 0 111 . 9.880 12.046 -13.091 1.00 71.02 111 A 1 ATOM 883 N N . PRO A 0 112 . 9.362 14.254 -10.254 1.00 71.88 112 A 1 ATOM 884 C CA . PRO A 0 112 . 8.138 14.842 -9.700 1.00 71.88 112 A 1 ATOM 885 C C . PRO A 0 112 . 6.878 14.064 -10.109 1.00 71.88 112 A 1 ATOM 886 C CB . PRO A 0 112 . 8.127 16.298 -10.187 1.00 71.88 112 A 1 ATOM 887 O O . PRO A 0 112 . 5.942 13.942 -9.320 1.00 71.88 112 A 1 ATOM 888 C CG . PRO A 0 112 . 9.116 16.334 -11.353 1.00 71.88 112 A 1 ATOM 889 C CD . PRO A 0 112 . 10.117 15.240 -11.006 1.00 71.88 112 A 1 ATOM 890 N N . ASN A 0 113 . 6.899 13.425 -11.283 1.00 72.09 113 A 1 ATOM 891 C CA . ASN A 0 113 . 5.801 12.585 -11.755 1.00 72.09 113 A 1 ATOM 892 C C . ASN A 0 113 . 5.603 11.326 -10.893 1.00 72.09 113 A 1 ATOM 893 C CB . ASN A 0 113 . 6.036 12.235 -13.236 1.00 72.09 113 A 1 ATOM 894 O O . ASN A 0 113 . 4.464 10.920 -10.679 1.00 72.09 113 A 1 ATOM 895 C CG . ASN A 0 113 . 6.003 13.458 -14.138 1.00 72.09 113 A 1 ATOM 896 N ND2 . ASN A 0 113 . 6.516 13.367 -15.338 1.00 72.09 113 A 1 ATOM 897 O OD1 . ASN A 0 113 . 5.530 14.519 -13.783 1.00 72.09 113 A 1 ATOM 898 N N . CYS A 0 114 . 6.673 10.736 -10.343 1.00 68.62 114 A 1 ATOM 899 C CA . CYS A 0 114 . 6.565 9.581 -9.446 1.00 68.62 114 A 1 ATOM 900 C C . CYS A 0 114 . 5.909 9.969 -8.116 1.00 68.62 114 A 1 ATOM 901 C CB . CYS A 0 114 . 7.950 8.963 -9.200 1.00 68.62 114 A 1 ATOM 902 O O . CYS A 0 114 . 5.036 9.256 -7.624 1.00 68.62 114 A 1 ATOM 903 S SG . CYS A 0 114 . 8.627 8.302 -10.748 1.00 68.62 114 A 1 ATOM 904 N N . VAL A 0 115 . 6.280 11.127 -7.558 1.00 71.61 115 A 1 ATOM 905 C CA . VAL A 0 115 . 5.679 11.648 -6.316 1.00 71.61 115 A 1 ATOM 906 C C . VAL A 0 115 . 4.190 11.930 -6.518 1.00 71.61 115 A 1 ATOM 907 C CB . VAL A 0 115 . 6.404 12.922 -5.840 1.00 71.61 115 A 1 ATOM 908 O O . VAL A 0 115 . 3.364 11.585 -5.668 1.00 71.61 115 A 1 ATOM 909 C CG1 . VAL A 0 115 . 5.811 13.456 -4.531 1.00 71.61 115 A 1 ATOM 910 C CG2 . VAL A 0 115 . 7.895 12.646 -5.610 1.00 71.61 115 A 1 ATOM 911 N N . GLN A 0 116 . 3.837 12.501 -7.672 1.00 79.82 116 A 1 ATOM 912 C CA . GLN A 0 116 . 2.449 12.766 -8.028 1.00 79.82 116 A 1 ATOM 913 C C . GLN A 0 116 . 1.647 11.468 -8.198 1.00 79.82 116 A 1 ATOM 914 C CB . GLN A 0 116 . 2.427 13.639 -9.287 1.00 79.82 116 A 1 ATOM 915 O O . GLN A 0 116 . 0.517 11.388 -7.720 1.00 79.82 116 A 1 ATOM 916 C CG . GLN A 0 116 . 1.033 14.230 -9.537 1.00 79.82 116 A 1 ATOM 917 C CD . GLN A 0 116 . 