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 ILE 0 3 PHE 0 4 ILE 0 5 GLU 0 6 LYS 0 7 GLU 0 8 THR 0 9 TYR 0 10 ASN 0 11 ASN 0 12 TYR 0 13 SER 0 14 SER 0 15 ILE 0 16 ASN 0 17 ASP 0 18 GLY 0 19 TYR 0 20 VAL 0 21 MET 0 22 ASN 0 23 PRO 0 24 ILE 0 25 LEU 0 26 ILE 0 27 ILE 0 28 ASN 0 29 ASN 0 30 GLN 0 31 LYS 0 32 LEU 0 33 SER 0 34 ASP 0 35 TYR 0 36 VAL 0 37 THR 0 38 ALA 0 39 ASN 0 40 ASN 0 41 LEU 0 42 GLU 0 43 SER 0 44 THR 0 45 SER 0 46 TRP 0 47 THR 0 48 LEU 0 49 TRP 0 50 LEU 0 51 GLY 0 52 ILE 0 53 THR 0 54 VAL 0 55 VAL 0 56 LEU 0 57 LEU 0 58 THR 0 59 MET 0 60 ILE 0 61 ILE 0 62 THR 0 63 TRP 0 64 ILE 0 65 LEU 0 66 HIS 0 67 ILE 0 68 SER 0 69 ILE 0 70 MET 0 71 ILE 0 72 SER 0 73 VAL 0 74 CYS 0 75 ARG 0 76 ASN 0 77 MET 0 78 ILE 0 79 MET 0 80 LYS 0 81 HIS 0 82 THR 0 83 THR 0 84 TYR 0 85 TYR 0 86 TYR 0 87 ILE 0 88 ILE 0 89 SER 0 90 ILE 0 91 GLY 0 92 PHE 0 93 VAL 0 94 VAL 0 95 MET 0 96 LEU 0 97 HIS 0 98 SER 0 99 LEU 0 100 LEU 0 101 ASN 0 102 PHE 0 103 PRO 0 104 VAL 0 105 ASN 0 106 ILE 0 107 ILE 0 108 SER 0 109 ASP 0 110 LEU 0 111 ILE 0 112 GLU 0 113 VAL 0 114 PHE 0 115 SER 0 116 ILE 0 117 GLN 0 118 ILE 0 119 GLN 0 120 LYS 0 121 TYR 0 122 HIS 0 123 ARG 0 124 GLN 0 125 GLN 0 126 PHE 0 127 ILE 0 128 ILE 0 129 SER 0 130 ARG 0 131 ASP 0 132 THR # 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 . 27.438 27.483 -31.484 1.00 35.99 1 A 1 ATOM 2 C CA . MET A 0 1 . 27.146 26.160 -32.073 1.00 35.99 1 A 1 ATOM 3 C C . MET A 0 1 . 27.015 26.362 -33.573 1.00 35.99 1 A 1 ATOM 4 C CB . MET A 0 1 . 25.871 25.589 -31.432 1.00 35.99 1 A 1 ATOM 5 O O . MET A 0 1 . 26.098 27.054 -33.989 1.00 35.99 1 A 1 ATOM 6 C CG . MET A 0 1 . 25.454 24.209 -31.945 1.00 35.99 1 A 1 ATOM 7 S SD . MET A 0 1 . 24.058 23.559 -30.992 1.00 35.99 1 A 1 ATOM 8 C CE . MET A 0 1 . 23.616 22.120 -31.999 1.00 35.99 1 A 1 ATOM 9 N N . ILE A 0 2 . 27.993 25.903 -34.355 1.00 33.41 2 A 1 ATOM 10 C CA . ILE A 0 2 . 27.981 26.042 -35.818 1.00 33.41 2 A 1 ATOM 11 C C . ILE A 0 2 . 27.188 24.857 -36.368 1.00 33.41 2 A 1 ATOM 12 C CB . ILE A 0 2 . 29.422 26.129 -36.383 1.00 33.41 2 A 1 ATOM 13 O O . ILE A 0 2 . 27.580 23.709 -36.173 1.00 33.41 2 A 1 ATOM 14 C CG1 . ILE A 0 2 . 30.114 27.414 -35.862 1.00 33.41 2 A 1 ATOM 15 C CG2 . ILE A 0 2 . 29.417 26.106 -37.924 1.00 33.41 2 A 1 ATOM 16 C CD1 . ILE A 0 2 . 31.615 27.490 -36.165 1.00 33.41 2 A 1 ATOM 17 N N . PHE A 0 3 . 26.055 25.149 -37.003 1.00 36.36 3 A 1 ATOM 18 C CA . PHE A 0 3 . 25.286 24.188 -37.782 1.00 36.36 3 A 1 ATOM 19 C C . PHE A 0 3 . 25.893 24.137 -39.181 1.00 36.36 3 A 1 ATOM 20 C CB . PHE A 0 3 . 23.810 24.610 -37.827 1.00 36.36 3 A 1 ATOM 21 O O . PHE A 0 3 . 25.903 25.141 -39.886 1.00 36.36 3 A 1 ATOM 22 C CG . PHE A 0 3 . 23.062 24.385 -36.528 1.00 36.36 3 A 1 ATOM 23 C CD1 . PHE A 0 3 . 22.358 23.183 -36.328 1.00 36.36 3 A 1 ATOM 24 C CD2 . PHE A 0 3 . 23.059 25.372 -35.522 1.00 36.36 3 A 1 ATOM 25 C CE1 . PHE A 0 3 . 21.645 22.971 -35.134 1.00 36.36 3 A 1 ATOM 26 C CE2 . PHE A 0 3 . 22.348 25.158 -34.327 1.00 36.36 3 A 1 ATOM 27 C CZ . PHE A 0 3 . 21.635 23.962 -34.137 1.00 36.36 3 A 1 ATOM 28 N N . ILE A 0 4 . 26.423 22.979 -39.569 1.00 35.83 4 A 1 ATOM 29 C CA . ILE A 0 4 . 26.803 22.723 -40.957 1.00 35.83 4 A 1 ATOM 30 C C . ILE A 0 4 . 25.590 22.058 -41.599 1.00 35.83 4 A 1 ATOM 31 C CB . ILE A 0 4 . 28.120 21.924 -41.064 1.00 35.83 4 A 1 ATOM 32 O O . ILE A 0 4 . 25.377 20.851 -41.474 1.00 35.83 4 A 1 ATOM 33 C CG1 . ILE A 0 4 . 29.254 22.667 -40.313 1.00 35.83 4 A 1 ATOM 34 C CG2 . ILE A 0 4 . 28.483 21.732 -42.549 1.00 35.83 4 A 1 ATOM 35 C CD1 . ILE A 0 4 . 30.597 21.929 -40.297 1.00 35.83 4 A 1 ATOM 36 N N . GLU A 0 5 . 24.750 22.886 -42.212 1.00 40.77 5 A 1 ATOM 37 C CA . GLU A 0 5 . 23.666 22.457 -43.085 1.00 40.77 5 A 1 ATOM 38 C C . GLU A 0 5 . 24.295 21.751 -44.288 1.00 40.77 5 A 1 ATOM 39 C CB . GLU A 0 5 . 22.827 23.685 -43.463 1.00 40.77 5 A 1 ATOM 40 O O . GLU A 0 5 . 24.934 22.360 -45.144 1.00 40.77 5 A 1 ATOM 41 C CG . GLU A 0 5 . 21.557 23.338 -44.254 1.00 40.77 5 A 1 ATOM 42 C CD . GLU A 0 5 . 20.603 24.540 -44.390 1.00 40.77 5 A 1 ATOM 43 O OE1 . GLU A 0 5 . 19.430 24.287 -44.748 1.00 40.77 5 A 1 ATOM 44 O OE2 . GLU A 0 5 . 21.019 25.674 -44.058 1.00 40.77 5 A 1 ATOM 45 N N . LYS A 0 6 . 24.203 20.421 -44.300 1.00 36.88 6 A 1 ATOM 46 C CA . LYS A 0 6 . 24.663 19.619 -45.425 1.00 36.88 6 A 1 ATOM 47 C C . LYS A 0 6 . 23.615 19.735 -46.527 1.00 36.88 6 A 1 ATOM 48 C CB . LYS A 0 6 . 24.968 18.187 -44.954 1.00 36.88 6 A 1 ATOM 49 O O . LYS A 0 6 . 22.726 18.891 -46.634 1.00 36.88 6 A 1 ATOM 50 C CG . LYS A 0 6 . 25.900 17.455 -45.929 1.00 36.88 6 A 1 ATOM 51 C CD . LYS A 0 6 . 26.164 16.026 -45.442 1.00 36.88 6 A 1 ATOM 52 C CE . LYS A 0 6 . 27.186 15.341 -46.354 1.00 36.88 6 A 1 ATOM 53 N NZ . LYS A 0 6 . 27.405 13.929 -45.954 1.00 36.88 6 A 1 ATOM 54 N N . GLU A 0 7 . 23.718 20.790 -47.329 1.00 34.20 7 A 1 ATOM 55 C CA . GLU A 0 7 . 23.049 20.861 -48.622 1.00 34.20 7 A 1 ATOM 56 C C . GLU A 0 7 . 23.420 19.608 -49.423 1.00 34.20 7 A 1 ATOM 57 C CB . GLU A 0 7 . 23.459 22.113 -49.410 1.00 34.20 7 A 1 ATOM 58 O O . GLU A 0 7 . 24.554 19.416 -49.855 1.00 34.20 7 A 1 ATOM 59 C CG . GLU A 0 7 . 22.883 23.419 -48.842 1.00 34.20 7 A 1 ATOM 60 C CD . GLU A 0 7 . 23.067 24.600 -49.815 1.00 34.20 7 A 1 ATOM 61 O OE1 . GLU A 0 7 . 22.319 25.590 -49.669 1.00 34.20 7 A 1 ATOM 62 O OE2 . GLU A 0 7 . 23.922 24.489 -50.725 1.00 34.20 7 A 1 ATOM 63 N N . THR A 0 8 . 22.460 18.707 -49.588 1.00 35.50 8 A 1 ATOM 64 C CA . THR A 0 8 . 22.505 17.691 -50.642 1.00 35.50 8 A 1 ATOM 65 C C . THR A 0 8 . 21.184 17.755 -51.387 1.00 35.50 8 A 1 ATOM 66 C CB . THR A 0 8 . 22.927 16.287 -50.158 1.00 35.50 8 A 1 ATOM 67 O O . THR A 0 8 . 20.347 16.860 -51.336 1.00 35.50 8 A 1 ATOM 68 C CG2 . THR A 0 8 . 24.431 16.073 -50.349 1.00 35.50 8 A 1 ATOM 69 O OG1 . THR A 0 8 . 22.682 16.090 -48.783 1.00 35.50 8 A 1 ATOM 70 N N . TYR A 0 9 . 21.011 18.882 -52.082 1.00 32.95 9 A 1 ATOM 71 C CA . TYR A 0 9 . 20.169 18.982 -53.264 1.00 32.95 9 A 1 ATOM 72 C C . TYR A 0 9 . 20.771 18.088 -54.347 1.00 32.95 9 A 1 ATOM 73 C CB . TYR A 0 9 . 20.153 20.436 -53.769 1.00 32.95 9 A 1 ATOM 74 O O . TYR A 0 9 . 21.678 18.507 -55.054 1.00 32.95 9 A 1 ATOM 75 C CG . TYR A 0 9 . 19.183 21.350 -53.064 1.00 32.95 9 A 1 ATOM 76 C CD1 . TYR A 0 9 . 17.864 21.457 -53.547 1.00 32.95 9 A 1 ATOM 77 C CD2 . TYR A 0 9 . 19.603 22.127 -51.968 1.00 32.95 9 A 1 ATOM 78 C CE1 . TYR A 0 9 . 16.960 22.339 -52.929 1.00 32.95 9 A 1 ATOM 79 C CE2 . TYR A 0 9 . 18.700 23.008 -51.346 1.00 32.95 9 A 1 ATOM 80 O OH . TYR A 0 9 . 16.503 23.971 -51.240 1.00 32.95 9 A 1 ATOM 81 C CZ . TYR A 0 9 . 17.377 23.115 -51.828 1.00 32.95 9 A 1 ATOM 82 N N . ASN A 0 10 . 20.259 16.872 -54.505 1.00 34.64 10 A 1 ATOM 83 C CA . ASN A 0 10 . 20.426 16.142 -55.757 1.00 34.64 10 A 1 ATOM 84 C C . ASN A 0 10 . 19.049 15.937 -56.376 1.00 34.64 10 A 1 ATOM 85 C CB . ASN A 0 10 . 21.268 14.873 -55.561 1.00 34.64 10 A 1 ATOM 86 O O . ASN A 0 10 . 18.350 14.970 -56.087 1.00 34.64 10 A 1 ATOM 87 C CG . ASN A 0 10 . 22.764 15.160 -55.533 1.00 34.64 10 A 1 ATOM 88 N ND2 . ASN A 0 10 . 23.561 14.206 -55.118 1.00 34.64 10 A 1 ATOM 89 O OD1 . ASN A 0 10 . 23.263 16.198 -55.916 1.00 34.64 10 A 1 ATOM 90 N N . ASN A 0 11 . 18.687 16.938 -57.183 1.00 32.17 11 A 1 ATOM 91 C CA . ASN A 0 11 . 17.859 16.870 -58.384 1.00 32.17 11 A 1 ATOM 92 C C . ASN A 0 11 . 17.201 15.507 -58.630 1.00 32.17 11 A 1 ATOM 93 C CB . ASN A 0 11 . 18.756 17.264 -59.579 1.00 32.17 11 A 1 ATOM 94 O O . ASN A 0 11 . 17.737 14.661 -59.348 1.00 32.17 11 A 1 ATOM 95 C CG . ASN A 0 11 . 18.934 18.760 -59.726 1.00 32.17 11 A 1 ATOM 96 N ND2 . ASN A 0 11 . 20.110 19.226 -60.075 1.00 32.17 11 A 1 ATOM 97 O OD1 . ASN A 0 11 . 18.017 19.532 -59.533 1.00 32.17 11 A 1 ATOM 98 N N . TYR A 0 12 . 15.986 15.337 -58.113 1.00 34.84 12 A 1 ATOM 99 C CA . TYR A 0 12 . 15.031 14.474 -58.789 1.00 34.84 12 A 1 ATOM 100 C C . TYR A 0 12 . 14.671 15.150 -60.112 1.00 34.84 12 A 1 ATOM 101 C CB . TYR A 0 12 . 13.815 14.177 -57.903 1.00 34.84 12 A 1 ATOM 102 O O . TYR A 0 12 . 13.974 16.161 -60.157 1.00 34.84 12 A 1 ATOM 103 C CG . TYR A 0 12 . 13.931 12.834 -57.209 1.00 34.84 12 A 1 ATOM 104 C CD1 . TYR A 0 12 . 13.315 11.701 -57.776 1.00 34.84 12 A 1 ATOM 105 C CD2 . TYR A 0 12 . 14.691 12.706 -56.030 1.00 34.84 12 A 1 ATOM 106 C CE1 . TYR A 0 12 . 13.441 10.444 -57.156 1.00 34.84 12 A 1 ATOM 107 C CE2 . TYR A 0 12 . 14.814 11.450 -55.403 1.00 34.84 12 A 1 ATOM 108 O OH . TYR A 0 12 . 14.298 9.105 -55.364 1.00 34.84 12 A 1 ATOM 109 C CZ . TYR A 0 12 . 14.185 10.318 -55.966 1.00 34.84 12 A 1 ATOM 110 N N . SER A 0 13 . 15.230 14.598 -61.185 1.00 36.64 13 A 1 ATOM 111 C CA . SER A 0 13 . 14.808 14.839 -62.558 1.00 36.64 13 A 1 ATOM 112 C C . SER A 0 13 . 13.324 14.497 -62.676 1.00 36.64 13 A 1 ATOM 113 C CB . SER A 0 13 . 15.633 13.929 -63.474 1.00 36.64 13 A 1 ATOM 114 O O . SER A 0 13 . 12.947 13.337 -62.526 1.00 36.64 13 A 1 ATOM 115 O OG . SER A 0 13 . 15.292 14.132 -64.829 1.00 36.64 13 A 1 ATOM 116 N N . SER A 0 14 . 12.478 15.493 -62.915 1.00 37.77 14 A 1 ATOM 117 C CA . SER A 0 14 . 11.089 15.268 -63.305 1.00 37.77 14 A 1 ATOM 118 C C . SER A 0 14 . 10.691 16.335 -64.305 1.00 37.77 14 A 1 ATOM 119 C CB . SER A 0 14 . 10.155 15.229 -62.101 1.00 37.77 14 A 1 ATOM 120 O O . SER A 0 14 . 10.269 17.438 -63.970 1.00 37.77 14 A 1 ATOM 121 O OG . SER A 0 14 . 8.853 14.881 -62.516 1.00 37.77 14 A 1 ATOM 122 N N . ILE A 0 15 . 10.909 15.966 -65.558 1.00 36.55 15 A 1 ATOM 123 C CA . ILE A 0 15 . 