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 ALA 0 3 THR 0 4 LEU 0 5 LEU 0 6 LYS 0 7 TYR 0 8 CYS 0 9 GLY 0 10 THR 0 11 LEU 0 12 THR 0 13 ASN 0 14 VAL 0 15 ILE 0 16 HIS 0 17 SER 0 18 ARG 0 19 ASN 0 20 ALA 0 21 THR 0 22 VAL 0 23 LEU 0 24 SER 0 25 SER 0 26 SER 0 27 ARG 0 28 LYS 0 29 ARG 0 30 LYS 0 31 MET 0 32 PRO 0 33 LEU 0 34 LEU 0 35 THR 0 36 GLY 0 37 PRO 0 38 GLU 0 39 ARG 0 40 GLU 0 41 GLN 0 42 MET 0 43 LEU 0 44 PRO 0 45 PRO 0 46 LEU 0 47 LEU 0 48 ASN 0 49 ILE 0 50 HIS 0 51 HIS 0 52 TRP 0 53 GLU 0 54 LEU 0 55 CYS 0 56 GLN 0 57 HIS 0 58 SER 0 59 SER 0 60 ARG 0 61 GLU 0 62 ALA 0 63 ILE 0 64 ARG 0 65 ARG 0 66 SER 0 67 PHE 0 68 LEU 0 69 PHE 0 70 LYS 0 71 ASP 0 72 PHE 0 73 ASP 0 74 VAL 0 75 ALA 0 76 PHE 0 77 ASP 0 78 PHE 0 79 MET 0 80 LYS 0 81 LYS 0 82 ILE 0 83 ALA 0 84 GLU 0 85 LYS 0 86 SER 0 87 LYS 0 88 VAL 0 89 MET 0 90 ASN 0 91 HIS 0 92 HIS 0 93 PRO 0 94 GLU 0 95 TRP 0 96 PHE 0 97 ASN 0 98 VAL 0 99 TYR 0 100 ASN 0 101 LYS 0 102 VAL 0 103 ASP 0 104 ILE 0 105 LEU 0 106 LEU 0 107 THR 0 108 SER 0 109 HIS 0 110 ASP 0 111 ALA 0 112 GLY 0 113 GLY 0 114 LEU 0 115 SER 0 116 ARG 0 117 ARG 0 118 ASP 0 119 ILE 0 120 ASP 0 121 LEU 0 122 ALA 0 123 ASN 0 124 PHE 0 125 ILE 0 126 ASN 0 127 ASP 0 128 ALA 0 129 ALA 0 130 PHE 0 131 GLU 0 132 TYR 0 133 GLN 0 134 ALA 0 135 LYS # 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 . -14.102 67.167 -11.537 1.00 44.76 1 A 1 ATOM 2 C CA . MET A 0 1 . -12.998 68.136 -11.705 1.00 44.76 1 A 1 ATOM 3 C C . MET A 0 1 . -11.766 67.595 -10.995 1.00 44.76 1 A 1 ATOM 4 C CB . MET A 0 1 . -13.378 69.509 -11.114 1.00 44.76 1 A 1 ATOM 5 O O . MET A 0 1 . -11.668 67.778 -9.795 1.00 44.76 1 A 1 ATOM 6 C CG . MET A 0 1 . -14.241 70.368 -12.039 1.00 44.76 1 A 1 ATOM 7 S SD . MET A 0 1 . -13.340 70.979 -13.484 1.00 44.76 1 A 1 ATOM 8 C CE . MET A 0 1 . -14.391 72.393 -13.924 1.00 44.76 1 A 1 ATOM 9 N N . ALA A 0 2 . -10.912 66.857 -11.707 1.00 48.31 2 A 1 ATOM 10 C CA . ALA A 0 2 . -9.483 66.649 -11.425 1.00 48.31 2 A 1 ATOM 11 C C . ALA A 0 2 . -8.979 65.571 -12.396 1.00 48.31 2 A 1 ATOM 12 C CB . ALA A 0 2 . -9.180 66.249 -9.977 1.00 48.31 2 A 1 ATOM 13 O O . ALA A 0 2 . -9.257 64.383 -12.255 1.00 48.31 2 A 1 ATOM 14 N N . THR A 0 3 . -8.344 66.066 -13.447 1.00 45.59 3 A 1 ATOM 15 C CA . THR A 0 3 . -7.736 65.361 -14.576 1.00 45.59 3 A 1 ATOM 16 C C . THR A 0 3 . -6.308 64.928 -14.206 1.00 45.59 3 A 1 ATOM 17 C