1.001 15.181 -10.727 1.00 79.82 116 A 1 ATOM 918 N NE2 . GLN A 0 116 . -0.160 15.673 -11.100 1.00 79.82 116 A 1 ATOM 919 O OE1 . GLN A 0 116 . 1.994 15.509 -11.346 1.00 79.82 116 A 1 ATOM 920 N N . TRP A 0 117 . 2.239 10.433 -8.800 1.00 77.03 117 A 1 ATOM 921 C CA . TRP A 0 117 . 1.605 9.120 -8.948 1.00 77.03 117 A 1 ATOM 922 C C . TRP A 0 117 . 1.341 8.443 -7.602 1.00 77.03 117 A 1 ATOM 923 C CB . TRP A 0 117 . 2.452 8.222 -9.860 1.00 77.03 117 A 1 ATOM 924 O O . TRP A 0 117 . 0.229 7.977 -7.356 1.00 77.03 117 A 1 ATOM 925 C CG . TRP A 0 117 . 1.761 7.856 -11.130 1.00 77.03 117 A 1 ATOM 926 C CD1 . TRP A 0 117 . 1.630 8.649 -12.217 1.00 77.03 117 A 1 ATOM 927 C CD2 . TRP A 0 117 . 1.066 6.615 -11.449 1.00 77.03 117 A 1 ATOM 928 C CE2 . TRP A 0 117 . 0.518 6.729 -12.760 1.00 77.03 117 A 1 ATOM 929 C CE3 . TRP A 0 117 . 0.855 5.403 -10.763 1.00 77.03 117 A 1 ATOM 930 N NE1 . TRP A 0 117 . 0.898 7.986 -13.184 1.00 77.03 117 A 1 ATOM 931 C CH2 . TRP A 0 117 . -0.416 4.499 -12.642 1.00 77.03 117 A 1 ATOM 932 C CZ2 . TRP A 0 117 . -0.216 5.693 -13.357 1.00 77.03 117 A 1 ATOM 933 C CZ3 . TRP A 0 117 . 0.121 4.355 -11.351 1.00 77.03 117 A 1 ATOM 934 N N . VAL A 0 118 . 2.327 8.443 -6.699 1.00 74.13 118 A 1 ATOM 935 C CA . VAL A 0 118 . 2.164 7.889 -5.345 1.00 74.13 118 A 1 ATOM 936 C C . VAL A 0 118 . 1.082 8.644 -4.575 1.00 74.13 118 A 1 ATOM 937 C CB . VAL A 0 118 . 3.499 7.898 -4.577 1.00 74.13 118 A 1 ATOM 938 O O . VAL A 0 118 . 0.218 8.011 -3.969 1.00 74.13 118 A 1 ATOM 939 C CG1 . VAL A 0 118 . 3.335 7.466 -3.113 1.00 74.13 118 A 1 ATOM 940 C CG2 . VAL A 0 118 . 4.478 6.911 -5.212 1.00 74.13 118 A 1 ATOM 941 N N . SER A 0 119 . 1.069 9.980 -4.647 1.00 79.42 119 A 1 ATOM 942 C CA . SER A 0 119 . -0.001 10.786 -4.040 1.00 79.42 119 A 1 ATOM 943 C C . SER A 0 119 . -1.373 10.447 -4.613 1.00 79.42 119 A 1 ATOM 944 C CB . SER A 0 119 . 0.237 12.282 -4.248 1.00 79.42 119 A 1 ATOM 945 O O . SER A 0 119 . -2.334 10.315 -3.861 1.00 79.42 119 A 1 ATOM 946 O OG . SER A 0 119 . 1.185 12.753 -3.322 1.00 79.42 119 A 1 ATOM 947 N N . LEU A 0 120 . -1.481 10.273 -5.931 1.00 80.80 120 A 1 ATOM 948 C CA . LEU A 0 120 . -2.749 9.957 -6.582 1.00 80.80 120 A 1 ATOM 949 C C . LEU A 0 120 . -3.267 8.571 -6.174 1.00 80.80 120 A 1 ATOM 950 C CB . LEU A 0 120 . -2.568 10.128 -8.098 1.00 80.80 120 A 1 ATOM 951 O O . LEU A 0 120 . -4.457 8.428 -5.892 1.00 80.80 120 A 1 ATOM 952 C CG . LEU A 0 120 . -3.904 10.147 -8.867 1.00 80.80 120 A 1 ATOM 953 C CD1 . LEU A 0 120 . -3.895 11.266 -9.909 1.00 80.80 120 A 1 ATOM 954 C CD2 . LEU A 0 120 . -4.158 8.821 -9.586 1.00 80.80 120 A 1 ATOM 955 N N . ILE A 0 121 . -2.383 7.575 -6.059 1.00 77.80 121 A 1 ATOM 956 C CA . ILE A 0 121 . -2.753 6.250 -5.545 1.00 77.80 121 A 1 ATOM 957 C C . ILE A 0 121 . -3.205 6.341 -4.084 1.00 77.80 121 A 1 ATOM 958 C CB . ILE A 0 121 . -1.607 5.227 -5.715 1.00 77.80 121 A 1 ATOM 959 O O . ILE A 0 121 . -4.245 5.784 -3.737 1.00 77.80 121 A 1 ATOM 960 C CG1 . ILE A 0 121 . -1.329 4.948 -7.209 1.00 77.80 121 A 1 ATOM 961 C CG2 . ILE A 0 121 . -2.006 3.912 -5.011 1.00 77.80 121 A 1 ATOM 962 C CD1 . ILE A 0 121 . -0.032 4.163 -7.451 1.00 77.80 121 A 1 ATOM 963 N N . LEU A 0 122 . -2.464 7.055 -3.231 1.00 76.35 122 A 1 ATOM 964 C CA . LEU A 0 122 . -2.815 7.205 -1.816 1.00 76.35 122 A 1 ATOM 965 C C . LEU A 0 122 . -4.161 7.920 -1.631 1.00 76.35 122 A 1 ATOM 966 C CB . LEU A 0 122 . -1.683 7.942 -1.079 1.00 76.35 122 A 1 ATOM 967 O O . LEU A 0 122 . -4.981 7.462 -0.836 1.00 76.35 122 A 1 ATOM 968 C CG . LEU A 0 122 . -0.433 7.077 -0.825 1.00 76.35 122 A 1 ATOM 969 C CD1 . LEU A 0 122 . 0.708 7.964 -0.327 1.00 76.35 122 A 1 ATOM 970 C CD2 . LEU A 0 122 . -0.687 5.997 0.234 1.00 76.35 122 A 1 ATOM 971 N N . ASN A 0 123 . -4.419 8.974 -2.406 1.00 80.52 123 A 1 ATOM 972 C CA . ASN A 0 123 . -5.677 9.722 -2.360 1.00 80.52 123 A 1 ATOM 973 C C . ASN A 0 123 . -6.869 8.887 -2.853 1.00 80.52 123 A 1 ATOM 974 C CB . ASN A 0 123 . -5.514 11.006 -3.191 1.00 80.52 123 A 1 ATOM 975 O O . ASN A 0 123 . -7.952 8.937 -2.266 1.00 80.52 123 A 1 ATOM 976 C CG . ASN A 0 123 . -4.623 12.038 -2.521 1.00 80.52 123 A 1 ATOM 977 N ND2 . ASN A 0 123 . -4.062 12.951 -3.280 1.00 80.52 123 A 1 ATOM 978 O OD1 . ASN A 0 123 . -4.443 12.076 -1.319 1.00 80.52 123 A 1 ATOM 979 N N . ASN A 0 124 . -6.675 8.067 -3.888 1.00 76.59 124 A 1 ATOM 980 C CA . ASN A 0 124 . -7.716 7.146 -4.350 1.00 76.59 124 A 1 ATOM 981 C C . ASN A 0 124 . -7.938 5.984 -3.375 1.00 76.59 124 A 1 ATOM 982 C CB . ASN A 0 124 . -7.360 6.643 -5.755 1.00 76.59 124 A 1 ATOM 983 O O . ASN A 0 124 . -9.060 5.517 -3.216 1.00 76.59 124 A 1 ATOM 984 C CG . ASN A 0 124 . -7.649 7.664 -6.839 1.00 76.59 124 A 1 ATOM 985 N ND2 . ASN A 0 124 . -7.078 7.489 -8.007 1.00 76.59 124 A 1 ATOM 986 O OD1 . ASN A 0 124 . -8.413 8.601 -6.686 1.00 76.59 124 A 1 ATOM 987 N N . ALA A 0 125 . -6.902 5.525 -2.672 1.00 70.00 125 A 1 ATOM 988 C CA . ALA A 0 125 . -7.060 4.485 -1.659 1.00 70.00 125 A 1 ATOM 989 C C . ALA A 0 