10.268 16.521 -66.738 1.00 36.55 15 A 1 ATOM 124 C C . ILE A 0 15 . 8.753 16.530 -66.494 1.00 36.55 15 A 1 ATOM 125 C CB . ILE A 0 15 . 10.650 15.603 -67.927 1.00 36.55 15 A 1 ATOM 126 O O . ILE A 0 15 . 8.187 15.486 -66.199 1.00 36.55 15 A 1 ATOM 127 C CG1 . ILE A 0 15 . 12.174 15.667 -68.203 1.00 36.55 15 A 1 ATOM 128 C CG2 . ILE A 0 15 . 9.860 15.936 -69.203 1.00 36.55 15 A 1 ATOM 129 C CD1 . ILE A 0 15 . 12.698 14.467 -69.000 1.00 36.55 15 A 1 ATOM 130 N N . ASN A 0 16 . 8.147 17.700 -66.687 1.00 33.50 16 A 1 ATOM 131 C CA . ASN A 0 16 . 6.722 17.952 -66.894 1.00 33.50 16 A 1 ATOM 132 C C . ASN A 0 16 . 5.726 17.618 -65.767 1.00 33.50 16 A 1 ATOM 133 C CB . ASN A 0 16 . 6.287 17.370 -68.248 1.00 33.50 16 A 1 ATOM 134 O O . ASN A 0 16 . 5.692 16.538 -65.195 1.00 33.50 16 A 1 ATOM 135 C CG . ASN A 0 16 . 6.952 18.036 -69.436 1.00 33.50 16 A 1 ATOM 136 N ND2 . ASN A 0 16 . 6.682 17.548 -70.623 1.00 33.50 16 A 1 ATOM 137 O OD1 . ASN A 0 16 . 7.715 18.985 -69.338 1.00 33.50 16 A 1 ATOM 138 N N . ASP A 0 17 . 4.834 18.593 -65.597 1.00 36.29 17 A 1 ATOM 139 C CA . ASP A 0 17 . 3.466 18.501 -65.102 1.00 36.29 17 A 1 ATOM 140 C C . ASP A 0 17 . 3.226 18.130 -63.639 1.00 36.29 17 A 1 ATOM 141 C CB . ASP A 0 17 . 2.603 17.675 -66.069 1.00 36.29 17 A 1 ATOM 142 O O . ASP A 0 17 . 3.340 16.988 -63.221 1.00 36.29 17 A 1 ATOM 143 C CG . ASP A 0 17 . 2.637 18.241 -67.493 1.00 36.29 17 A 1 ATOM 144 O OD1 . ASP A 0 17 . 2.863 19.468 -67.628 1.00 36.29 17 A 1 ATOM 145 O OD2 . ASP A 0 17 . 2.463 17.449 -68.443 1.00 36.29 17 A 1 ATOM 146 N N . GLY A 0 18 . 2.674 19.120 -62.931 1.00 34.56 18 A 1 ATOM 147 C CA . GLY A 0 18 . 1.515 18.895 -62.075 1.00 34.56 18 A 1 ATOM 148 C C . GLY A 0 18 . 1.798 18.250 -60.723 1.00 34.56 18 A 1 ATOM 149 O O . GLY A 0 18 . 2.354 17.172 -60.608 1.00 34.56 18 A 1 ATOM 150 N N . TYR A 0 19 . 1.262 18.890 -59.687 1.00 35.56 19 A 1 ATOM 151 C CA . TYR A 0 19 . 1.265 18.439 -58.297 1.00 35.56 19 A 1 ATOM 152 C C . TYR A 0 19 . 2.621 18.600 -57.609 1.00 35.56 19 A 1 ATOM 153 C CB . TYR A 0 19 . 0.622 17.047 -58.147 1.00 35.56 19 A 1 ATOM 154 O O . TYR A 0 19 . 3.490 17.734 -57.621 1.00 35.56 19 A 1 ATOM 155 C CG . TYR A 0 19 . -0.689 16.929 -58.904 1.00 35.56 19 A 1 ATOM 156 C CD1 . TYR A 0 19 . -1.858 17.502 -58.368 1.00 35.56 19 A 1 ATOM 157 C CD2 . TYR A 0 19 . -0.722 16.326 -60.178 1.00 35.56 19 A 1 ATOM 158 C CE1 . TYR A 0 19 . -3.057 17.480 -59.105 1.00 35.56 19 A 1 ATOM 159 C CE2 . TYR A 0 19 . -1.914 16.315 -60.924 1.00 35.56 19 A 1 ATOM 160 O OH . TYR A 0 19 . -4.236 16.874 -61.107 1.00 35.56 19 A 1 ATOM 161 C CZ . TYR A 0 19 . -3.084 16.890 -60.388 1.00 35.56 19 A 1 ATOM 162 N N . VAL A 0 20 . 2.742 19.731 -56.907 1.00 37.38 20 A 1 ATOM 163 C CA . VAL A 0 20 . 3.625 19.863 -55.748 1.00 37.38 20 A 1 ATOM 164 C C . VAL A 0 20 . 3.200 18.776 -54.766 1.00 37.38 20 A 1 ATOM 165 C CB . VAL A 0 20 . 3.518 21.271 -55.123 1.00 37.38 20 A 1 ATOM 166 O O . VAL A 0 20 . 2.262 18.937 -53.987 1.00 37.38 20 A 1 ATOM 167 C CG1 . VAL A 0 20 . 4.429 21.426 -53.898 1.00 37.38 20 A 1 ATOM 168 C CG2 . VAL A 0 20 . 3.909 22.351 -56.141 1.00 37.38 20 A 1 ATOM 169 N N . MET A 0 21 . 3.831 17.614 -54.879 1.00 33.99 21 A 1 ATOM 170 C CA . MET A 0 21 . 3.695 16.545 -53.915 1.00 33.99 21 A 1 ATOM 171 C C . MET A 0 21 . 4.373 17.077 -52.657 1.00 33.99 21 A 1 ATOM 172 C CB . MET A 0 21 . 4.313 15.257 -54.494 1.00 33.99 21 A 1 ATOM 173 O O . MET A 0 21 . 5.601 17.132 -52.588 1.00 33.99 21 A 1 ATOM 174 C CG . MET A 0 21 . 3.541 14.001 -54.083 1.00 33.99 21 A 1 ATOM 175 S SD . MET A 0 21 . 4.019 12.540 -55.047 1.00 33.99 21 A 1 ATOM 176 C CE . MET A 0 21 . 2.611 11.450 -54.719 1.00 33.99 21 A 1 ATOM 177 N N . ASN A 0 22 . 3.577 17.572 -51.701 1.00 37.93 22 A 1 ATOM 178 C CA . ASN A 0 22 . 4.087 17.930 -50.384 1.00 37.93 22 A 1 ATOM 179 C C . ASN A 0 22 . 4.924 16.741 -49.911 1.00 37.93 22 A 1 ATOM 180 C CB . ASN A 0 22 . 2.942 18.204 -49.393 1.00 37.93 22 A 1 ATOM 181 O O . ASN A 0 22 . 4.382 15.631 -49.868 1.00 37.93 22 A 1 ATOM 182 C CG . ASN A 0 22 . 2.347 19.590 -49.535 1.00 37.93 22 A 1 ATOM 183 N ND2 . ASN A 0 22 . 1.832 20.147 -48.464 1.00 37.93 22 A 1 ATOM 184 O OD1 . ASN A 0 22 . 2.338 20.202 -50.583 1.00 37.93 22 A 1 ATOM 185 N N . PRO A 0 23 . 6.225 16.930 -49.627 1.00 44.95 23 A 1 ATOM 186 C CA . PRO A 0 23 . 7.076 15.819 -49.263 1.00 44.95 23 A 1 ATOM 187 C C . PRO A 0 23 . 6.419 15.142 -48.070 1.00 44.95 23 A 1 ATOM 188 C CB . PRO A 0 23 . 8.456 16.415 -48.960 1.00 44.95 23 A 1 ATOM 189 O O . PRO A 0 23 . 6.193 15.775 -47.036 1.00 44.95 23 A 1 ATOM 190 C CG . PRO A 0 23 . 8.166 17.887 -48.664 1.00 44.95 23 A 1 ATOM 191 C CD . PRO A 0 23 . 6.947 18.186 -49.534 1.00 44.95 23 A 1 ATOM 192 N N . ILE A 0 24 . 6.071 13.863 -48.236 1.00 44.76 24 A 1 ATOM 193 C CA . ILE A 0 24 . 5.844 12.981 -47.101 1.00 44.76 24 A 1 ATOM 194 C C . ILE A 0 24 . 7.118 13.144 -46.292 1.00 44.76 24 A 1 ATOM 195 C CB . ILE A 0 24 . 5.602 11.523 -47.550 1.00 44.76 24 A 1 ATOM 196 O O . ILE A 0 24 . 8.198 12.758 -46.740 1.00 44.76 24 A 1 ATOM 197 C CG1 . ILE A 0 24 . 4.262 11.436 -48.318 1.00 44.76 24 A 1 ATOM 198 C CG2 . ILE A 0 24 . 5.600 10.572 -46.336 1.00 44.76 24 A 1 ATOM 199 C CD1 . ILE A 0 24 . 4.048 10.102 -49.042 1.00 44.76 24 A 1 ATOM 200 N N . LEU A 0 25 . 7.005 13.853 -45.172 1.00 47.87 25 A 1 ATOM 201 C CA . LEU A 0 25 . 8.107 14.107 -44.275 1.00 47.87 25 A 1 ATOM 202 C C . LEU A 0 25 . 8.452 12.731 -43.710 1.00 47.87 25 A 1 ATOM 203 C CB . LEU A 0 25 . 7.670 15.152 -43.223 1.00 47.87 25 A 1 ATOM 204 O O . LEU A 0 25 . 7.866 12.287 -42.725 1.00 47.87 25 A 1 ATOM 205 C CG . LEU A 0 25 . 8.849 15.888 -42.561 1.00 47.87 25 A 1 ATOM 206 C CD1 . LEU A 0 25 . 9.264 17.108 -43.387 1.00 47.87 25 A 1 ATOM 207 C CD2 . LEU A 0 25 . 8.474 16.404 -41.173 1.00 47.87 25 A 1 ATOM 208 N N . ILE A 0 26 . 9.339 12.009 -44.394 1.00 47.11 26 A 1 ATOM 209 C CA . ILE A 0 26 . 9.972 10.810 -43.869 1.00 47.11 26 A 1 ATOM 210 C C . ILE A 0 26 . 10.861 11.350 -42.757 1.00 47.11 26 A 1 ATOM 211 C CB . ILE A 0 26 . 10.731 10.013 -44.959 1.00 47.11 26 A 1 ATOM 212 O O . ILE A 0 26 . 12.028 11.686 -42.960 1.00 47.11 26 A 1 ATOM 213 C CG1 . ILE A 0 26 . 9.793 9.601 -46.119 1.00 47.11 26 A 1 ATOM 214 C CG2 . ILE A 0 26 . 11.363 8.758 -44.324 1.00 47.11 26 A 1 ATOM 215 C CD1 . ILE A 0 26 . 10.520 8.990 -47.324 1.00 47.11 26 A 1 ATOM 216 N N . ILE A 0 27 . 10.258 11.557 -41.586 1.00 49.87 27 A 1 ATOM 217 C CA . ILE A 0 27 . 10.977 11.822 -40.354 1.00 49.87 27 A 1 ATOM 218 C C . ILE A 0 27 . 11.806 10.565 -40.165 1.00 49.87 27 A 1 ATOM 219 C CB . ILE A 0 27 . 10.021 12.095 -39.168 1.00 49.87 27 A 1 ATOM 220 O O . ILE A 0 27 . 11.290 9.528 -39.759 1.00 49.87 27 A 1 ATOM 221 C CG1 . ILE A 0 27 . 9.127 13.322 -39.452 1.00 49.87 27 A 1 ATOM 222 C CG2 . ILE A 0 27 . 10.837 12.326 -37.880 1.00 49.87 27 A 1 ATOM 223 C CD1 . ILE A 0 27 . 8.025 13.542 -38.407 1.00 49.87 27 A 1 ATOM 224 N N . ASN A 0 28 . 13.074 10.648 -40.567 1.00 48.04 28 A 1 ATOM 225 C CA . ASN A 0 28 . 14.086 9.643 -40.304 1.00 48.04 28 A 1 ATOM 226 C C . ASN A 0 28 . 13.865 9.145 -38.870 1.00 48.04 28 A 1 ATOM 227 C CB . ASN A 0 28 . 15.454 10.326 -40.515 1.00 48.04 28 A 1 ATOM 228 O O . ASN A 0 28 . 13.813 9.967 -37.953 1.00 48.04 28 A 1 ATOM 229 C CG . ASN A 0 28 . 16.647 9.443 -40.201 1.00 48.04 28 A 1 ATOM 230 N ND2 . ASN A 0 28 . 17.840 9.983 -40.274 1.00 48.04 28 A 1 ATOM 231 O OD1 . ASN A 0 28 . 16.515 8.286 -39.843 1.00 48.04 28 A 1 ATOM 232 N N . ASN A 0 29 . 13.686 7.835 -38.680 1.00 50.57 29 A 1 ATOM 233 C CA . ASN A 0 29 . 13.392 7.226 -37.378 1.00 50.57 29 A 1 ATOM 234 C C . ASN A 0 29 . 14.358 7.705 -36.274 1.00 50.57 29 A 1 ATOM 235 C CB . ASN A 0 29 . 13.454 5.694 -37.534 1.00 50.57 29 A 1 ATOM 236 O O . ASN A 0 29 . 13.987 7.734 -35.103 1.00 50.57 29 A 1 ATOM 237 C CG . ASN A 0 29 . 12.327 5.112 -38.374 1.00 50.57 29 A 1 ATOM 238 N ND2 . ASN A 0 29 . 12.434 3.864 -38.766 1.00 50.57 29 A 1 ATOM 239 O OD1 . ASN A 0 29 . 11.344 5.749 -38.693 1.00 50.57 29 A 1 ATOM 240 N N . GLN A 0 30 . 15.562 8.152 -36.650 1.00 48.58 30 A 1 ATOM 241 C CA . GLN A 0 30 . 16.524 8.808 -35.765 1.00 48.58 30 A 1 ATOM 242 C C . GLN A 0 30 . 16.005 10.121 -35.166 1.00 48.58 30 A 1 ATOM 243 C CB . GLN A 0 30 . 17.824 9.065 -36.536 1.00 48.58 30 A 1 ATOM 244 O O . GLN A 0 30 . 16.098 10.299 -33.962 1.00 48.58 30 A 1 ATOM 245 C CG . GLN A 0 30 . 18.495 7.752 -36.963 1.00 48.58 30 A 1 ATOM 246 C CD . GLN A 0 30 . 19.804 7.999 -37.697 1.00 48.58 30 A 1 ATOM 247 N NE2 . GLN A 0 30 . 20.886 7.381 -37.276 1.00 48.58 30 A 1 ATOM 248 O OE1 . GLN A 0 30 . 19.877 8.738 -38.667 1.00 48.58 30 A 1 ATOM 249 N N . LYS A 0 31 . 15.374 11.008 -35.947 1.00 52.03 31 A 1 ATOM 250 C CA . LYS A 0 31 . 14.877 12.296 -35.438 1.00 52.03 31 A 1 ATOM 251 C C . LYS A 0 31 . 13.674 12.112 -34.511 1.00 52.03 31 A 1 ATOM 252 C CB . LYS A 0 31 . 14.590 13.260 -36.602 1.00 52.03 31 A 1 ATOM 253 O O . LYS A 0 31 . 13.554 12.845 -33.540 1.00 52.03 31 A 1 ATOM 254 C CG . LYS A 0 31 . 14.606 14.727 -36.139 1.00 52.03 31 A 1 ATOM 255 C CD . LYS A 0 31 . 14.333 15.699 -37.297 1.00 52.03 31 A 1 ATOM 256 C CE . LYS A 0 31 . 14.565 17.148 -36.840 1.00 52.03 31 A 1 ATOM 257 N NZ . LYS A 0 31 . 14.229 18.132 -37.901 1.00 52.03 31 A 1 ATOM 258 N N . LEU A 0 32 . 12.803 11.127 -34.763 1.00 51.34 32 A 1 ATOM 259 C CA . LEU A 0 32 . 11.710 10.806 -33.834 1.00 51.34 32 A 1 ATOM 260 C C . LEU A 0 32 . 12.253 10.218 -32.522 1.00 51.34 32 A 1 ATOM 261 C CB . LEU A 0 32 . 10.696 9.865 -34.509 1.00 51.34 32 A 1 ATOM 262 O O . LEU A 0 32 . 