CB . THR A 0 3 . -7.730 66.358 -15.764 1.00 45.59 3 A 1 ATOM 18 O O . THR A 0 3 . -5.784 65.358 -13.184 1.00 45.59 3 A 1 ATOM 19 C CG2 . THR A 0 3 . -7.475 65.785 -17.158 1.00 45.59 3 A 1 ATOM 20 O OG1 . THR A 0 3 . -8.997 66.974 -15.883 1.00 45.59 3 A 1 ATOM 21 N N . LEU A 0 4 . -5.669 64.209 -15.135 1.00 50.97 4 A 1 ATOM 22 C CA . LEU A 0 4 . -4.218 64.069 -15.358 1.00 50.97 4 A 1 ATOM 23 C C . LEU A 0 4 . -3.570 62.846 -14.679 1.00 50.97 4 A 1 ATOM 24 C CB . LEU A 0 4 . -3.448 65.390 -15.063 1.00 50.97 4 A 1 ATOM 25 O O . LEU A 0 4 . -3.787 62.587 -13.509 1.00 50.97 4 A 1 ATOM 26 C CG . LEU A 0 4 . -3.921 66.661 -15.821 1.00 50.97 4 A 1 ATOM 27 C CD1 . LEU A 0 4 . -4.323 67.797 -14.881 1.00 50.97 4 A 1 ATOM 28 C CD2 . LEU A 0 4 . -2.867 67.297 -16.724 1.00 50.97 4 A 1 ATOM 29 N N . LEU A 0 5 . -2.720 62.051 -15.330 1.00 52.28 5 A 1 ATOM 30 C CA . LEU A 0 5 . -2.205 62.024 -16.703 1.00 52.28 5 A 1 ATOM 31 C C . LEU A 0 5 . -1.495 60.672 -16.878 1.00 52.28 5 A 1 ATOM 32 C CB . LEU A 0 5 . -1.154 63.136 -16.906 1.00 52.28 5 A 1 ATOM 33 O O . LEU A 0 5 . -0.767 60.231 -15.991 1.00 52.28 5 A 1 ATOM 34 C CG . LEU A 0 5 . -1.572 64.295 -17.819 1.00 52.28 5 A 1 ATOM 35 C CD1 . LEU A 0 5 . -0.529 65.399 -17.669 1.00 52.28 5 A 1 ATOM 36 C CD2 . LEU A 0 5 . -1.656 63.913 -19.293 1.00 52.28 5 A 1 ATOM 37 N N . LYS A 0 6 . -1.665 60.040 -18.041 1.00 47.98 6 A 1 ATOM 38 C CA . LYS A 0 6 . -0.860 58.892 -18.473 1.00 47.98 6 A 1 ATOM 39 C C . LYS A 0 6 . 0.557 59.378 -18.797 1.00 47.98 6 A 1 ATOM 40 C CB . LYS A 0 6 . -1.496 58.250 -19.720 1.00 47.98 6 A 1 ATOM 41 O O . LYS A 0 6 . 0.713 60.198 -19.696 1.00 47.98 6 A 1 ATOM 42 C CG . LYS A 0 6 . -2.825 57.530 -19.444 1.00 47.98 6 A 1 ATOM 43 C CD . LYS A 0 6 . -3.411 56.962 -20.747 1.00 47.98 6 A 1 ATOM 44 C CE . LYS A 0 6 . -4.681 56.150 -20.467 1.00 47.98 6 A 1 ATOM 45 N NZ . LYS A 0 6 . -5.241 55.556 -21.710 1.00 47.98 6 A 1 ATOM 46 N N . TYR A 0 7 . 1.571 58.847 -18.116 1.00 53.54 7 A 1 ATOM 47 C CA . TYR A 0 7 . 2.972 58.999 -18.517 1.00 53.54 7 A 1 ATOM 48 C C . TYR A 0 7 . 3.407 57.765 -19.316 1.00 53.54 7 A 1 ATOM 49 C CB . TYR A 0 7 . 3.875 59.294 -17.305 1.00 53.54 7 A 1 ATOM 50 O O . TYR A 0 7 . 3.495 56.658 -18.789 1.00 53.54 7 A 1 ATOM 51 C CG . TYR A 0 7 . 4.500 60.677 -17.358 1.00 53.54 7 A 1 ATOM 52 C CD1 . TYR A 0 7 . 5.777 60.856 -17.928 1.00 53.54 7 A 1 ATOM 53 C CD2 . TYR A 0 7 . 