125 . -7.885 4.969 -0.453 1.00 70.00 125 A 1 ATOM 990 C CB . ALA A 0 125 . -5.673 3.990 -1.240 1.00 70.00 125 A 1 ATOM 991 O O . ALA A 0 125 . -8.552 4.166 0.195 1.00 70.00 125 A 1 ATOM 992 N N . THR A 0 126 . -7.863 6.271 -0.151 1.00 72.94 126 A 1 ATOM 993 C CA . THR A 0 126 . -8.698 6.863 0.905 1.00 72.94 126 A 1 ATOM 994 C C . THR A 0 126 . -10.138 7.134 0.483 1.00 72.94 126 A 1 ATOM 995 C CB . THR A 0 126 . -8.083 8.160 1.452 1.00 72.94 126 A 1 ATOM 996 O O . THR A 0 126 . -10.979 7.335 1.353 1.00 72.94 126 A 1 ATOM 997 C CG2 . THR A 0 126 . -6.836 7.859 2.283 1.00 72.94 126 A 1 ATOM 998 O OG1 . THR A 0 126 . -7.660 9.047 0.444 1.00 72.94 126 A 1 ATOM 999 N N . SER A 0 127 . -10.438 7.150 -0.819 1.00 73.97 127 A 1 ATOM 1000 C CA . SER A 0 127 . -11.759 7.540 -1.317 1.00 73.97 127 A 1 ATOM 1001 C C . SER A 0 127 . -12.741 6.389 -1.460 1.00 73.97 127 A 1 ATOM 1002 C CB . SER A 0 127 . -11.651 8.304 -2.637 1.00 73.97 127 A 1 ATOM 1003 O O . SER A 0 127 . -13.896 6.665 -1.756 1.00 73.97 127 A 1 ATOM 1004 O OG . SER A 0 127 . -11.244 7.446 -3.681 1.00 73.97 127 A 1 ATOM 1005 N N . TYR A 0 128 . -12.342 5.132 -1.236 1.00 66.85 128 A 1 ATOM 1006 C CA . TYR A 0 128 . -13.314 4.048 -1.132 1.00 66.85 128 A 1 ATOM 1007 C C . TYR A 0 128 . -14.140 4.283 0.133 1.00 66.85 128 A 1 ATOM 1008 C CB . TYR A 0 128 . -12.629 2.676 -1.124 1.00 66.85 128 A 1 ATOM 1009 O O . TYR A 0 128 . -13.611 4.078 1.232 1.00 66.85 128 A 1 ATOM 1010 C CG . TYR A 0 128 . -12.010 2.330 -2.460 1.00 66.85 128 A 1 ATOM 1011 C CD1 . TYR A 0 128 . -12.815 1.824 -3.499 1.00 66.85 128 A 1 ATOM 1012 C CD2 . TYR A 0 128 . -10.642 2.571 -2.679 1.00 66.85 128 A 1 ATOM 1013 C CE1 . TYR A 0 128 . -12.250 1.562 -4.762 1.00 66.85 128 A 1 ATOM 1014 C CE2 . TYR A 0 128 . -10.073 2.312 -3.939 1.00 66.85 128 A 1 ATOM 1015 O OH . TYR A 0 128 . -10.337 1.567 -6.205 1.00 66.85 128 A 1 ATOM 1016 C CZ . TYR A 0 128 . -10.879 1.810 -4.983 1.00 66.85 128 A 1 ATOM 1017 N N . PRO A 0 129 . -15.411 4.728 0.025 1.00 61.76 129 A 1 ATOM 1018 C CA . PRO A 0 129 . -16.263 4.728 1.191 1.00 61.76 129 A 1 ATOM 1019 C C . PRO A 0 129 . -16.327 3.271 1.629 1.00 61.76 129 A 1 ATOM 1020 C CB . PRO A 0 129 . -17.610 5.294 0.732 1.00 61.76 129 A 1 ATOM 1021 O O . PRO A 0 129 . -16.613 2.390 0.812 1.00 61.76 129 A 1 ATOM 1022 C CG . PRO A 0 129 . -17.676 4.907 -0.743 1.00 61.76 129 A 1 ATOM 1023 C CD . PRO A 0 129 . -16.216 4.923 -1.181 1.00 61.76 129 A 1 ATOM 1024 N N . LEU A 0 130 . -16.011 3.009 