11.827 10.636 -31.450 1.00 51.34 32 A 1 ATOM 263 C CG . LEU A 0 32 . 9.407 9.661 -33.683 1.00 51.34 32 A 1 ATOM 264 C CD1 . LEU A 0 32 . 8.572 10.943 -33.590 1.00 51.34 32 A 1 ATOM 265 C CD2 . LEU A 0 32 . 8.544 8.582 -34.335 1.00 51.34 32 A 1 ATOM 266 N N . SER A 0 33 . 13.239 9.319 -32.613 1.00 51.56 33 A 1 ATOM 267 C CA . SER A 0 33 . 14.031 8.850 -31.468 1.00 51.56 33 A 1 ATOM 268 C C . SER A 0 33 . 14.635 10.025 -30.700 1.00 51.56 33 A 1 ATOM 269 C CB . SER A 0 33 . 15.122 7.886 -31.967 1.00 51.56 33 A 1 ATOM 270 O O . SER A 0 33 . 14.484 10.098 -29.485 1.00 51.56 33 A 1 ATOM 271 O OG . SER A 0 33 . 16.296 7.893 -31.180 1.00 51.56 33 A 1 ATOM 272 N N . ASP A 0 34 . 15.241 10.986 -31.393 1.00 52.48 34 A 1 ATOM 273 C CA . ASP A 0 34 . 15.860 12.153 -30.772 1.00 52.48 34 A 1 ATOM 274 C C . ASP A 0 34 . 14.823 13.087 -30.155 1.00 52.48 34 A 1 ATOM 275 C CB . ASP A 0 34 . 16.722 12.920 -31.781 1.00 52.48 34 A 1 ATOM 276 O O . ASP A 0 34 . 15.099 13.640 -29.107 1.00 52.48 34 A 1 ATOM 277 C CG . ASP A 0 34 . 17.915 12.120 -32.314 1.00 52.48 34 A 1 ATOM 278 O OD1 . ASP A 0 34 . 18.316 11.131 -31.657 1.00 52.48 34 A 1 ATOM 279 O OD2 . ASP A 0 34 . 18.409 12.521 -33.393 1.00 52.48 34 A 1 ATOM 280 N N . TYR A 0 35 . 13.615 13.236 -30.709 1.00 49.27 35 A 1 ATOM 281 C CA . TYR A 0 35 . 12.540 13.990 -30.047 1.00 49.27 35 A 1 ATOM 282 C C . TYR A 0 35 . 12.034 13.282 -28.786 1.00 49.27 35 A 1 ATOM 283 C CB . TYR A 0 35 . 11.379 14.265 -31.015 1.00 49.27 35 A 1 ATOM 284 O O . TYR A 0 35 . 11.783 13.941 -27.780 1.00 49.27 35 A 1 ATOM 285 C CG . TYR A 0 35 . 11.529 15.559 -31.791 1.00 49.27 35 A 1 ATOM 286 C CD1 . TYR A 0 35 . 11.276 16.791 -31.158 1.00 49.27 35 A 1 ATOM 287 C CD2 . TYR A 0 35 . 11.903 15.539 -33.145 1.00 49.27 35 A 1 ATOM 288 C CE1 . TYR A 0 35 . 11.425 17.998 -31.869 1.00 49.27 35 A 1 ATOM 289 C CE2 . TYR A 0 35 . 12.069 16.738 -33.856 1.00 49.27 35 A 1 ATOM 290 O OH . TYR A 0 35 . 12.011 19.124 -33.920 1.00 49.27 35 A 1 ATOM 291 C CZ . TYR A 0 35 . 11.840 17.971 -33.219 1.00 49.27 35 A 1 ATOM 292 N N . VAL A 0 36 . 11.914 11.952 -28.805 1.00 51.18 36 A 1 ATOM 293 C CA . VAL A 0 36 . 11.528 11.161 -27.623 1.00 51.18 36 A 1 ATOM 294 C C . VAL A 0 36 . 12.635 11.185 -26.559 1.00 51.18 36 A 1 ATOM 295 C CB . VAL A 0 36 . 11.152 9.724 -28.046 1.00 51.18 36 A 1 ATOM 296 O O . VAL A 0 36 . 12.342 11.267 -25.367 1.00 51.18 36 A 1 ATOM 297 C CG1 . VAL A 0 36 . 10.873 8.804 -26.852 1.00 51.18 36 A 1 ATOM 298 C CG2 . VAL A 0 36 . 9.878 9.728 -28.906 1.00 51.18 36 A 1 ATOM 299 N N . THR A 0 37 . 13.901 11.190 -26.982 1.00 48.30 37 A 1 ATOM 300 C CA . THR A 0 37 . 15.078 11.196 -26.098 1.00 48.30 37 A 1 ATOM 301 C C . THR A 0 37 . 15.418 12.605 -25.594 1.00 48.30 37 A 1 ATOM 302 C CB . THR A 0 37 . 16.299 10.563 -26.794 1.00 48.30 37 A 1 ATOM 303 O O . THR A 0 37 . 15.749 12.771 -24.425 1.00 48.30 37 A 1 ATOM 304 C CG2 . THR A 0 37 . 17.394 10.181 -25.800 1.00 48.30 37 A 1 ATOM 305 O OG1 . THR A 0 37 . 15.955 9.355 -27.431 1.00 48.30 37 A 1 ATOM 306 N N . ALA A 0 38 . 15.281 13.642 -26.427 1.00 50.58 38 A 1 ATOM 307 C CA . ALA A 0 38 . 15.475 15.051 -26.066 1.00 50.58 38 A 1 ATOM 308 C C . ALA A 0 38 . 14.357 15.562 -25.161 1.00 50.58 38 A 1 ATOM 309 C CB . ALA A 0 38 . 15.559 15.925 -27.324 1.00 50.58 38 A 1 ATOM 310 O O . ALA A 0 38 . 14.610 16.390 -24.289 1.00 50.58 38 A 1 ATOM 311 N N . ASN A 0 39 . 13.150 15.006 -25.299 1.00 48.85 39 A 1 ATOM 312 C CA . ASN A 0 39 . 12.094 15.202 -24.317 1.00 48.85 39 A 1 ATOM 313 C C . ASN A 0 39 . 12.336 14.435 -23.023 1.00 48.85 39 A 1 ATOM 314 C CB . ASN A 0 39 . 10.722 14.888 -24.931 1.00 48.85 39 A 1 ATOM 315 O O . ASN A 0 39 . 11.412 14.429 -22.216 1.00 48.85 39 A 1 ATOM 316 C CG . ASN A 0 39 . 10.251 15.983 -25.860 1.00 48.85 39 A 1 ATOM 317 N ND2 . ASN A 0 39 . 9.238 15.707 -26.646 1.00 48.85 39 A 1 ATOM 318 O OD1 . ASN A 0 39 . 10.726 17.105 -25.878 1.00 48.85 39 A 1 ATOM 319 N N . ASN A 0 40 . 13.526 13.824 -22.842 1.00 48.14 40 A 1 ATOM 320 C CA . ASN A 0 40 . 14.063 13.307 -21.583 1.00 48.14 40 A 1 ATOM 321 C C . ASN A 0 40 . 12.913 12.822 -20.718 1.00 48.14 40 A 1 ATOM 322 C CB . ASN A 0 40 . 14.972 14.374 -20.927 1.00 48.14 40 A 1 ATOM 323 O O . ASN A 0 40 . 12.660 13.361 -19.642 1.00 48.14 40 A 1 ATOM 324 C CG . ASN A 0 40 . 16.411 13.931 -20.766 1.00 48.14 40 A 1 ATOM 325 N ND2 . ASN A 0 40 . 17.325 14.873 -20.782 1.00 48.14 40 A 1 ATOM 326 O OD1 . ASN A 0 40 . 16.752 12.769 -20.617 1.00 48.14 40 A 1 ATOM 327 N N . LEU A 0 41 . 12.112 11.918 -21.301 1.00 44.08 41 A 1 ATOM 328 C CA . LEU A 0 41 . 10.905 11.406 -20.686 1.00 44.08 41 A 1 ATOM 329 C C . LEU A 0 41 . 11.395 10.481 -19.573 1.00 44.08 41 A 1 ATOM 330 C CB . LEU A 0 41 . 9.975 10.749 -21.736 1.00 44.08 41 A 1 ATOM 331 O O . LEU A 0 41 . 11.231 9.266 -19.628 1.00 44.08 41 A 1 ATOM 332 C CG . LEU A 0 41 . 9.066 11.731 -22.509 1.00 44.08 41 A 1 ATOM 333 C CD1 . LEU A 0 41 . 8.594 11.098 -23.819 1.00 44.08 41 A 1 ATOM 334 C CD2 . LEU A 0 41 . 7.818 12.113 -21.704 1.00 44.08 41 A 1 ATOM 335 N N . GLU A 0 42 . 11.893 11.108 -18.508 1.00 51.19 42 A 1 ATOM 336 C CA . GLU A 0 42 . 11.921 10.733 -17.098 1.00 51.19 42 A 1 ATOM 337 C C . GLU A 0 42 . 10.552 10.224 -16.612 1.00 51.19 42 A 1 ATOM 338 C CB . GLU A 0 42 . 12.317 11.982 -16.274 1.00 51.19 42 A 1 ATOM 339 O O . GLU A 0 42 . 10.327 10.062 -15.423 1.00 51.19 42 A 1 ATOM 340 C CG . GLU A 0 42 . 13.813 12.134 -15.985 1.00 51.19 42 A 1 ATOM 341 C CD . GLU A 0 42 . 14.031 13.145 -14.844 1.00 51.19 42 A 1 ATOM 342 O OE1 . GLU A 0 42 . 14.860 12.838 -13.957 1.00 51.19 42 A 1 ATOM 343 O OE2 . GLU A 0 42 . 13.322 14.178 -14.821 1.00 51.19 42 A 1 ATOM 344 N N . SER A 0 43 . 9.612 9.934 -17.511 1.00 49.55 43 A 1 ATOM 345 C CA . SER A 0 43 . 8.390 9.185 -17.279 1.00 49.55 43 A 1 ATOM 346 C C . SER A 0 43 . 8.594 8.045 -16.283 1.00 49.55 43 A 1 ATOM 347 C CB . SER A 0 43 . 7.862 8.660 -18.620 1.00 49.55 43 A 1 ATOM 348 O O . SER A 0 43 . 7.792 7.937 -15.365 1.00 49.55 43 A 1 ATOM 349 O OG . SER A 0 43 . 8.790 7.811 -19.279 1.00 49.55 43 A 1 ATOM 350 N N . THR A 0 44 . 9.699 7.291 -16.363 1.00 56.94 44 A 1 ATOM 351 C CA . THR A 0 44 . 9.998 6.204 -15.422 1.00 56.94 44 A 1 ATOM 352 C C . THR A 0 44 . 10.108 6.669 -13.965 1.00 56.94 44 A 1 ATOM 353 C CB . THR A 0 44 . 11.295 5.474 -15.809 1.00 56.94 44 A 1 ATOM 354 O O . THR A 0 44 . 9.553 6.012 -13.085 1.00 56.94 44 A 1 ATOM 355 C CG2 . THR A 0 44 . 11.382 4.086 -15.175 1.00 56.94 44 A 1 ATOM 356 O OG1 . THR A 0 44 . 11.378 5.285 -17.203 1.00 56.94 44 A 1 ATOM 357 N N . SER A 0 45 . 10.789 7.788 -13.681 1.00 63.13 45 A 1 ATOM 358 C CA . SER A 0 45 . 10.958 8.270 -12.300 1.00 63.13 45 A 1 ATOM 359 C C . SER A 0 45 . 9.651 8.842 -11.752 1.00 63.13 45 A 1 ATOM 360 C CB . SER A 0 45 . 12.109 9.283 -12.187 1.00 63.13 45 A 1 ATOM 361 O O . SER A 0 45 . 9.278 8.535 -10.618 1.00 63.13 45 A 1 ATOM 362 O OG . SER A 0 45 . 11.883 10.422 -12.989 1.00 63.13 45 A 1 ATOM 363 N N . TRP A 0 46 . 8.906 9.588 -12.574 1.00 59.32 46 A 1 ATOM 364 C CA . TRP A 0 46 . 7.619 10.169 -12.189 1.00 59.32 46 A 1 ATOM 365 C C . TRP A 0 46 . 6.545 9.109 -11.944 1.00 59.32 46 A 1 ATOM 366 C CB . TRP A 0 46 . 7.159 11.171 -13.251 1.00 59.32 46 A 1 ATOM 367 O O . TRP A 0 46 . 5.844 9.188 -10.937 1.00 59.32 46 A 1 ATOM 368 C CG . TRP A 0 46 . 7.899 12.471 -13.227 1.00 59.32 46 A 1 ATOM 369 C CD1 . TRP A 0 46 . 9.054 12.739 -13.875 1.00 59.32 46 A 1 ATOM 370 C CD2 . TRP A 0 46 . 7.581 13.684 -12.479 1.00 59.32 46 A 1 ATOM 371 C CE2 . TRP A 0 46 . 8.593 14.656 -12.745 1.00 59.32 46 A 1 ATOM 372 C CE3 . TRP A 0 46 . 6.546 14.054 -11.590 1.00 59.32 46 A 1 ATOM 373 N NE1 . TRP A 0 46 . 9.473 14.022 -13.595 1.00 59.32 46 A 1 ATOM 374 C CH2 . TRP A 0 46 . 7.526 16.274 -11.296 1.00 59.32 46 A 1 ATOM 375 C CZ2 . TRP A 0 46 . 8.573 15.933 -12.170 1.00 59.32 46 A 1 ATOM 376 C CZ3 . TRP A 0 46 . 6.519 15.335 -11.005 1.00 59.32 46 A 1 ATOM 377 N N . THR A 0 47 . 6.420 8.096 -12.811 1.00 74.24 47 A 1 ATOM 378 C CA . THR A 0 47 . 5.424 7.027 -12.621 1.00 74.24 47 A 1 ATOM 379 C C . THR A 0 47 . 5.710 6.197 -11.379 1.00 74.24 47 A 1 ATOM 380 C CB . THR A 0 47 . 5.323 6.080 -13.827 1.00 74.24 47 A 1 ATOM 381 O O . THR A 0 47 . 4.776 5.843 -10.660 1.00 74.24 47 A 1 ATOM 382 C CG2 . THR A 0 47 . 4.688 6.774 -15.032 1.00 74.24 47 A 1 ATOM 383 O OG1 . THR A 0 47 . 6.575 5.568 -14.227 1.00 74.24 47 A 1 ATOM 384 N N . LEU A 0 48 . 6.988 5.923 -11.094 1.00 71.32 48 A 1 ATOM 385 C CA . LEU A 0 48 . 7.402 5.191 -9.899 1.00 71.32 48 A 1 ATOM 386 C C . LEU A 0 48 . 7.060 5.996 -8.636 1.00 71.32 48 A 1 ATOM 387 C CB . LEU A 0 48 . 8.894 4.844 -10.066 1.00 71.32 48 A 1 ATOM 388 O O . LEU A 0 48 . 6.448 5.465 -7.708 1.00 71.32 48 A 1 ATOM 389 C CG . LEU A 0 48 . 9.479 3.897 -9.001 1.00 71.32 48 A 1 ATOM 390 C CD1 . LEU A 0 48 . 10.688 3.164 -9.576 1.00 71.32 48 A 1 ATOM 391 C CD2 . LEU A 0 48 . 9.976 4.663 -7.777 1.00 71.32 48 A 1 ATOM 392 N N . TRP A 0 49 . 7.346 7.300 -8.634 1.00 75.60 49 A 1 ATOM 393 C CA . TRP A 0 49 . 6.968 8.201 -7.539 1.00 75.60 49 A 1 ATOM 394 C C . TRP A 0 49 . 5.454 8.267 -7.322 1.00 75.60 49 A 1 ATOM 395 C CB . TRP A 0 49 . 7.528 9.603 -7.814 1.00 75.60 49 A 1 ATOM 396 O O . TRP A 0 49 . 4.970 8.174 -6.190 1.00 75.60 49 A 1 ATOM 397 C CG . TRP A 0 49 . 8.553 10.028 -6.823 1.00 75.60 49 A 1 ATOM 398 C CD1 . TRP A 0 49 . 9.842 9.624 -6.798 1.00 75.60 49 A 1 ATOM 399 C CD2 . TRP A 0 49 . 8.381 10.920 -5.685 1.00 75.60 49 A 1 ATOM 400 C CE2 . TRP A 0 49 . 9.628 11.019 -5.003 1.00 75.60 49 A 1 ATOM 401 C CE3 . TRP A 0 49 . 7.293 11.656 -5.165 1.00 75.60 49 A 1 ATOM 402 N NE1 . TRP A 0 49 . 