3.792 61.789 -16.860 1.00 53.54 7 A 1 ATOM 54 C CE1 . TYR A 0 7 . 6.352 62.141 -17.990 1.00 53.54 7 A 1 ATOM 55 C CE2 . TYR A 0 7 . 4.364 63.075 -16.923 1.00 53.54 7 A 1 ATOM 56 O OH . TYR A 0 7 . 6.191 64.496 -17.536 1.00 53.54 7 A 1 ATOM 57 C CZ . TYR A 0 7 . 5.645 63.254 -17.484 1.00 53.54 7 A 1 ATOM 58 N N . CYS A 0 8 . 3.644 57.972 -20.612 1.00 46.52 8 A 1 ATOM 59 C CA . CYS A 0 8 . 4.289 57.033 -21.521 1.00 46.52 8 A 1 ATOM 60 C C . CYS A 0 8 . 5.803 57.261 -21.423 1.00 46.52 8 A 1 ATOM 61 C CB . CYS A 0 8 . 3.729 57.294 -22.930 1.00 46.52 8 A 1 ATOM 62 O O . CYS A 0 8 . 6.309 58.257 -21.933 1.00 46.52 8 A 1 ATOM 63 S SG . CYS A 0 8 . 4.440 56.147 -24.143 1.00 46.52 8 A 1 ATOM 64 N N . GLY A 0 9 . 6.507 56.379 -20.712 1.00 57.23 9 A 1 ATOM 65 C CA . GLY A 0 9 . 7.963 56.397 -20.585 1.00 57.23 9 A 1 ATOM 66 C C . GLY A 0 9 . 8.589 55.286 -21.417 1.00 57.23 9 A 1 ATOM 67 O O . GLY A 0 9 . 8.423 54.107 -21.116 1.00 57.23 9 A 1 ATOM 68 N N . THR A 0 10 . 9.303 55.674 -22.466 1.00 48.91 10 A 1 ATOM 69 C CA . THR A 0 10 . 10.139 54.818 -23.309 1.00 48.91 10 A 1 ATOM 70 C C . THR A 0 10 . 11.341 54.349 -22.487 1.00 48.91 10 A 1 ATOM 71 C CB . THR A 0 10 . 10.611 55.616 -24.549 1.00 48.91 10 A 1 ATOM 72 O O . THR A 0 10 . 12.230 55.144 -22.191 1.00 48.91 10 A 1 ATOM 73 C CG2 . THR A 0 10 . 10.726 54.737 -25.790 1.00 48.91 10 A 1 ATOM 74 O OG1 . THR A 0 10 . 9.703 56.651 -24.872 1.00 48.91 10 A 1 ATOM 75 N N . LEU A 0 11 . 11.372 53.076 -22.084 1.00 54.48 11 A 1 ATOM 76 C CA . LEU A 0 11 . 12.545 52.486 -21.440 1.00 54.48 11 A 1 ATOM 77 C C . LEU A 0 11 . 13.417 51.799 -22.489 1.00 54.48 11 A 1 ATOM 78 C CB . LEU A 0 11 . 12.150 51.584 -20.259 1.00 54.48 11 A 1 ATOM 79 O O . LEU A 0 11 . 13.005 50.884 -23.199 1.00 54.48 11 A 1 ATOM 80 C CG . LEU A 0 11 . 11.883 52.393 -18.972 1.00 54.48 11 A 1 ATOM 81 C CD1 . LEU A 0 11 . 11.142 51.526 -17.955 1.00 54.48 11 A 1 ATOM 82 C CD2 . LEU A 0 11 . 13.177 52.887 -18.311 1.00 54.48 11 A 1 ATOM 83 N N . THR A 0 12 . 14.630 52.321 -22.581 1.00 55.37 12 A 1 ATOM 84 C CA . THR A 0 12 . 15.762 51.853 -23.365 1.00 55.37 12 A 1 ATOM 85 C C . THR A 0 12 . 16.134 50.416 -22.998 1.00 55.37 12 A 1 ATOM 86 C CB . THR A 0 12 . 16.949 52.803 -23.103 1.00 55.37 12 A 1 ATOM 87 O O . THR A 0 12 . 16.344 50.076 -21.834 1.00 55.37 12 A 1 ATOM 88 C CG2 . THR A 0 12 . 16.856 54.056 -23.973 1.00 55.37 12 A 1 ATOM 89 O OG1 . THR A 0 12 . 