2.898 1.00 64.35 130 A 1 ATOM 1025 C CA . LEU A 0 130 . -16.460 1.790 3.552 1.00 64.35 130 A 1 ATOM 1026 C C . LEU A 0 130 . -17.959 1.759 3.283 1.00 64.35 130 A 1 ATOM 1027 C CB . LEU A 0 130 . -16.163 1.868 5.061 1.00 64.35 130 A 1 ATOM 1028 O O . LEU A 0 130 . -18.688 2.572 3.849 1.00 64.35 130 A 1 ATOM 1029 C CG . LEU A 0 130 . -14.677 1.704 5.423 1.00 64.35 130 A 1 ATOM 1030 C CD1 . LEU A 0 130 . -14.450 2.134 6.871 1.00 64.35 130 A 1 ATOM 1031 C CD2 . LEU A 0 130 . -14.222 0.251 5.269 1.00 64.35 130 A 1 ATOM 1032 N N . LEU A 0 131 . -18.373 0.960 2.297 1.00 62.80 131 A 1 ATOM 1033 C CA . LEU A 0 131 . -19.757 0.818 1.888 1.00 62.80 131 A 1 ATOM 1034 C C . LEU A 0 131 . -20.474 0.357 3.144 1.00 62.80 131 A 1 ATOM 1035 C CB . LEU A 0 131 . -19.867 -0.174 0.708 1.00 62.80 131 A 1 ATOM 1036 O O . LEU A 0 131 . -20.396 -0.807 3.529 1.00 62.80 131 A 1 ATOM 1037 C CG . LEU A 0 131 . -20.119 0.516 -0.650 1.00 62.80 131 A 1 ATOM 1038 C CD1 . LEU A 0 131 . -19.205 -0.046 -1.738 1.00 62.80 131 A 1 ATOM 1039 C CD2 . LEU A 0 131 . -21.571 0.316 -1.094 1.00 62.80 131 A 1 ATOM 1040 N N . GLY A 0 132 . -21.065 1.326 3.838 1.00 59.14 132 A 1 ATOM 1041 C CA . GLY A 0 132 . -21.858 1.088 5.014 1.00 59.14 132 A 1 ATOM 1042 C C . GLY A 0 132 . -22.976 0.184 4.555 1.00 59.14 132 A 1 ATOM 1043 O O . GLY A 0 132 . -23.815 0.599 3.754 1.00 59.14 132 A 1 ATOM 1044 N N . CYS A 0 133 . -22.947 -1.060 5.023 1.00 60.83 133 A 1 ATOM 1045 C CA . CYS A 0 133 . -24.104 -1.931 5.008 1.00 60.83 133 A 1 ATOM 1046 C C . CYS A 0 133 . -25.213 -1.193 5.761 1.00 60.83 133 A 1 ATOM 1047 C CB . CYS A 0 133 . -23.752 -3.274 5.664 1.00 60.83 133 A 1 ATOM 1048 O O . CYS A 0 133 . -25.297 -1.248 6.982 1.00 60.83 133 A 1 ATOM 1049 S SG . CYS A 0 133 . -22.719 -4.273 4.554 1.00 60.83 133 A 1 ATOM 1050 N N . SER A 0 134 . -26.012 -0.425 5.024 1.00 64.24 134 A 1 ATOM 1051 C CA . SER A 0 134 . -27.304 0.056 5.478 1.00 64.24 134 A 1 ATOM 1052 C C . SER A 0 134 . -28.244 -1.130 5.396 1.00 64.24 134 A 1 ATOM 1053 C CB . SER A 0 134 . -27.815 1.195 4.590 1.00 64.24 134 A 1 ATOM 1054 O O . SER A 0 134 . -28.738 -1.441 4.314 1.00 64.24 134 A 1 ATOM 1055 O OG . SER A 0 134 . -27.066 2.367 4.826 1.00 64.24 134 A 1 ATOM 1056 N N . SER A 0 135 . -28.427 -1.835 6.506 1.00 65.65 135 A 1 ATOM 1057 C CA . SER A 0 135 . -29.587 -2.691 6.783 1.00 65.65 135 A 1 ATOM 1058 C C . SER A 0 135 . -29.671 -2.918 8.282 1.00 65.65 135 A 1 ATOM 1059 C CB . SER A 0 135 . -29.509 -4.051 6.097 