10.483 10.207 -5.721 1.00 75.60 49 A 1 ATOM 403 C CH2 . TRP A 0 49 . 8.694 12.543 -3.372 1.00 75.60 49 A 1 ATOM 404 C CZ2 . TRP A 0 49 . 9.793 11.815 -3.861 1.00 75.60 49 A 1 ATOM 405 C CZ3 . TRP A 0 49 . 7.449 12.461 -4.022 1.00 75.60 49 A 1 ATOM 406 N N . LEU A 0 50 . 4.689 8.390 -8.406 1.00 80.12 50 A 1 ATOM 407 C CA . LEU A 0 50 . 3.231 8.455 -8.349 1.00 80.12 50 A 1 ATOM 408 C C . LEU A 0 50 . 2.654 7.135 -7.808 1.00 80.12 50 A 1 ATOM 409 C CB . LEU A 0 50 . 2.712 8.857 -9.743 1.00 80.12 50 A 1 ATOM 410 O O . LEU A 0 50 . 1.802 7.155 -6.920 1.00 80.12 50 A 1 ATOM 411 C CG . LEU A 0 50 . 1.460 9.749 -9.716 1.00 80.12 50 A 1 ATOM 412 C CD1 . LEU A 0 50 . 1.310 10.451 -11.066 1.00 80.12 50 A 1 ATOM 413 C CD2 . LEU A 0 50 . 0.181 8.963 -9.439 1.00 80.12 50 A 1 ATOM 414 N N . GLY A 0 51 . 3.195 5.991 -8.235 1.00 81.72 51 A 1 ATOM 415 C CA . GLY A 0 51 . 2.847 4.679 -7.685 1.00 81.72 51 A 1 ATOM 416 C C . GLY A 0 51 . 3.099 4.584 -6.178 1.00 81.72 51 A 1 ATOM 417 O O . GLY A 0 51 . 2.210 4.178 -5.427 1.00 81.72 51 A 1 ATOM 418 N N . ILE A 0 52 . 4.266 5.037 -5.710 1.00 82.58 52 A 1 ATOM 419 C CA . ILE A 0 52 . 4.607 5.028 -4.280 1.00 82.58 52 A 1 ATOM 420 C C . ILE A 0 52 . 3.652 5.910 -3.471 1.00 82.58 52 A 1 ATOM 421 C CB . ILE A 0 52 . 6.085 5.424 -4.063 1.00 82.58 52 A 1 ATOM 422 O O . ILE A 0 52 . 3.153 5.479 -2.429 1.00 82.58 52 A 1 ATOM 423 C CG1 . ILE A 0 52 . 7.009 4.330 -4.640 1.00 82.58 52 A 1 ATOM 424 C CG2 . ILE A 0 52 . 6.394 5.628 -2.565 1.00 82.58 52 A 1 ATOM 425 C CD1 . ILE A 0 52 . 8.481 4.743 -4.690 1.00 82.58 52 A 1 ATOM 426 N N . THR A 0 53 . 3.362 7.126 -3.940 1.00 84.81 53 A 1 ATOM 427 C CA . THR A 0 53 . 2.490 8.058 -3.202 1.00 84.81 53 A 1 ATOM 428 C C . THR A 0 53 . 1.062 7.533 -3.056 1.00 84.81 53 A 1 ATOM 429 C CB . THR A 0 53 . 2.457 9.462 -3.821 1.00 84.81 53 A 1 ATOM 430 O O . THR A 0 53 . 0.501 7.602 -1.962 1.00 84.81 53 A 1 ATOM 431 C CG2 . THR A 0 53 . 3.791 10.198 -3.707 1.00 84.81 53 A 1 ATOM 432 O OG1 . THR A 0 53 . 2.102 9.411 -5.177 1.00 84.81 53 A 1 ATOM 433 N N . VAL A 0 54 . 0.485 6.946 -4.110 1.00 87.32 54 A 1 ATOM 434 C CA . VAL A 0 54 . -0.867 6.361 -4.066 1.00 87.32 54 A 1 ATOM 435 C C . VAL A 0 54 . -0.928 5.170 -3.109 1.00 87.32 54 A 1 ATOM 436 C CB . VAL A 0 54 . -1.328 5.960 -5.481 1.00 87.32 54 A 1 ATOM 437 O O . VAL A 0 54 . -1.887 5.041 -2.340 1.00 87.32 54 A 1 ATOM 438 C CG1 . VAL A 0 54 . -2.660 5.194 -5.475 1.00 87.32 54 A 1 ATOM 439 C CG2 . VAL A 0 54 . -1.531 7.210 -6.346 1.00 87.32 54 A 1 ATOM 440 N N . VAL A 0 55 . 0.093 4.311 -3.097 1.00 85.82 55 A 1 ATOM 441 C CA . VAL A 0 55 . 0.112 3.163 -2.181 1.00 85.82 55 A 1 ATOM 442 C C . VAL A 0 55 . 0.292 3.607 -0.727 1.00 85.82 55 A 1 ATOM 443 C CB . VAL A 0 55 . 1.159 2.122 -2.585 1.00 85.82 55 A 1 ATOM 444 O O . VAL A 0 55 . -0.418 3.121 0.151 1.00 85.82 55 A 1 ATOM 445 C CG1 . VAL A 0 55 . 1.143 0.972 -1.566 1.00 85.82 55 A 1 ATOM 446 C CG2 . VAL A 0 55 . 0.846 1.521 -3.962 1.00 85.82 55 A 1 ATOM 447 N N . LEU A 0 56 . 1.165 4.580 -0.452 1.00 85.81 56 A 1 ATOM 448 C CA . LEU A 0 56 . 1.301 5.135 0.900 1.00 85.81 56 A 1 ATOM 449 C C . LEU A 0 56 . 0.003 5.804 1.373 1.00 85.81 56 A 1 ATOM 450 C CB . LEU A 0 56 . 2.471 6.130 0.942 1.00 85.81 56 A 1 ATOM 451 O O . LEU A 0 56 . -0.412 5.604 2.515 1.00 85.81 56 A 1 ATOM 452 C CG . LEU A 0 56 . 3.864 5.483 0.868 1.00 85.81 56 A 1 ATOM 453 C CD1 . LEU A 0 56 . 4.922 6.585 0.806 1.00 85.81 56 A 1 ATOM 454 C CD2 . LEU A 0 56 . 4.165 4.604 2.086 1.00 85.81 56 A 1 ATOM 455 N N . LEU A 0 57 . -0.672 6.548 0.494 1.00 89.35 57 A 1 ATOM 456 C CA . LEU A 0 57 . -1.947 7.191 0.806 1.00 89.35 57 A 1 ATOM 457 C C . LEU A 0 57 . -3.029 6.159 1.149 1.00 89.35 57 A 1 ATOM 458 C CB . LEU A 0 57 . -2.357 8.067 -0.390 1.00 89.35 57 A 1 ATOM 459 O O . LEU A 0 57 . -3.698 6.276 2.177 1.00 89.35 57 A 1 ATOM 460 C CG . LEU A 0 57 . -3.699 8.794 -0.202 1.00 89.35 57 A 1 ATOM 461 C CD1 . LEU A 0 57 . -3.642 9.809 0.943 1.00 89.35 57 A 1 ATOM 462 C CD2 . LEU A 0 57 . -4.077 9.524 -1.489 1.00 89.35 57 A 1 ATOM 463 N N . THR A 0 58 . -3.191 5.131 0.315 1.00 88.87 58 A 1 ATOM 464 C CA . THR A 0 58 . -4.179 4.064 0.549 1.00 88.87 58 A 1 ATOM 465 C C . THR A 0 58 . -3.852 3.248 1.801 1.00 88.87 58 A 1 ATOM 466 C CB . THR A 0 58 . -4.330 3.139 -0.666 1.00 88.87 58 A 1 ATOM 467 O O . THR A 0 58 . -4.765 2.893 2.552 1.00 88.87 58 A 1 ATOM 468 C CG2 . THR A 0 58 . -4.982 3.843 -1.855 1.00 88.87 58 A 1 ATOM 469 O OG1 . THR A 0 58 . -3.088 2.668 -1.106 1.00 88.87 58 A 1 ATOM 470 N N . MET A 0 59 . -2.570 3.029 2.106 1.00 87.47 59 A 1 ATOM 471 C CA . MET A 0 59 . -2.138 2.424 3.367 1.00 87.47 59 A 1 ATOM 472 C C . MET A 0 59 . -2.587 3.278 4.562 1.00 87.47 59 A 1 ATOM 473 C CB . MET A 0 59 . -0.616 2.211 3.345 1.00 87.47 59 A 1 ATOM 474 O O . MET A 0 59 . -3.274 2.785 5.449 1.00 87.47 59 A 1 ATOM 475 C CG . MET A 0 59 . -0.115 1.387 4.537 1.00 87.47 59 A 1 ATOM 476 S SD . MET A 0 59 . -0.632 -0.356 4.569 1.00 87.47 59 A 1 ATOM 477 C CE . MET A 0 59 . 0.390 -1.019 3.226 1.00 87.47 59 A 1 ATOM 478 N N . ILE A 0 60 . -2.304 4.581 4.576 1.00 89.37 60 A 1 ATOM 479 C CA . ILE A 0 60 . -2.706 5.452 5.694 1.00 89.37 60 A 1 ATOM 480 C C . ILE A 0 60 . -4.233 5.465 5.874 1.00 89.37 60 A 1 ATOM 481 C CB . ILE A 0 60 . -2.129 6.869 5.492 1.00 89.37 60 A 1 ATOM 482 O O . ILE A 0 60 . -4.724 5.325 6.996 1.00 89.37 60 A 1 ATOM 483 C CG1 . ILE A 0 60 . -0.587 6.837 5.603 1.00 89.37 60 A 1 ATOM 484 C CG2 . ILE A 0 60 . -2.706 7.855 6.527 1.00 89.37 60 A 1 ATOM 485 C CD1 . ILE A 0 60 . 0.087 8.091 5.032 1.00 89.37 60 A 1 ATOM 486 N N . ILE A 0 61 . -4.994 5.574 4.780 1.00 91.61 61 A 1 ATOM 487 C CA . ILE A 0 61 . -6.465 5.587 4.821 1.00 91.61 61 A 1 ATOM 488 C C . ILE A 0 61 . -7.013 4.276 5.397 1.00 91.61 61 A 1 ATOM 489 C CB . ILE A 0 61 . -7.037 5.871 3.413 1.00 91.61 61 A 1 ATOM 490 O O . ILE A 0 61 . -7.882 4.302 6.271 1.00 91.61 61 A 1 ATOM 491 C CG1 . ILE A 0 61 . -6.712 7.323 2.994 1.00 91.61 61 A 1 ATOM 492 C CG2 . ILE A 0 61 . -8.563 5.644 3.366 1.00 91.61 61 A 1 ATOM 493 C CD1 . ILE A 0 61 . -6.970 7.607 1.508 1.00 91.61 61 A 1 ATOM 494 N N . THR A 0 62 . -6.501 3.131 4.938 1.00 89.80 62 A 1 ATOM 495 C CA . THR A 0 62 . -6.950 1.821 5.434 1.00 89.80 62 A 1 ATOM 496 C C . THR A 0 62 . -6.617 1.635 6.913 1.00 89.80 62 A 1 ATOM 497 C CB . THR A 0 62 . -6.393 0.652 4.605 1.00 89.80 62 A 1 ATOM 498 O O . THR A 0 62 . -7.463 1.149 7.663 1.00 89.80 62 A 1 ATOM 499 C CG2 . THR A 0 62 . -7.008 0.594 3.207 1.00 89.80 62 A 1 ATOM 500 O OG1 . THR A 0 62 . -5.002 0.734 4.450 1.00 89.80 62 A 1 ATOM 501 N N . TRP A 0 63 . -5.450 2.098 7.374 1.00 88.60 63 A 1 ATOM 502 C CA . TRP A 0 63 . -5.074 2.094 8.794 1.00 88.60 63 A 1 ATOM 503 C C . TRP A 0 63 . -6.005 2.948 9.653 1.00 88.60 63 A 1 ATOM 504 C CB . TRP A 0 63 . -3.605 2.498 8.940 1.00 88.60 63 A 1 ATOM 505 O O . TRP A 0 63 . -6.504 2.465 10.670 1.00 88.60 63 A 1 ATOM 506 C CG . TRP A 0 63 . -2.642 1.358 8.793 1.00 88.60 63 A 1 ATOM 507 C CD1 . TRP A 0 63 . -2.222 0.794 7.637 1.00 88.60 63 A 1 ATOM 508 C CD2 . TRP A 0 63 . -2.022 0.565 9.848 1.00 88.60 63 A 1 ATOM 509 C CE2 . TRP A 0 63 . -1.203 -0.438 9.244 1.00 88.60 63 A 1 ATOM 510 C CE3 . TRP A 0 63 . -2.091 0.576 11.257 1.00 88.60 63 A 1 ATOM 511 N NE1 . TRP A 0 63 . -1.348 -0.237 7.894 1.00 88.60 63 A 1 ATOM 512 C CH2 . TRP A 0 63 . -0.561 -1.327 11.394 1.00 88.60 63 A 1 ATOM 513 C CZ2 . TRP A 0 63 . -0.484 -1.376 9.994 1.00 88.60 63 A 1 ATOM 514 C CZ3 . TRP A 0 63 . -1.363 -0.355 12.022 1.00 88.60 63 A 1 ATOM 515 N N . ILE A 0 64 . -6.310 4.176 9.234 1.00 92.22 64 A 1 ATOM 516 C CA . ILE A 0 64 . -7.246 5.048 9.961 1.00 92.22 64 A 1 ATOM 517 C C . ILE A 0 64 . -8.633 4.400 10.050 1.00 92.22 64 A 1 ATOM 518 C CB . ILE A 0 64 . -7.305 6.438 9.292 1.00 92.22 64 A 1 ATOM 519 O O . ILE A 0 64 . -9.259 4.417 11.116 1.00 92.22 64 A 1 ATOM 520 C CG1 . ILE A 0 64 . -5.957 7.171 9.479 1.00 92.22 64 A 1 ATOM 521 C CG2 . ILE A 0 64 . -8.452 7.290 9.875 1.00 92.22 64 A 1 ATOM 522 C CD1 . ILE A 0 64 . -5.816 8.417 8.596 1.00 92.22 64 A 1 ATOM 523 N N . LEU A 0 65 . -9.107 3.795 8.958 1.00 91.09 65 A 1 ATOM 524 C CA . LEU A 0 65 . -10.390 3.096 8.938 1.00 91.09 65 A 1 ATOM 525 C C . LEU A 0 65 . -10.397 1.903 9.906 1.00 91.09 65 A 1 ATOM 526 C CB . LEU A 0 65 . -10.699 2.670 7.493 1.00 91.09 65 A 1 ATOM 527 O O . LEU A 0 65 . -11.341 1.751 10.682 1.00 91.09 65 A 1 ATOM 528 C CG . LEU A 0 65 . -12.097 2.052 7.315 1.00 91.09 65 A 1 ATOM 529 C CD1 . LEU A 0 65 . -13.212 3.074 7.555 1.00 91.09 65 A 1 ATOM 530 C CD2 . LEU A 0 65 . -12.239 1.511 5.893 1.00 91.09 65 A 1 ATOM 531 N N . HIS A 0 66 . -9.332 1.099 9.921 1.00 89.65 66 A 1 ATOM 532 C CA . HIS A 0 66 . -9.223 -0.067 10.804 1.00 89.65 66 A 1 ATOM 533 C C . HIS A 0 66 . -9.192 0.320 12.287 1.00 89.65 66 A 1 ATOM 534 C CB . HIS A 0 66 . -7.987 -0.884 10.415 1.00 89.65 66 A 1 ATOM 535 O O . HIS A 0 66 . -9.896 -0.272 13.109 1.00 89.65 66 A 1 ATOM 536 C CG . HIS A 0 66 . -8.041 -2.281 10.970 1.00 89.65 66 A 1 ATOM 537 C CD2 . HIS A 0 66 . -7.118 -2.878 11.779 1.00 89.65 66 A 1 ATOM 538 N ND1 . HIS A 0 66 . -9.059 -3.191 10.689 1.00 89.65 66 A 1 ATOM 539 C CE1 . HIS A 0 66 . -8.714 -4.325 11.305 1.00 89.65 66 A 1 ATOM 540 N NE2 . HIS A 0 66 . -7.565 -4.166 11.982 1.00 89.65 66 A 1 ATOM 541 N N . ILE A 0 67 . -8.451 1.376 12.634 1.00 89.24 67 A 1 ATOM 542 C CA . ILE A 0 67 . -8.433 1.930 13.996 1.00 89.24 67 A 1 ATOM 543 C C . ILE A 0 67 . -9.800 2.516 14.380 1.00 89.24 67 A 1 ATOM 544 C CB . ILE A 0 67 . -7.294 2.965 14.132 1.00 89.24 67 A 1 ATOM 545 O O . ILE A 0 67 . -10.251 2.354 15.515 1.00 89.24 67 A 1 ATOM 546 C CG1 . ILE A 0 67 . -5.894 2.331 13.944 1.00 89.24 67 A 1 ATOM 547 C CG2 . ILE A 0 67 . -7.351 3.697 15.486 1.00 89.24 67 A 1 ATOM 548 C CD1 . ILE A 0 67 . -5.528 1.196 14.911 1.00 89.24 67 A 1 ATOM 549 N N . SER A 0 68 . -10.510 3.136 13.438 1.00 90.65 68 A 1 ATOM 550 C CA . SER A 0 68 . -11.866 3.643 13.683 1.00 90.65 68 A 1 ATOM 551 C C . SER A 0 68 . -12.847 2.508 14.001 1.00 90.65 68 A 1 ATOM 552 C CB . SER A 0 68 . -12.363 4.451 12.482 1.00 90.65 68 A 1 ATOM 553 O O . SER A 0 68 . -13.664 2.633 14.917 1.00 90.65 68 A 1 ATOM 554 O OG . SER A 0 68 . -11.507 5.549 12.242 1.00 90.65 68 A 1 ATOM 555 N N . ILE A 0 69 . -12.736 1.373 13.300 1.00 87.79 69 A 1 ATOM 556 C CA . ILE A 0 69 . -13.537 0.168 13.563 1.00 87.79 69 A 1 ATOM 557 C C . ILE A 0 69 . -13.194 -0.419 14.938 1.00 87.79 69 A 1 ATOM 558 C CB . ILE A 0 69 . -13.357 -0.864 12.426 1.00 87.79 69 A 1 ATOM 559 O O . ILE A 0 69 . -14.113 -0.708 15.707 1.00 87.79 69 A 1 ATOM 560 C CG1 . ILE A 0 69 . -13.944 -0.317 11.102 1.00 87.79 69 A 1 ATOM 561 C CG2 . ILE A 0 69 . -14.040 -2.201 12.779 1.00 87.79 69 A 1 ATOM 562 C CD1 . ILE A 0 69 . -13.448 -1.067 9.859 1.00 87.79 69 A 1 ATOM 563 N N . MET A 0 70 . -11.904 -0.520 15.284 1.00 87.31 70 A 1 ATOM 564 C CA . MET A 0 70 . -11.443 -0.923 16.623 1.00 87.31 70 A 1 ATOM 565 C C . MET A 0 70 . -12.127 -0.111 17.726 1.00 87.31 70 A 1 ATOM 566 C CB . MET A 0 70 . -9.923 -0.708 16.763 1.00 87.31 70 A 1 ATOM 567 O O . MET A 0 70 . -12.729 -0.672 18.642 1.00 87.31 70 A 1 ATOM 568 C CG . MET A 0 70 . -9.047 -1.887 16.381 1.00 87.31 70 A 1 ATOM 569 S SD . MET A 0 70 . -9.288 -3.292 17.509 1.00 87.31 70 A 1 ATOM 570 C CE . MET A 0 70 . -7.653 -4.057 17.423 1.00 87.31 70 A 1 ATOM 571 N N . ILE A 0 71 . -12.067 1.219 17.625 1.00 87.65 71 A 1 ATOM 572 C CA . ILE A 0 71 . -12.650 2.123 18.623 1.00 87.65 71 A 1 ATOM 573 C C . ILE A 0 71 . -14.173 1.946 18.687 1.00 87.65 71 A 1 ATOM 574 C CB . ILE A 0 71 . -12.242 3.580 18.310 1.00 87.65 71 A 1 ATOM 575 O O . ILE A 0 71 . -14.747 1.923 19.778 1.00 87.65 71 A 1 ATOM 576 C CG1 . ILE A 0 71 . -10.715 3.764 18.487 1.00 87.65 71 A 1 ATOM 577 C CG2 . ILE A 0 71 . -12.993 4.573 19.219 1.00 87.65 71 A 1 ATOM 578 C CD1 . ILE A 0 71 . -10.176 5.047 17.841 1.00 87.65 71 A 1 ATOM 579 N N . SER A 0 72 . -14.832 1.787 17.535 1.00 86.27 72 A 1 ATOM 580 C CA . SER A 0 72 . -16.281 1.577 17.456 1.00 86.27 72 A 1 ATOM 581 C C . SER A 0 72 . -16.722 0.289 18.161 1.00 86.27 72 A 1 ATOM 582 C CB . SER A 0 72 . -16.716 1.558 15.990 1.00 86.27 72 A 1 ATOM 583 O O . SER A 0 72 . -17.647 0.322 18.979 1.00 86.27 72 A 1 ATOM 584 O OG . SER A 0 72 . -18.127 1.594 15.907 1.00 86.27 72 A 1 ATOM 585 N N . VAL A 0 73 . -16.024 -0.825 17.915 1.00 83.89 73 A 1 ATOM 586 C CA . VAL A 0 73 . -16.298 -2.116 18.569 1.00 83.89 73 A 1 ATOM 587 C C . VAL A 0 73 . -16.020 -2.041 20.069 1.00 83.89 73 A 1 ATOM 588 C CB . VAL A 0 73 . -15.507 -3.251 17.889 1.00 83.89 73 A 1 ATOM 589 O O . VAL A 0 73 . -16.839 -2.504 20.858 1.00 83.89 73 A 1 ATOM 590 C CG1 . VAL A 0 73 . -15.574 -4.576 18.661 1.00 83.89 73 A 1 ATOM 591 C CG2 . VAL A 0 73 . -16.083 -3.498 16.485 1.00 83.89 73 A 1 ATOM 592 N N . CYS A 0 74 . -14.931 -1.389 20.487 1.00 81.13 74 A 1 ATOM 593 C CA . CYS A 0 74 . -14.620 -1.200 21.907 1.00 81.13 74 A 1 ATOM 594 C C . CYS A 0 74 . -15.664 -0.345 22.642 1.00 81.13 74 A 1 ATOM 595 C CB . CYS A 0 74 . -13.227 -0.570 22.027 1.00 81.13 74 A 1 ATOM 596 O O . CYS A 0 74 . -15.962 -0.609 23.808 1.00 81.13 74 A 1 ATOM 597 S SG . CYS A 0 74 . -11.967 -1.815 21.629 1.00 81.13 74 A 1 ATOM 598 N N . ARG A 0 75 . -16.230 0.673 21.982 1.00 82.90 75 A 1 ATOM 599 C CA . ARG A 0 75 . -17.254 1.545 22.578 1.00 82.90 75 A 1 ATOM 600 C C . ARG A 0 75 . -18.623 0.869 22.646 1.00 82.90 75 A 1 ATOM 601 C CB . ARG A 0 75 . -17.299 2.867 21.798 1.00 82.90 75 A 1 ATOM 602 O O . ARG A 0 75 . -19.385 1.125 23.578 1.00 82.90 75 A 1 ATOM 603 C CG . ARG A 0 75 . -18.191 3.914 22.489 1.00 82.90 75 A 1 ATOM 604 C CD . ARG A 0 75 . -18.135 5.270 21.778 1.00 82.90 75 A 1 ATOM 605 N NE . ARG A 0 75 . -18.751 5.215 20.437 1.00 82.90 75 A 1 ATOM 606 N NH1 . ARG A 0 75 . -18.028 7.260 19.685 1.00 82.90 75 A 1 ATOM 607 N NH2 . ARG A 0 75 . -19.277 5.976 18.357 1.00 82.90 75 A 1 ATOM 608 C CZ . ARG A 0 75 . -18.683 6.147 19.504 1.00 82.90 75 A 1 ATOM 609 N N . ASN A 0 76 . -18.965 0.038 21.665 1.00 76.36 76 A 1 ATOM 610 C CA . ASN A 0 76 . -20.286 -0.570 21.597 1.00 76.36 76 A 1 ATOM 611 C C . ASN A 0 76 . -20.377 -1.825 22.481 1.00 76.36 76 A 1 ATOM 612 C CB . ASN A 0 76 . -20.658 -0.834 20.130 1.00 76.36 76 A 1 ATOM 613 O O . ASN A 0 76 . -19.950 -2.909 22.092 1.00 76.36 76 A 1 ATOM 614 C CG . ASN A 0 76 . -22.123 -1.204 19.990 1.00 76.36 76 A 1 ATOM 615 N ND2 . ASN A 0 76 . -22.536 -1.655 18.831 1.00 76.36 76 A 1 ATOM 616 O OD1 . ASN A 0 76 . -22.914 -1.094 20.913 1.00 76.36 76 A 1 ATOM 617 N N . MET A 0 77 . -21.009 -1.700 23.654 1.00 66.68 77 A 1 ATOM 618 C CA . MET A 0 77 . -21.215 -2.811 24.600 1.00 66.68 77 A 1 ATOM 619 C C . MET A 0 77 . -21.926 -4.027 23.981 1.00 66.68 77 A 1 ATOM 620 C CB . MET A 0 77 . -22.017 -2.308 25.814 1.00 66.68 77 A 1 ATOM 621 O O . MET A 0 77 . -21.709 -5.147 24.438 1.00 66.68 77 A 1 ATOM 622 C CG . MET A 0 77 . -21.198 -1.371 26.716 1.00 66.68 77 A 1 ATOM 623 S SD . MET A 0 77 . -20.722 -2.084 28.319 1.00 66.68 77 A 1 ATOM 624 C CE . MET A 0 77 . -22.148 -1.582 29.326 1.00 66.68 77 A 1 ATOM 625 N N . ILE A 0 78 . -22.737 -3.821 22.938 1.00 66.40 78 A 1 ATOM 626 C CA . ILE A 0 78 . -23.482 -4.882 22.241 1.00 66.40 78 A 1 ATOM 627 C C . ILE A 0 78 . -22.549 -5.747 21.374 1.00 66.40 78 A 1 ATOM 628 C CB . ILE A 0 78 . -24.630 -4.238 21.422 1.00 66.40 78 A 1 ATOM 629 O O . ILE A 0 78 . -22.797 -6.936 21.199 1.00 66.40 78 A 1 ATOM 630 C CG1 . ILE A 0 78 . -25.634 -3.526 22.365 1.00 66.40 78 A 1 ATOM 631 C CG2 . ILE A 0 78 . -25.370 -5.275 20.557 1.00 66.40 78 A 1 ATOM 632 C CD1 . ILE A 0 78 . -26.576 -2.551 21.648 1.00 66.40 78 A 1 ATOM 633 N N . MET A 0 79 . -21.435 -5.193 20.881 1.00 62.97 79 A 1 ATOM 634 C CA . MET A 0 79 . -20.473 -5.900 20.022 1.00 62.97 79 A 1 ATOM 635 C C . MET A 0 79 . -19.319 -6.549 20.795 1.00 62.97 79 A 1 ATOM 636 C CB . MET A 0 79 . -20.004 -5.005 18.865 1.00 62.97 79 A 1 ATOM 637 O O . MET A 0 79 . -18.277 -6.856 20.226 1.00 62.97 79 A 1 ATOM 638 C CG . MET A 0 79 . -21.161 -4.801 17.886 1.00 62.97 79 A 1 ATOM 639 S SD . MET A 0 79 . -20.659 -4.285 16.231 1.00 62.97 79 A 1 ATOM 640 C CE . MET A 0 79 . -22.267 -4.375 15.404 1.00 62.97 79 A 1 ATOM 641 N N . LYS A 0 80 . -19.511 -6.845 22.084 1.00 65.14 80 A 1 ATOM 642 C CA . LYS A 0 80 . -18.520 -7.558 22.911 1.00 65.14 80 A 1 ATOM 643 C C . LYS A 0 80 . -18.334 -9.037 22.551 1.00 65.14 80 A 1 ATOM 644 C CB . LYS A 0 80 . -18.870 -7.387 24.395 1.00 65.14 80 A 1 ATOM 645 O O . LYS A 0 80 . -17.568 -9.728 23.219 1.00 65.14 80 A 1 ATOM 646 C CG . LYS A 0 80 . -18.489 -5.990 24.895 1.00 65.14 80 A 1 ATOM 647 C CD . LYS A 0 80 . -18.837 -5.866 26.380 1.00 65.14 80 A 1 ATOM 648 C CE . LYS A 0 80 . -18.329 -4.528 26.917 1.00 65.14 80 A 1 ATOM 649 N NZ . LYS A 0 80 . -18.606 -4.393 28.367 1.00 65.14 80 A 1 ATOM 650 N N . HIS A 0 81 . -19.015 -9.547 21.523 1.00 73.32 81 A 1 ATOM 651 C CA . HIS A 0 81 . -18.798 -10.919 21.078 1.00 73.32 81 A 1 ATOM 652 C C . HIS A 0 81 . -17.347 -11.094 20.606 1.00 73.32 81 A 1 ATOM 653 C CB . HIS A 0 81 . -19.817 -11.317 20.003 1.00 73.32 81 A 1 ATOM 654 O O . HIS A 0 81 . -16.843 -10.302 19.807 1.00 73.32 81 A 1 ATOM 655 C CG . HIS A 0 81 . -19.901 -12.814 19.852 1.00 73.32 81 A 1 ATOM 656 C CD2 . HIS A 0 81 . -20.686 -13.660 20.589 1.00 73.32 81 A 1 ATOM 657 N ND1 . HIS A 0 81 . -19.159 -13.604 19.007 1.00 73.32 81 A 1 ATOM 658 C CE1 . HIS A 0 81 . -19.478 -14.886 19.232 1.00 73.32 81 A 1 ATOM 659 N NE2 . HIS A 0 81 . -20.406 -14.969 20.191 1.00 73.32 81 A 1 ATOM 660 N N . THR A 0 82 . -16.681 -12.149 21.078 1.00 77.19 82 A 1 ATOM 661 C CA . THR A 0 82 . -15.266 -12.456 20.791 1.00 77.19 82 A 1 ATOM 662 C C . THR A 0 82 . -14.951 -12.478 19.292 1.00 77.19 82 A 1 ATOM 663 C CB . THR A 0 82 . -14.888 -13.813 21.402 1.00 77.19 82 A 1 ATOM 664 O O . THR A 0 82 . -13.852 -12.107 18.884 1.00 77.19 82 A 1 ATOM 665 C CG2 . THR A 0 82 . -14.836 -13.757 22.929 1.00 77.19 82 A 1 ATOM 666 O OG1 . THR A 0 82 . -15.860 -14.771 21.050 1.00 77.19 82 A 1 ATOM 667 N N . THR A 0 83 . -15.934 -12.823 18.456 1.00 84.04 83 A 1 ATOM 668 C CA . THR A 0 83 . -15.836 -12.779 16.988 1.00 84.04 83 A 1 ATOM 669 C C . THR A 0 83 . -15.458 -11.404 16.440 1.00 84.04 83 A 1 ATOM 670 C CB . THR A 0 83 . -17.159 -13.203 16.340 1.00 84.04 83 A 1 ATOM 671 O O . THR A 0 83 . -14.680 -11.346 15.494 1.00 84.04 83 A 1 ATOM 672 C CG2 . THR A 0 83 . -17.086 -13.398 14.830 1.00 84.04 83 A 1 ATOM 673 O OG1 . THR A 0 83 . -17.555 -14.439 16.871 1.00 84.04 83 A 1 ATOM 674 N N . TYR A 0 84 . -15.946 -10.296 17.009 1.00 83.55 84 A 1 ATOM 675 C CA . TYR A 0 84 . -15.586 -8.965 16.505 1.00 83.55 84 A 1 ATOM 676 C C . TYR A 0 84 . -14.107 -8.663 16.744 1.00 83.55 84 A 1 ATOM 677 C CB . TYR A 0 84 . -16.477 -7.888 17.128 1.00 83.55 84 A 1 ATOM 678 O O . TYR A 0 84 . -13.419 -8.208 15.835 1.00 83.55 84 A 1 ATOM 679 C CG . TYR A 0 84 . -17.925 -7.970 16.693 1.00 83.55 84 A 1 ATOM 680 C CD1 . TYR A 0 84 . -18.279 -7.620 15.376 1.00 83.55 84 A 1 ATOM 681 C CD2 . TYR A 0 84 . -18.915 -8.386 17.601 1.00 83.55 84 A 1 ATOM 682 C CE1 . TYR A 0 84 . -19.625 -7.673 14.970 1.00 83.55 