1.00 65.65 135 A 1 ATOM 1060 O O . SER A 0 135 . -28.709 -3.506 8.822 1.00 65.65 135 A 1 ATOM 1061 O OG . SER A 0 135 . -29.464 -3.907 4.695 1.00 65.65 135 A 1 ATOM 1062 O OXT . SER A 0 135 . -30.686 -2.461 8.839 1.00 65.65 135 A 1 # _audit_conform.dict_name mmcif_ma.dic _audit_conform.dict_version 1.3.9 _audit_conform.dict_location https://raw.githubusercontent.com/ihmwg/ModelCIF/master/dist/mmcif_ma.dic # loop_ _pdbx_data_usage.id _pdbx_data_usage.type _pdbx_data_usage.details _pdbx_data_usage.url _pdbx_data_usage.name 1 license 'Data in this file is available under a CC-BY-4.0 license.' https://creativecommons.org/licenses/by/4.0/ CC-BY-4.0 2 disclaimer ;ALPHAFOLD DATA, COPYRIGHT (2021) DEEPMIND TECHNOLOGIES LIMITED. THE INFORMATION PROVIDED IS THEORETICAL MODELLING ONLY AND CAUTION SHOULD BE EXERCISED IN ITS USE. IT IS PROVIDED "AS-IS" WITHOUT ANY WARRANTY OF ANY KIND, WHETHER EXPRESSED OR IMPLIED. NO WARRANTY IS GIVEN THAT USE OF THE INFORMATION SHALL NOT INFRINGE THE RIGHTS OF ANY THIRD PARTY. DISCLAIMER: THE INFORMATION IS NOT INTENDED TO BE A SUBSTITUTE FOR PROFESSIONAL MEDICAL ADVICE, DIAGNOSIS, OR TREATMENT, AND DOES NOT CONSTITUTE MEDICAL OR OTHER PROFESSIONAL ADVICE. IT IS AVAILABLE FOR ACADEMIC AND COMMERCIAL PURPOSES, UNDER CC-BY 4.0 LICENCE. ; ? ? # loop_ _audit_author.name _audit_author.pdbx_ordinal 'Jumper, John' 1 'Evans, Richard' 2 'Pritzel, Alexander' 3 'Green, Tim' 4 'Figurnov, Michael' 5 'Ronneberger, Olaf' 6 'Tunyasuvunakool, Kathryn' 7 'Bates, Russ' 8 'Zidek, Augustin' 9 'Potapenko, Anna' 10 'Bridgland, Alex' 11 'Meyer, Clemens' 12 'Kohl, Simon A. A.' 13 'Ballard, Andrew J.' 14 'Cowie, Andrew' 15 'Romera-Paredes, Bernardino' 16 'Nikolov, Stanislav' 17 'Jain, Rishub' 18 'Adler, Jonas' 19 'Back, Trevor' 20 'Petersen, Stig' 21 'Reiman, David' 22 'Clancy, Ellen' 23 'Zielinski, Michal' 24 'Steinegger, Martin' 25 'Pacholska, Michalina' 26 'Berghammer, Tamas' 27 'Silver, David' 28 'Vinyals, Oriol' 29 'Senior, Andrew W.' 30 'Kavukcuoglu, Koray' 31 'Kohli, Pushmeet' 32 'Hassabis, Demis' 33 # loop_ _citation_author.citation_id _citation_author.name _citation_author.ordinal primary 'Jumper, John' 1 primary 'Evans, Richard' 2 primary 'Pritzel, Alexander' 3 primary 'Green, Tim' 4 primary 'Figurnov, Michael' 5 primary 'Ronneberger, Olaf' 6 primary 'Tunyasuvunakool, Kathryn' 7 primary 'Bates, Russ' 8 primary 'Zidek, Augustin' 9 primary 'Potapenko, Anna' 10 primary 'Bridgland, Alex' 11 primary 'Meyer, Clemens' 