84 A 1 ATOM 683 C CE2 . TYR A 0 84 . -20.265 -8.421 17.207 1.00 83.55 84 A 1 ATOM 684 O OH . TYR A 0 84 . -21.925 -8.099 15.515 1.00 83.55 84 A 1 ATOM 685 C CZ . TYR A 0 84 . -20.621 -8.063 15.891 1.00 83.55 84 A 1 ATOM 686 N N . TYR A 0 85 . -13.585 -9.013 17.922 1.00 84.25 85 A 1 ATOM 687 C CA . TYR A 0 85 . -12.153 -8.917 18.204 1.00 84.25 85 A 1 ATOM 688 C C . TYR A 0 85 . -11.323 -9.815 17.278 1.00 84.25 85 A 1 ATOM 689 C CB . TYR A 0 85 . -11.892 -9.261 19.673 1.00 84.25 85 A 1 ATOM 690 O O . TYR A 0 85 . -10.263 -9.396 16.817 1.00 84.25 85 A 1 ATOM 691 C CG . TYR A 0 85 . -12.485 -8.261 20.643 1.00 84.25 85 A 1 ATOM 692 C CD1 . TYR A 0 85 . -11.888 -6.992 20.775 1.00 84.25 85 A 1 ATOM 693 C CD2 . TYR A 0 85 . -13.625 -8.586 21.404 1.00 84.25 85 A 1 ATOM 694 C CE1 . TYR A 0 85 . -12.421 -6.050 21.674 1.00 84.25 85 A 1 ATOM 695 C CE2 . TYR A 0 85 . -14.154 -7.651 22.314 1.00 84.25 85 A 1 ATOM 696 O OH . TYR A 0 85 . -14.059 -5.479 23.329 1.00 84.25 85 A 1 ATOM 697 C CZ . TYR A 0 85 . -13.552 -6.383 22.451 1.00 84.25 85 A 1 ATOM 698 N N . TYR A 0 86 . -11.823 -11.011 16.948 1.00 87.99 86 A 1 ATOM 699 C CA . TYR A 0 86 . -11.172 -11.901 15.985 1.00 87.99 86 A 1 ATOM 700 C C . TYR A 0 86 . -11.110 -11.290 14.578 1.00 87.99 86 A 1 ATOM 701 C CB . TYR A 0 86 . -11.877 -13.261 15.968 1.00 87.99 86 A 1 ATOM 702 O O . TYR A 0 86 . -10.036 -11.258 13.981 1.00 87.99 86 A 1 ATOM 703 C CG . TYR A 0 86 . -11.215 -14.249 15.032 1.00 87.99 86 A 1 ATOM 704 C CD1 . TYR A 0 86 . -11.715 -14.439 13.728 1.00 87.99 86 A 1 ATOM 705 C CD2 . TYR A 0 86 . -10.066 -14.943 15.456 1.00 87.99 86 A 1 ATOM 706 C CE1 . TYR A 0 86 . -11.067 -15.330 12.851 1.00 87.99 86 A 1 ATOM 707 C CE2 . TYR A 0 86 . -9.417 -15.835 14.581 1.00 87.99 86 A 1 ATOM 708 O OH . TYR A 0 86 . -9.301 -16.887 12.425 1.00 87.99 86 A 1 ATOM 709 C CZ . TYR A 0 86 . -9.919 -16.029 13.276 1.00 87.99 86 A 1 ATOM 710 N N . ILE A 0 87 . -12.224 -10.743 14.073 1.00 87.21 87 A 1 ATOM 711 C CA . ILE A 0 87 . -12.285 -10.068 12.763 1.00 87.21 87 A 1 ATOM 712 C C . ILE A 0 87 . -11.299 -8.896 12.712 1.00 87.21 87 A 1 ATOM 713 C CB . ILE A 0 87 . -13.724 -9.597 12.452 1.00 87.21 87 A 1 ATOM 714 O O . ILE A 0 87 . -10.604 -8.692 11.715 1.00 87.21 87 A 1 ATOM 715 C CG1 . ILE A 0 87 . -14.647 -10.815 12.220 1.00 87.21 87 A 1 ATOM 716 C CG2 . ILE A 0 87 . -13.758 -8.687 11.206 1.00 87.21 87 A 1 ATOM 717 C CD1 . ILE A 0 87 . -16.140 -10.468 12.272 1.00 87.21 87 A 1 ATOM 718 N N . ILE A 0 88 . -11.196 -8.130 13.795 1.00 87.37 88 A 1 ATOM 719 C CA . ILE A 0 88 . -10.275 -7.002 13.816 1.00 87.37 88 A 1 ATOM 720 C C . ILE A 0 88 . -8.811 -7.463 13.895 1.00 87.37 88 A 1 ATOM 721 C CB . ILE A 0 88 . -10.641 -6.031 14.942 1.00 87.37 88 A 1 ATOM 722 O O . ILE A 0 88 . -7.943 -6.884 13.235 1.00 87.37 88 A 1 ATOM 723 C CG1 . ILE A 0 88 . -12.071 -5.455 14.843 1.00 87.37 88 A 1 ATOM 724 C CG2 . ILE A 0 88 . -9.683 -4.861 14.771 1.00 87.37 88 A 1 ATOM 725 C CD1 . ILE A 0 88 . -12.548 -4.874 16.180 1.00 87.37 88 A 1 ATOM 726 N N . SER A 0 89 . -8.529 -8.524 14.653 1.00 89.66 89 A 1 ATOM 727 C CA . SER A 0 89 . -7.190 -9.111 14.748 1.00 89.66 89 A 1 ATOM 728 C C . SER A 0 89 . -6.722 -9.686 13.408 1.00 89.66 89 A 1 ATOM 729 C CB . SER A 0 89 . -7.171 -10.183 15.839 1.00 89.66 89 A 1 ATOM 730 O O . SER A 0 89 . -5.615 -9.371 12.974 1.00 89.66 89 A 1 ATOM 731 O OG . SER A 0 89 . -5.870 -10.712 15.994 1.00 89.66 89 A 1 ATOM 732 N N . ILE A 0 90 . -7.566 -10.444 12.697 1.00 90.97 90 A 1 ATOM 733 C CA . ILE A 0 90 . -7.208 -10.968 11.370 1.00 90.97 90 A 1 ATOM 734 C C . ILE A 0 90 . -7.024 -9.837 10.352 1.00 90.97 90 A 1 ATOM 735 C CB . ILE A 0 90 . -8.200 -12.058 10.907 1.00 90.97 90 A 1 ATOM 736 O O . ILE A 0 90 . -6.066 -9.866 9.581 1.00 90.97 90 A 1 ATOM 737 C CG1 . ILE A 0 90 . -7.614 -12.860 9.731 1.00 90.97 90 A 1 ATOM 738 C CG2 . ILE A 0 90 . -9.583 -11.506 10.543 1.00 90.97 90 A 1 ATOM 739 C CD1 . ILE A 0 90 . -8.328 -14.200 9.512 1.00 90.97 90 A 1 ATOM 740 N N . GLY A 0 91 . -7.858 -8.791 10.410 1.00 88.62 91 A 1 ATOM 741 C CA . GLY A 0 91 . -7.673 -7.587 9.597 1.00 88.62 91 A 1 ATOM 742 C C . GLY A 0 91 . -6.324 -6.914 9.864 1.00 88.62 91 A 1 ATOM 743 O O . GLY A 0 91 . -5.607 -6.580 8.926 1.00 88.62 91 A 1 ATOM 744 N N . PHE A 0 92 . -5.917 -6.814 11.133 1.00 89.68 92 A 1 ATOM 745 C CA . PHE A 0 92 . -4.618 -6.252 11.507 1.00 89.68 92 A 1 ATOM 746 C C . PHE A 0 92 . -3.447 -7.079 10.956 1.00 89.68 92 A 1 ATOM 747 C CB . PHE A 0 92 . -4.536 -6.127 13.033 1.00 89.68 92 A 1 ATOM 748 O O . PHE A 0 92 . -2.499 -6.511 10.417 1.00 89.68 92 A 1 ATOM 749 C CG . PHE A 0 92 . -3.220 -5.560 13.519 1.00 89.68 92 A 1 ATOM 750 C CD1 . PHE A 0 92 . -2.216 -6.414 14.016 1.00 89.68 92 A 1 ATOM 751 C CD2 . PHE A 0 92 . -2.989 -4.175 13.448 1.00 89.68 92 A 1 ATOM 752 C CE1 . PHE A 0 92 . -0.988 -5.881 14.446 1.00 89.68 92 A 1 ATOM 753 C CE2 . PHE A 0 92 . -1.765 -3.643 13.888 1.00 89.68 92 A 1 ATOM 754 C CZ . PHE A 0 92 . -0.763 -4.495 14.383 1.00 89.68 92 A 1 ATOM 755 N N . VAL A 0 93 . -3.523 -8.411 11.030 1.00 91.89 93 A 1 ATOM 756 C CA . VAL A 0 93 . -2.481 -9.301 10.488 1.00 91.89 93 A 1 ATOM 757 C C . VAL A 0 93 . -2.349 -9.143 8.969 1.00 91.89 93 A 1 ATOM 758 C CB . VAL A 0 93 . -2.758 -10.767 10.876 1.00 91.89 93 A 1 ATOM 759 O O . VAL A 0 93 . -1.234 -9.022 8.464 1.00 91.89 93 A 1 ATOM 760 C CG1 . VAL A 0 93 . -1.782 -11.743 10.206 1.00 91.89 93 A 1 ATOM 761 C CG2 . VAL A 0 93 . -2.618 -10.962 12.392 1.00 91.89 93 A 1 ATOM 762 N N . VAL A 0 94 . -3.467 -9.081 8.238 1.00 89.01 94 A 1 ATOM 763 C CA . VAL A 0 94 . -3.467 -8.873 6.776 1.00 89.01 94 A 1 ATOM 764 C C . VAL A 0 94 . -2.866 -7.513 6.402 1.00 89.01 94 A 1 ATOM 765 C CB . VAL A 0 94 . -4.899 -9.018 6.220 1.00 89.01 94 A 1 ATOM 766 O O . VAL A 0 94 . -2.101 -7.403 5.438 1.00 89.01 94 A 1 ATOM 767 C CG1 . VAL A 0 94 . -5.000 -8.637 4.737 1.00 89.01 94 A 1 ATOM 768 C CG2 . VAL A 0 94 . -5.384 -10.469 6.345 1.00 89.01 94 A 1 ATOM 769 N N . MET A 0 95 . -3.163 -6.474 7.183 1.00 87.31 95 A 1 ATOM 770 C CA . MET A 0 95 . -2.594 -5.141 6.975 1.00 87.31 95 A 1 ATOM 771 C C . MET A 0 95 . -1.098 -5.102 7.273 1.00 87.31 95 A 1 ATOM 772 C CB . MET A 0 95 . -3.331 -4.123 7.842 1.00 87.31 95 A 1 ATOM 773 O O . MET A 0 95 . -0.343 -4.516 6.499 1.00 87.31 95 A 1 ATOM 774 C CG . MET A 0 95 . -4.753 -3.925 7.322 1.00 87.31 95 A 1 ATOM 775 S SD . MET A 0 95 . -5.736 -2.823 8.347 1.00 87.31 95 A 1 ATOM 776 C CE . MET A 0 95 . -4.936 -1.280 7.885 1.00 87.31 95 A 1 ATOM 777 N N . LEU A 0 96 . -0.651 -5.766 8.340 1.00 87.57 96 A 1 ATOM 778 C CA . LEU A 0 96 . 0.764 -5.862 8.690 1.00 87.57 96 A 1 ATOM 779 C C . LEU A 0 96 . 1.555 -6.629 7.623 1.00 87.57 96 A 1 ATOM 780 C CB . LEU A 0 96 . 0.871 -6.494 10.087 1.00 87.57 96 A 1 ATOM 781 O O . LEU A 0 96 . 2.631 -6.192 7.224 1.00 87.57 96 A 1 ATOM 782 C CG . LEU A 0 96 . 2.298 -6.415 10.668 1.00 87.57 96 A 1 ATOM 783 C CD1 . LEU A 0 96 . 2.253 -5.890 12.103 1.00 87.57 96 A 1 ATOM 784 C CD2 . LEU A 0 96 . 2.975 -7.786 10.676 1.00 87.57 96 A 1 ATOM 785 N N . HIS A 0 97 . 0.989 -7.714 7.092 1.00 87.56 97 A 1 ATOM 786 C CA . HIS A 0 97 . 1.572 -8.445 5.968 1.00 87.56 97 A 1 ATOM 787 C C . HIS A 0 97 . 1.745 -7.548 4.729 1.00 87.56 97 A 1 ATOM 788 C CB . HIS A 0 97 . 0.677 -9.653 5.673 1.00 87.56 97 A 1 ATOM 789 O O . HIS A 0 97 . 2.804 -7.529 4.105 1.00 87.56 97 A 1 ATOM 790 C CG . HIS A 0 97 . 1.176 -10.499 4.535 1.00 87.56 97 A 1 ATOM 791 C CD2 . HIS A 0 97 . 2.192 -11.415 4.581 1.00 87.56 97 A 1 ATOM 792 N ND1 . HIS A 0 97 . 0.673 -10.511 3.254 1.00 87.56 97 A 1 ATOM 793 C CE1 . HIS A 0 97 . 1.347 -11.439 2.556 1.00 87.56 97 A 1 ATOM 794 N NE2 . HIS A 0 97 . 2.298 -11.999 3.315 1.00 87.56 97 A 1 ATOM 795 N N . SER A 0 98 . 0.733 -6.741 4.407 1.00 84.27 98 A 1 ATOM 796 C CA . SER A 0 98 . 0.788 -5.810 3.272 1.00 84.27 98 A 1 ATOM 797 C C . SER A 0 98 . 1.796 -4.676 3.497 1.00 84.27 98 A 1 ATOM 798 C CB . SER A 0 98 . -0.604 -5.233 3.004 1.00 84.27 98 A 1 ATOM 799 O O . SER A 0 98 . 2.528 -4.306 2.578 1.00 84.27 98 A 1 ATOM 800 O OG . SER A 0 98 . -1.539 -6.283 2.819 1.00 84.27 98 A 1 ATOM 801 N N . LEU A 0 99 . 1.872 -4.159 4.727 1.00 83.18 99 A 1 ATOM 802 C CA . LEU A 0 99 . 2.815 -3.115 5.125 1.00 83.18 99 A 1 ATOM 803 C C . LEU A 0 99 . 4.269 -3.574 5.023 1.00 83.18 99 A 1 ATOM 804 C CB . LEU A 0 99 . 2.489 -2.666 6.562 1.00 83.18 99 A 1 ATOM 805 O O . LEU A 0 99 . 5.124 -2.753 4.718 1.00 83.18 99 A 1 ATOM 806 C CG . LEU A 0 99 . 3.372 -1.511 7.079 1.00 83.18 99 A 1 ATOM 807 C CD1 . LEU A 0 99 . 3.110 -0.211 6.315 1.00 83.18 99 A 1 ATOM 808 C CD2 . LEU A 0 99 . 3.090 -1.262 8.559 1.00 83.18 99 A 1 ATOM 809 N N . LEU A 0 100 . 4.554 -4.853 5.272 1.00 83.48 100 A 1 ATOM 810 C CA . LEU A 0 100 . 5.906 -5.400 5.158 1.00 83.48 100 A 1 ATOM 811 C C . LEU A 0 100 . 6.277 -5.739 3.710 1.00 83.48 100 A 1 ATOM 812 C CB . LEU A 0 100 . 6.036 -6.622 6.080 1.00 83.48 100 A 1 ATOM 813 O O . LEU A 0 100 . 7.405 -5.478 3.301 1.00 83.48 100 A 1 ATOM 814 C CG . LEU A 0 100 . 5.987 -6.286 7.583 1.00 83.48 100 A 1 ATOM 815 C CD1 . LEU A 0 100 . 5.992 -7.585 8.390 1.00 83.48 100 A 1 ATOM 816 C CD2 . LEU A 0 100 . 7.177 -5.437 8.038 1.00 83.48 100 A 1 ATOM 817 N N . ASN A 0 101 . 5.340 -6.255 2.912 1.00 80.54 101 A 1 ATOM 818 C CA . ASN A 0 101 . 5.630 -6.632 1.524 1.00 80.54 101 A 1 ATOM 819 C C . ASN A 0 101 . 5.855 -5.423 0.607 1.00 80.54 101 A 1 ATOM 820 C CB . ASN A 0 101 . 4.495 -7.523 0.999 1.00 80.54 101 A 1 ATOM 821 O O . ASN A 0 101 . 6.680 -5.477 -0.302 1.00 80.54 101 A 1 ATOM 822 C CG . ASN A 0 101 . 4.534 -8.921 1.585 1.00 80.54 101 A 1 ATOM 823 N ND2 . ASN A 0 101 . 3.482 -9.677 1.404 1.00 80.54 101 A 1 ATOM 824 O OD1 . ASN A 0 101 . 5.491 -9.363 2.193 1.00 80.54 101 A 1 ATOM 825 N N . PHE A 0 102 . 5.151 -4.316 0.840 1.00 77.00 102 A 1 ATOM 826 C CA . PHE A 0 102 . 5.277 -3.130 -0.003 1.00 77.00 102 A 1 ATOM 827 C C . PHE A 0 102 . 6.684 -2.485 -0.013 1.00 77.00 102 A 1 ATOM 828 C CB . PHE A 0 102 . 4.172 -2.135 0.358 1.00 77.00 102 A 1 ATOM 829 O O . PHE A 0 102 . 7.245 -2.325 -1.099 1.00 77.00 102 A 1 ATOM 830 C CG . PHE A 0 102 . 4.226 -0.896 -0.502 1.00 77.00 102 A 1 ATOM 831 C CD1 . PHE A 0 102 . 4.558 0.350 0.061 1.00 77.00 102 A 1 ATOM 832 C CD2 . PHE A 0 102 . 4.000 -1.008 -1.887 1.00 77.00 102 A 1 ATOM 833 C CE1 . PHE A 0 102 . 4.623 1.490 -0.757 1.00 77.00 102 A 1 ATOM 834 C CE2 . PHE A 0 102 . 4.102 0.125 -2.709 1.00 77.00 102 A 1 ATOM 835 C CZ . PHE A 0 102 . 4.397 1.372 -2.139 1.00 77.00 102 A 1 ATOM 836 N N . PRO A 0 103 . 7.305 -2.135 1.135 1.00 77.14 103 A 1 ATOM 837 C CA . PRO A 0 103 . 8.644 -1.556 1.153 1.00 77.14 103 A 1 ATOM 838 C C . PRO A 0 103 . 9.698 -2.536 0.636 1.00 77.14 103 A 1 ATOM 839 C CB . PRO A 0 103 . 8.911 -1.149 2.605 1.00 77.14 103 A 1 ATOM 840 O O . PRO A 0 103 . 10.635 -2.098 -0.021 1.00 77.14 103 A 1 ATOM 841 C CG . PRO A 0 103 . 8.008 -2.076 3.410 1.00 77.14 103 A 1 ATOM 842 C CD . PRO A 0 103 . 6.804 -2.241 2.489 1.00 77.14 103 A 1 ATOM 843 N N . VAL A 0 104 . 9.539 -3.845 0.863 1.00 79.20 104 A 1 ATOM 844 C CA . VAL A 0 104 . 10.456 -4.860 0.316 1.00 79.20 104 A 1 ATOM 845 C C . VAL A 0 104 . 10.464 -4.820 -1.212 1.00 79.20 104 A 1 ATOM 846 C CB . VAL A 0 104 . 10.102 -6.263 0.844 1.00 79.20 104 A 1 ATOM 847 O O . VAL A 0 104 . 11.540 -4.818 -1.809 1.00 79.20 104 A 1 ATOM 848 C CG1 . VAL A 0 104 . 10.918 -7.371 0.166 1.00 79.20 104 A 1 ATOM 849 C CG2 . VAL A 0 104 . 10.388 -6.348 2.349 1.00 79.20 104 A 1 ATOM 850 N N . ASN A 0 105 . 9.296 -4.697 -1.847 1.00 77.59 105 A 1 ATOM 851 C CA . ASN A 0 105 . 9.209 -4.583 -3.303 1.00 77.59 105 A 1 ATOM 852 C C . ASN A 0 105 . 9.855 -3.292 -3.826 1.00 77.59 105 A 1 ATOM 853 C CB . ASN A 0 105 . 7.742 -4.690 -3.747 1.00 77.59 105 A 1 ATOM 854 O O . ASN A 0 105 . 10.574 -3.342 -4.820 1.00 77.59 105 A 1 ATOM 855 C CG . ASN A 0 105 . 7.186 -6.100 -3.665 1.00 77.59 105 A 1 ATOM 856 N ND2 . ASN A 0 105 . 6.060 -6.341 -4.297 1.00 77.59 105 A 1 ATOM 857 O OD1 . ASN A 0 105 . 7.733 -7.009 -3.070 1.00 77.59 105 A 1 ATOM 858 N N . ILE A 0 106 . 9.660 -2.155 -3.146 1.00 77.72 106 A 1 ATOM 859 C CA . ILE A 0 106 . 10.311 -0.889 -3.531 1.00 77.72 106 A 1 ATOM 860 C C . ILE A 0 106 . 11.833 -0.986 -3.386 1.00 77.72 106 A 1 ATOM 861 C CB . ILE A 0 106 . 9.782 0.291 -2.689 1.00 77.72 106 A 1 ATOM 862 O O . ILE A 0 106 . 12.571 -0.527 -4.254 1.00 77.72 106 A 1 ATOM 863 C CG1 . ILE A 0 106 . 8.283 0.543 -2.937 1.00 77.72 106 A 1 ATOM 864 C CG2 . ILE A 0 106 . 10.565 1.581 -3.028 1.00 77.72 106 A 1 ATOM 865 C CD1 . ILE A 0 106 . 7.670 1.393 -1.820 1.00 77.72 106 A 1 ATOM 866 N N . ILE A 0 107 . 12.315 -1.578 -2.290 1.00 78.15 107 A 1 ATOM 867 C CA . ILE A 0 107 . 13.750 -1.759 -2.051 1.00 78.15 107 A 1 ATOM 868 C C . ILE A 0 107 . 14.347 -2.667 -3.131 1.00 78.15 107 A 1 ATOM 869 C CB . ILE A 0 107 . 13.993 -2.300 -0.623 1.00 78.15 107 A 1 ATOM 870 O O . ILE A 0 107 . 15.415 -2.358 -3.652 1.00 78.15 107 A 1 ATOM 871 C CG1 . ILE A 0 107 . 13.642 -1.227 0.434 1.00 78.15 107 A 1 ATOM 872 C CG2 . ILE A 0 107 . 15.457 -2.738 -0.434 1.00 78.15 107 A 1 ATOM 873 C CD1 . ILE A 0 107 . 13.427 -1.808 1.839 1.00 78.15 107 A 1 ATOM 874 N N . SER A 0 108 . 13.653 -3.747 -3.500 1.00 79.67 108 A 1 ATOM 875 C CA . SER A 0 108 . 14.086 -4.645 -4.574 1.00 79.67 108 A 1 ATOM 876 C C . SER A 0 108 . 14.201 -3.919 -5.916 1.00 79.67 108 A 1 ATOM 877 C CB . SER A 0 108 . 13.113 -5.819 -4.695 1.00 79.67 108 A 1 ATOM 878 O O . SER A 0 108 . 15.221 -4.053 -6.587 1.00 79.67 108 A 1 ATOM 879 O OG . SER A 0 108 . 13.625 -6.788 -5.588 1.00 79.67 108 A 1 ATOM 880 N N . ASP A 0 109 . 13.196 -3.119 -6.280 1.00 78.78 109 A 1 ATOM 881 C CA . ASP A 0 109 . 13.191 -2.347 -7.530 1.00 78.78 109 A 1 ATOM 882 C C . ASP A 0 109 . 14.322 -1.301 -7.547 1.00 78.78 109 A 1 ATOM 883 C CB . ASP A 0 109 . 11.798 -1.710 -7.680 1.00 78.78 109 A 1 ATOM 884 O O . ASP A 0 109 . 15.079 -1.179 -8.511 1.00 78.78 109 A 1 ATOM 885 C CG . ASP A 0 109 . 11.537 -1.105 -9.063 1.00 78.78 109 A 1 ATOM 886 O OD1 . ASP A 0 109 . 12.057 -1.649 -10.058 1.00 78.78 109 A 1 ATOM 887 O OD2 . ASP A 0 109 . 10.775 -0.113 -9.115 1.00 78.78 109 A 1 ATOM 888 N N . LEU A 0 110 . 14.547 -0.611 -6.422 1.00 80.09 110 A 1 ATOM 889 C CA . LEU A 0 110 . 15.645 0.349 -6.297 1.00 80.09 110 A 1 ATOM 890 C C . LEU A 0 110 . 17.025 -0.322 -6.416 1.00 80.09 110 A 1 ATOM 891 C CB . LEU A 0 110 . 15.497 1.106 -4.966 1.00 80.09 110 A 1 ATOM 892 O O . LEU A 0 110 . 17.922 0.228 -7.059 1.00 80.09 110 A 1 ATOM 893 C CG . LEU A 0 110 . 16.446 2.312 -4.838 1.00 80.09 110 A 1 ATOM 894 C CD1 . LEU A 0 110 . 16.057 3.448 -5.790 1.00 80.09 110 A 1 ATOM 895 C CD2 . LEU A 0 110 . 16.407 2.857 -3.410 1.00 80.09 110 A 1 ATOM 896 N N . ILE A 0 111 . 17.203 -1.506 -5.819 1.00 81.64 111 A 1 ATOM 897 C CA . ILE A 0 111 . 18.444 -2.289 -5.926 1.00 81.64 111 A 1 ATOM 898 C C . ILE A 0 111 . 18.680 -2.732 -7.373 1.00 81.64 111 A 1 ATOM 899 C CB . ILE A 0 111 . 18.416 -3.499 -4.961 1.00 81.64 111 A 1 ATOM 900 O O . ILE A 0 111 . 19.822 -2.689 -7.840 1.00 81.64 111 A 1 ATOM 901 C CG1 . ILE A 0 111 . 18.542 -3.019 -3.498 1.00 81.64 111 A 1 ATOM 902 C CG2 . ILE A 0 111 . 19.550 -4.502 -5.266 1.00 81.64 111 A 1 ATOM 903 C CD1 . ILE A 0 111 . 18.185 -4.105 -2.473 1.00 81.64 111 A 1 ATOM 904 N N . GLU A 0 112 . 17.633 -3.132 -8.094 1.00 80.99 112 A 1 ATOM 905 C CA . GLU A 0 112 . 17.732 -3.520 -9.502 1.00 80.99 112 A 1 ATOM 906 C C . GLU A 0 112 . 18.158 -2.332 -10.374 1.00 80.99 112 A 1 ATOM 907 C CB . GLU A 0 112 . 16.401 -4.129 -9.966 1.00 80.99 112 A 1 ATOM 908 O O . GLU A 0 112 . 19.148 -2.419 -11.110 1.00 80.99 112 A 1 ATOM 909 C CG . GLU A 0 112 . 16.512 -4.638 -11.411 1.00 80.99 112 A 1 ATOM 910 C CD . GLU A 0 112 . 15.286 -5.422 -11.902 1.00 80.99 112 A 1 ATOM 911 O OE1 . GLU A 0 112 . 15.310 -5.785 -13.102 1.00 80.99 112 A 1 ATOM 912 O OE2 . GLU A 0 112 . 14.379 -5.707 -11.090 1.00 80.99 112 A 1 ATOM 913 N N . VAL A 0 113 . 17.491 -1.184 -10.221 1.00 80.12 113 A 1 ATOM 914 C CA . VAL A 0 113 . 17.846 0.051 -10.934 1.00 80.12 113 A 1 ATOM 915 C C . VAL A 0 113 . 19.285 0.468 -10.626 1.00 80.12 113 A 1 ATOM 916 C CB . VAL A 0 113 . 16.852 1.178 -10.590 1.00 80.12 113 A 1 ATOM 917 O O . VAL A 0 113 . 20.048 0.784 -11.545 1.00 80.12 113 A 1 ATOM 918 C CG1 . VAL A 0 113 . 17.287 2.531 -11.177 1.00 80.12 113 A 1 ATOM 919 C CG2 . VAL A 0 113 . 15.462 0.868 -11.158 1.00 80.12 113 A 1 ATOM 920 N N . PHE A 0 114 . 19.694 0.424 -9.357 1.00 77.66 114 A 1 ATOM 921 C CA . PHE A 0 114 . 21.058 0.762 -8.950 1.00 77.66 114 A 1 ATOM 922 C C . PHE A 0 114 . 22.093 -0.209 -9.537 1.00 77.66 114 A 1 ATOM 923 C CB . PHE A 0 114 . 21.121 0.798 -7.421 1.00 77.66 114 A 1 ATOM 924 O O . PHE A 0 114 . 23.130 0.218 -10.051 1.00 77.66 114 A 1 ATOM 925 C CG . PHE A 0 114 . 22.448 1.284 -6.880 1.00 77.66 114 A 1 ATOM 926 C CD1 . PHE A 0 114 . 23.319 0.392 -6.231 1.00 77.66 114 A 1 ATOM 927 C CD2 . PHE A 0 114 . 22.802 2.640 -7.010 1.00 77.66 114 A 1 ATOM 928 C CE1 . PHE A 0 114 . 24.526 0.864 -5.686 1.00 77.66 114 A 1 ATOM 929 C CE2 . PHE A 0 114 . 24.026 3.104 -6.496 1.00 77.66 114 A 1 ATOM 930 C CZ . PHE A 0 114 . 24.889 2.215 -5.833 1.00 77.66 114 A 1 ATOM 931 N N . SER A 0 115 . 21.785 -1.508 -9.558 1.00 79.03 115 A 1 ATOM 932 C CA . SER A 0 115 . 22.638 -2.536 -10.168 1.00 79.03 115 A 1 ATOM 933 C C . SER A 0 115 . 22.822 -2.297 -11.669 1.00 79.03 115 A 1 ATOM 934 C CB . SER A 0 115 . 22.053 -3.931 -9.929 1.00 79.03 115 A 1 ATOM 935 O O . SER A 0 115 . 23.944 -2.367 -12.180 1.00 79.03 115 A 1 ATOM 936 O OG . SER A 0 115 . 22.000 -4.197 -8.543 1.00 79.03 115 A 1 ATOM 937 N N . ILE A 0 116 . 21.748 -1.940 -12.380 1.00 81.18 116 A 1 ATOM 938 C CA . ILE A 0 116 . 21.801 -1.595 -13.807 1.00 81.18 116 A 1 ATOM 939 C C . ILE A 0 116 . 22.644 -0.331 -14.036 1.00 81.18 116 A 1 ATOM 940 C CB . ILE A 0 116 . 20.370 -1.450 -14.379 1.00 81.18 116 A 1 ATOM 941 O O . ILE A 0 116 . 23.422 -0.281 -14.994 1.00 81.18 116 A 1 ATOM 942 C CG1 . ILE A 0 116 . 19.655 -2.822 -14.385 1.00 81.18 116 A 1 ATOM 943 C CG2 . ILE A 0 116 . 20.396 -0.867 -15.810 1.00 81.18 116 A 1 ATOM 944 C CD1 . ILE A 0 116 . 18.142 -2.728 -14.621 1.00 81.18 116 A 1 ATOM 945 N N . GLN A 0 117 . 22.529 0.684 -13.174 1.00 80.84 117 A 1 ATOM 946 C CA . GLN A 0 117 . 23.347 1.897 -13.276 1.00 80.84 117 A 1 ATOM 947 C C . GLN A 0 117 . 24.838 1.616 -13.043 1.00 80.84 117 A 1 ATOM 948 C CB . GLN A 0 117 . 22.843 2.987 -12.322 1.00 80.84 117 A 1 ATOM 949 O O . GLN A 0 117 . 25.663 2.078 -13.835 1.00 80.84 117 A 1 ATOM 950 C CG . GLN A 0 117 . 21.525 3.617 -12.803 1.00 80.84 117 A 1 ATOM 951 C CD . GLN A 0 117 . 21.186 4.914 -12.074 1.00 80.84 117 A 1 ATOM 952 N NE2 . GLN A 0 117 . 20.055 5.519 -12.363 1.00 80.84 117 A 1 ATOM 953 O OE1 . GLN A 0 117 . 21.933 5.434 -11.267 1.00 80.84 117 A 1 ATOM 954 N N . ILE A 0 118 . 25.190 0.794 -12.049 1.00 79.56 118 A 1 ATOM 955 C CA . ILE A 0 118 . 26.581 0.364 -11.825 1.00 79.56 118 A 1 ATOM 956 C C . ILE A 0 118 . 27.124 -0.382 -13.047 1.00 79.56 118 A 1 ATOM 957 C CB . ILE A 0 118 . 26.696 -0.488 -10.541 1.00 79.56 118 A 1 ATOM 958 O O . ILE A 0 118 . 