12 primary 'Kohl, Simon A. A.' 13 primary 'Ballard, Andrew J.' 14 primary 'Cowie, Andrew' 15 primary 'Romera-Paredes, Bernardino' 16 primary 'Nikolov, Stanislav' 17 primary 'Jain, Rishub' 18 primary 'Adler, Jonas' 19 primary 'Back, Trevor' 20 primary 'Petersen, Stig' 21 primary 'Reiman, David' 22 primary 'Clancy, Ellen' 23 primary 'Zielinski, Michal' 24 primary 'Steinegger, Martin' 25 primary 'Pacholska, Michalina' 26 primary 'Berghammer, Tamas' 27 primary 'Silver, David' 28 primary 'Vinyals, Oriol' 29 primary 'Senior, Andrew W.' 30 primary 'Kavukcuoglu, Koray' 31 primary 'Kohli, Pushmeet' 32 primary 'Hassabis, Demis' 33 # _citation.id primary _citation.title 'Highly accurate protein structure prediction with AlphaFold' _citation.journal_full Nature _citation.journal_volume 596 _citation.page_first 583 _citation.page_last 589 _citation.year 2021 _citation.journal_id_ASTM NATUAS _citation.country UK _citation.journal_id_ISSN 0028-0836 _citation.journal_id_CSD 0006 _citation.book_publisher ? _citation.pdbx_database_id_PubMed 34265844 _citation.pdbx_database_id_DOI 10.1038/s41586-021-03819-2 # _ma_data.id 1 _ma_data.name Model _ma_data.content_type 'model coordinates' # _ma_target_entity_instance.asym_id A _ma_target_entity_instance.entity_id 0 _ma_target_entity_instance.details . # _ma_target_entity.entity_id 0 _ma_target_entity.data_id 1 _ma_target_entity.origin . # _ma_model_list.ordinal_id 1 _ma_model_list.model_id 1 _ma_model_list.model_group_id 1 _ma_model_list.model_name 'Top ranked model' _ma_model_list.model_group_name 'AlphaFold Monomer v2.3.2 model' _ma_model_list.data_id 1 _ma_model_list.model_type 'Ab initio model' # _software.pdbx_ordinal 1 _software.name AlphaFold _software.version v2.3.2 _software.type package _software.description 'Structure prediction' _software.classification other _software.date ? # _ma_software_group.ordinal_id 1 _ma_software_group.group_id 1 _ma_software_group.software_id 1 # loop_ _ma_protocol_step.ordinal_id _ma_protocol_step.protocol_id _ma_protocol_step.step_id _ma_protocol_step.method_type 1 1 1 'coevolution MSA' 2 1 2 'template search' 3 1 3 modeling # loop_ _ma_qa_metric.id _ma_qa_metric.name _ma_qa_metric.type _ma_qa_metric.mode _ma_qa_metric.software_group_id 1 pLDDT pLDDT global 1 2 pLDDT pLDDT local 1 # _ma_qa_metric_global.ordinal_id 1 _ma_qa_metric_global.model_id 1 _ma_qa_metric_global.metric_id 1 _ma_qa_metric_global.metric_value 64.82 # loop_ _atom_type.symbol C N O S #