28.224 -0.079 -13.507 1.00 79.56 118 A 1 ATOM 959 C CG1 . ILE A 0 118 . 26.532 0.430 -9.312 1.00 79.56 118 A 1 ATOM 960 C CG2 . ILE A 0 118 . 28.060 -1.214 -10.479 1.00 79.56 118 A 1 ATOM 961 C CD1 . ILE A 0 118 . 26.386 -0.330 -7.992 1.00 79.56 118 A 1 ATOM 962 N N . GLN A 0 119 . 26.356 -1.314 -13.618 1.00 82.40 119 A 1 ATOM 963 C CA . GLN A 0 119 . 26.760 -2.050 -14.824 1.00 82.40 119 A 1 ATOM 964 C C . GLN A 0 119 . 26.992 -1.116 -16.022 1.00 82.40 119 A 1 ATOM 965 C CB . GLN A 0 119 . 25.683 -3.094 -15.164 1.00 82.40 119 A 1 ATOM 966 O O . GLN A 0 119 . 27.949 -1.295 -16.782 1.00 82.40 119 A 1 ATOM 967 C CG . GLN A 0 119 . 25.710 -4.302 -14.214 1.00 82.40 119 A 1 ATOM 968 C CD . GLN A 0 119 . 26.939 -5.183 -14.410 1.00 82.40 119 A 1 ATOM 969 N NE2 . GLN A 0 119 . 27.485 -5.745 -13.355 1.00 82.40 119 A 1 ATOM 970 O OE1 . GLN A 0 119 . 27.431 -5.378 -15.510 1.00 82.40 119 A 1 ATOM 971 N N . LYS A 0 120 . 26.150 -0.088 -16.193 1.00 82.28 120 A 1 ATOM 972 C CA . LYS A 0 120 . 26.347 0.941 -17.226 1.00 82.28 120 A 1 ATOM 973 C C . LYS A 0 120 . 27.631 1.740 -16.988 1.00 82.28 120 A 1 ATOM 974 C CB . LYS A 0 120 . 25.124 1.869 -17.307 1.00 82.28 120 A 1 ATOM 975 O O . LYS A 0 120 . 28.403 1.897 -17.932 1.00 82.28 120 A 1 ATOM 976 C CG . LYS A 0 120 . 23.924 1.209 -18.005 1.00 82.28 120 A 1 ATOM 977 C CD . LYS A 0 120 . 22.724 2.167 -18.018 1.00 82.28 120 A 1 ATOM 978 C CE . LYS A 0 120 . 21.512 1.530 -18.711 1.00 82.28 120 A 1 ATOM 979 N NZ . LYS A 0 120 . 20.347 2.454 -18.742 1.00 82.28 120 A 1 ATOM 980 N N . TYR A 0 121 . 27.891 2.173 -15.755 1.00 79.72 121 A 1 ATOM 981 C CA . TYR A 0 121 . 29.107 2.911 -15.401 1.00 79.72 121 A 1 ATOM 982 C C . TYR A 0 121 . 30.376 2.073 -15.622 1.00 79.72 121 A 1 ATOM 983 C CB . TYR A 0 121 . 29.000 3.384 -13.946 1.00 79.72 121 A 1 ATOM 984 O O . TYR A 0 121 . 31.327 2.535 -16.251 1.00 79.72 121 A 1 ATOM 985 C CG . TYR A 0 121 . 30.166 4.250 -13.513 1.00 79.72 121 A 1 ATOM 986 C CD1 . TYR A 0 121 . 31.225 3.698 -12.764 1.00 79.72 121 A 1 ATOM 987 C CD2 . TYR A 0 121 . 30.198 5.607 -13.886 1.00 79.72 121 A 1 ATOM 988 C CE1 . TYR A 0 121 . 32.310 4.508 -12.375 1.00 79.72 121 A 1 ATOM 989 C CE2 . TYR A 0 121 . 31.281 6.418 -13.500 1.00 79.72 121 A 1 ATOM 990 O OH . TYR A 0 121 . 33.381 6.658 -12.386 1.00 79.72 121 A 1 ATOM 991 C CZ . TYR A 0 121 . 32.333 5.871 -12.739 1.00 79.72 121 A 1 ATOM 992 N N . HIS A 0 122 . 30.370 0.804 -15.198 1.00 76.87 122 A 1 ATOM 993 C CA . HIS A 0 122 . 31.504 -0.104 -15.391 1.00 76.87 122 A 1 ATOM 994 C C . HIS A 0 122 . 31.792 -0.371 -16.875 1.00 76.87 122 A 1 ATOM 995 C CB . HIS A 0 122 . 31.264 -1.421 -14.633 1.00 76.87 122 A 1 ATOM 996 O O . HIS A 0 122 . 32.956 -0.418 -17.276 1.00 76.87 122 A 1 ATOM 997 C CG . HIS A 0 122 . 32.393 -1.753 -13.697 1.00 76.87 122 A 1 ATOM 998 C CD2 . HIS A 0 122 . 32.337 -1.757 -12.329 1.00 76.87 122 A 1 ATOM 999 N ND1 . HIS A 0 122 . 33.686 -2.064 -14.054 1.00 76.87 122 A 1 ATOM 1000 C CE1 . HIS A 0 122 . 34.390 -2.260 -12.926 1.00 76.87 122 A 1 ATOM 1001 N NE2 . HIS A 0 122 . 33.608 -2.084 -11.850 1.00 76.87 122 A 1 ATOM 1002 N N . ARG A 0 123 . 30.750 -0.496 -17.713 1.00 77.71 123 A 1 ATOM 1003 C CA . ARG A 0 123 . 30.925 -0.609 -19.170 1.00 77.71 123 A 1 ATOM 1004 C C . ARG A 0 123 . 31.498 0.657 -19.795 1.00 77.71 123 A 1 ATOM 1005 C CB . ARG A 0 123 . 29.615 -0.995 -19.874 1.00 77.71 123 A 1 ATOM 1006 O O . ARG A 0 123 . 32.353 0.540 -20.665 1.00 77.71 123 A 1 ATOM 1007 C CG . ARG A 0 123 . 29.401 -2.514 -19.861 1.00 77.71 123 A 1 ATOM 1008 C CD . ARG A 0 123 . 28.471 -2.967 -20.992 1.00 77.71 123 A 1 ATOM 1009 N NE . ARG A 0 123 . 27.077 -2.533 -20.777 1.00 77.71 123 A 1 ATOM 1010 N NH1 . ARG A 0 123 . 26.044 -4.484 -21.429 1.00 77.71 123 A 1 ATOM 1011 N NH2 . ARG A 0 123 . 24.814 -2.779 -20.704 1.00 77.71 123 A 1 ATOM 1012 C CZ . ARG A 0 123 . 25.994 -3.264 -20.973 1.00 77.71 123 A 1 ATOM 1013 N N . GLN A 0 124 . 31.062 1.840 -19.366 1.00 78.53 124 A 1 ATOM 1014 C CA . GLN A 0 124 . 31.607 3.105 -19.872 1.00 78.53 124 A 1 ATOM 1015 C C . GLN A 0 124 . 33.091 3.263 -19.515 1.00 78.53 124 A 1 ATOM 1016 C CB . GLN A 0 124 . 30.782 4.281 -19.335 1.00 78.53 124 A 1 ATOM 1017 O O . GLN A 0 124 . 33.888 3.580 -20.392 1.00 78.53 124 A 1 ATOM 1018 C CG . GLN A 0 124 . 29.414 4.384 -20.028 1.00 78.53 124 A 1 ATOM 1019 C CD . GLN A 0 124 . 28.542 5.494 -19.451 1.00 78.53 124 A 1 ATOM 1020 N NE2 . GLN A 0 124 . 27.424 5.800 -20.073 1.00 78.53 124 A 1 ATOM 1021 O OE1 . GLN A 0 124 . 28.822 6.106 -18.438 1.00 78.53 124 A 1 ATOM 1022 N N . GLN A 0 125 . 33.477 2.955 -18.273 1.00 72.64 125 A 1 ATOM 1023 C CA . GLN A 0 125 . 34.882 2.962 -17.842 1.00 72.64 125 A 1 ATOM 1024 C C . GLN A 0 125 . 35.737 1.958 -18.630 1.00 72.64 125 A 1 ATOM 1025 C CB . GLN A 0 125 . 34.945 2.652 -16.336 1.00 72.64 125 A 1 ATOM 1026 O O . GLN A 0 125 . 36.842 2.284 -19.057 1.00 72.64 125 A 1 ATOM 1027 C CG . GLN A 0 125 . 34.434 3.811 -15.460 1.00 72.64 125 A 1 ATOM 1028 C CD . GLN A 0 125 . 35.362 5.024 -15.455 1.00 72.64 125 A 1 ATOM 1029 N NE2 . GLN A 0 125 . 34.935 6.151 -14.934 1.00 72.64 125 A 1 ATOM 1030 O OE1 . GLN A 0 125 . 36.494 4.991 -15.898 1.00 72.64 125 A 1 ATOM 1031 N N . PHE A 0 126 . 35.213 0.753 -18.884 1.00 74.58 126 A 1 ATOM 1032 C CA . PHE A 0 126 . 35.921 -0.246 -19.685 1.00 74.58 126 A 1 ATOM 1033 C C . PHE A 0 126 . 36.136 0.207 -21.138 1.00 74.58 126 A 1 ATOM 1034 C CB . PHE A 0 126 . 35.169 -1.579 -19.625 1.00 74.58 126 A 1 ATOM 1035 O O . PHE A 0 126 . 37.224 0.010 -21.676 1.00 74.58 126 A 1 ATOM 1036 C CG . PHE A 0 126 . 35.901 -2.706 -20.328 1.00 74.58 126 A 1 ATOM 1037 C CD1 . PHE A 0 126 . 35.520 -3.106 -21.622 1.00 74.58 126 A 1 ATOM 1038 C CD2 . PHE A 0 126 . 36.991 -3.333 -19.696 1.00 74.58 126 A 1 ATOM 1039 C CE1 . PHE A 0 126 . 36.211 -4.145 -22.272 1.00 74.58 126 A 1 ATOM 1040 C CE2 . PHE A 0 126 . 37.685 -4.367 -20.347 1.00 74.58 126 A 1 ATOM 1041 C CZ . PHE A 0 126 . 37.294 -4.777 -21.633 1.00 74.58 126 A 1 ATOM 1042 N N . ILE A 0 127 . 35.136 0.841 -21.763 1.00 71.12 127 A 1 ATOM 1043 C CA . ILE A 0 127 . 35.264 1.399 -23.120 1.00 71.12 127 A 1 ATOM 1044 C C . ILE A 0 127 . 36.336 2.497 -23.149 1.00 71.12 127 A 1 ATOM 1045 C CB . ILE A 0 127 . 33.896 1.889 -23.649 1.00 71.12 127 A 1 ATOM 1046 O O . ILE A 0 127 . 37.241 2.418 -23.970 1.00 71.12 127 A 1 ATOM 1047 C CG1 . ILE A 0 127 . 32.949 0.684 -23.872 1.00 71.12 127 A 1 ATOM 1048 C CG2 . ILE A 0 127 . 34.051 2.662 -24.973 1.00 71.12 127 A 1 ATOM 1049 C CD1 . ILE A 0 127 . 31.470 1.077 -23.978 1.00 71.12 127 A 1 ATOM 1050 N N . ILE A 0 128 . 36.309 3.441 -22.200 1.00 67.64 128 A 1 ATOM 1051 C CA . ILE A 0 128 . 37.312 4.518 -22.121 1.00 67.64 128 A 1 ATOM 1052 C C . ILE A 0 128 . 38.728 3.940 -21.964 1.00 67.64 128 A 1 ATOM 1053 C CB . ILE A 0 128 . 36.949 5.508 -20.988 1.00 67.64 128 A 1 ATOM 1054 O O . ILE A 0 128 . 39.644 4.401 -22.632 1.00 67.64 128 A 1 ATOM 1055 C CG1 . ILE A 0 128 . 35.629 6.248 -21.321 1.00 67.64 128 A 1 ATOM 1056 C CG2 . ILE A 0 128 . 38.070 6.541 -20.758 1.00 67.64 128 A 1 ATOM 1057 C CD1 . ILE A 0 128 . 34.997 6.958 -20.116 1.00 67.64 128 A 1 ATOM 1058 N N . SER A 0 129 . 38.906 2.887 -21.155 1.00 70.74 129 A 1 ATOM 1059 C CA . SER A 0 129 . 40.216 2.236 -20.979 1.00 70.74 129 A 1 ATOM 1060 C C . SER A 0 129 . 40.734 1.471 -22.206 1.00 70.74 129 A 1 ATOM 1061 C CB . SER A 0 129 . 40.187 1.302 -19.764 1.00 70.74 129 A 1 ATOM 1062 O O . SER A 0 129 . 41.920 1.167 -22.257 1.00 70.74 129 A 1 ATOM 1063 O OG . SER A 0 129 . 39.442 0.116 -20.000 1.00 70.74 129 A 1 ATOM 1064 N N . ARG A 0 130 . 39.871 1.119 -23.174 1.00 67.43 130 A 1 ATOM 1065 C CA . ARG A 0 130 . 40.292 0.502 -24.449 1.00 67.43 130 A 1 ATOM 1066 C C . ARG A 0 130 . 40.702 1.525 -25.505 1.00 67.43 130 A 1 ATOM 1067 C CB . ARG A 0 130 . 39.184 -0.395 -25.028 1.00 67.43 130 A 1 ATOM 1068 O O . ARG A 0 130 . 41.412 1.144 -26.432 1.00 67.43 130 A 1 ATOM 1069 C CG . ARG A 0 130 . 39.192 -1.797 -24.412 1.00 67.43 130 A 1 ATOM 1070 C CD . ARG A 0 130 . 38.243 -2.748 -25.159 1.00 67.43 130 A 1 ATOM 1071 N NE . ARG A 0 130 . 38.769 -3.140 -26.485 1.00 67.43 130 A 1 ATOM 1072 N NH1 . ARG A 0 130 . 37.379 -4.925 -26.853 1.00 67.43 130 A 1 ATOM 1073 N NH2 . ARG A 0 130 . 38.951 -4.428 -28.357 1.00 67.43 130 A 1 ATOM 1074 C CZ . ARG A 0 130 . 38.367 -4.157 -27.224 1.00 67.43 130 A 1 ATOM 1075 N N . ASP A 0 131 . 40.231 2.763 -25.380 1.00 71.83 131 A 1 ATOM 1076 C CA . ASP A 0 131 . 40.482 3.838 -26.343 1.00 71.83 131 A 1 ATOM 1077 C C . ASP A 0 131 . 41.714 4.696 -25.973 1.00 71.83 131 A 1 ATOM 1078 C CB . ASP A 0 131 . 39.203 4.686 -26.499 1.00 71.83 131 A 1 ATOM 1079 O O . ASP A 0 131 . 42.134 5.531 -26.776 1.00 71.83 131 A 1 ATOM 1080 C CG . ASP A 0 131 . 38.003 3.947 -27.123 1.00 71.83 131 A 1 ATOM 1081 O OD1 . ASP A 0 131 . 38.196 2.902 -27.792 1.00 71.83 131 A 1 ATOM 1082 O OD2 . ASP A 0 131 . 36.869 4.460 -26.960 1.00 71.83 131 A 1 ATOM 1083 N N . THR A 0 132 . 42.301 4.488 -24.785 1.00 66.54 132 A 1 ATOM 1084 C CA . THR A 0 132 . 43.578 5.079 -24.324 1.00 66.54 132 A 1 ATOM 1085 C C . THR A 0 132 . 44.723 4.083 -24.403 1.00 66.54 132 A 1 ATOM 1086 C CB . THR A 0 132 . 43.490 5.571 -22.878 1.00 66.54 132 A 1 ATOM 1087 O O . THR A 0 132 . 45.808 4.471 -24.886 1.00 66.54 132 A 1 ATOM 1088 C CG2 . THR A 0 132 . 42.477 6.701 -22.696 1.00 66.54 132 A 1 ATOM 1089 O OG1 . THR A 0 132 . 43.138 4.489 -22.046 1.00 66.54 132 A 1 ATOM 1090 O OXT . THR A 0 132 . 44.502 2.972 -23.875 1.00 66.54 132 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 68.15 # loop_ _atom_type.symbol C N O S #