16.944 53.273 -21.767 1.00 55.37 12 A 1 ATOM 90 N N . ASN A 0 13 . 16.255 49.567 -24.019 1.00 48.25 13 A 1 ATOM 91 C CA . ASN A 0 13 . 16.784 48.213 -23.891 1.00 48.25 13 A 1 ATOM 92 C C . ASN A 0 13 . 18.285 48.269 -23.572 1.00 48.25 13 A 1 ATOM 93 C CB . ASN A 0 13 . 16.515 47.437 -25.198 1.00 48.25 13 A 1 ATOM 94 O O . ASN A 0 13 . 19.110 48.416 -24.472 1.00 48.25 13 A 1 ATOM 95 C CG . ASN A 0 13 . 15.098 46.909 -25.311 1.00 48.25 13 A 1 ATOM 96 N ND2 . ASN A 0 13 . 14.555 46.833 -26.503 1.00 48.25 13 A 1 ATOM 97 O OD1 . ASN A 0 13 . 14.474 46.521 -24.342 1.00 48.25 13 A 1 ATOM 98 N N . VAL A 0 14 . 18.649 48.113 -22.299 1.00 58.85 14 A 1 ATOM 99 C CA . VAL A 0 14 . 20.006 47.716 -21.902 1.00 58.85 14 A 1 ATOM 100 C C . VAL A 0 14 . 20.009 46.196 -21.769 1.00 58.85 14 A 1 ATOM 101 C CB . VAL A 0 14 . 20.485 48.442 -20.630 1.00 58.85 14 A 1 ATOM 102 O O . VAL A 0 14 . 19.580 45.637 -20.761 1.00 58.85 14 A 1 ATOM 103 C CG1 . VAL A 0 14 . 21.901 47.996 -20.235 1.00 58.85 14 A 1 ATOM 104 C CG2 . VAL A 0 14 . 20.519 49.960 -20.857 1.00 58.85 14 A 1 ATOM 105 N N . ILE A 0 15 . 20.466 45.519 -22.823 1.00 57.03 15 A 1 ATOM 106 C CA . ILE A 0 15 . 20.677 44.069 -22.832 1.00 57.03 15 A 1 ATOM 107 C C . ILE A 0 15 . 21.905 43.782 -21.965 1.00 57.03 15 A 1 ATOM 108 C CB . ILE A 0 15 . 20.811 43.533 -24.280 1.00 57.03 15 A 1 ATOM 109 O O . ILE A 0 15 . 23.045 43.908 -22.404 1.00 57.03 15 A 1 ATOM 110 C CG1 . ILE A 0 15 . 19.522 43.838 -25.083 1.00 57.03 15 A 1 ATOM 111 C CG2 . ILE A 0 15 . 21.101 42.018 -24.274 1.00 57.03 15 A 1 ATOM 112 C CD1 . ILE A 0 15 . 19.589 43.445 -26.565 1.00 57.03 15 A 1 ATOM 113 N N . HIS A 0 16 . 21.672 43.418 -20.707 1.00 55.04 16 A 1 ATOM 114 C CA . HIS A 0 16 . 22.696 42.835 -19.850 1.00 55.04 16 A 1 ATOM 115 C C . HIS A 0 16 . 22.746 41.329 -20.131 1.00 55.04 16 A 1 ATOM 116 C CB . HIS A 0 16 . 22.426 43.191 -18.375 1.00 55.04 16 A 1 ATOM 117 O O . HIS A 0 16 . 21.869 40.575 -19.706 1.00 55.04 16 A 1 ATOM 118 C CG . HIS A 0 16 . 23.606 43.850 -17.708 1.00 55.04 16 A 1 ATOM 119 C CD2 . HIS A 0 16 . 24.286 43.397 -16.612 1.00 55.04 16 A 1 ATOM 120 N ND1 . HIS A 0 16 . 24.189 45.040 -18.081 1.00 55.04 16 A 1 ATOM 121 C CE1 . HIS A 0 16 . 25.194 45.297 -17.227 1.00 55.04 16 A 1 ATOM 122 N NE2 . HIS A 0 16 . 25.287 44.322 -16.309 1.00 55.04 16 A 1 ATOM 123 N N . SER A 0 17 . 23.764 40.886 -20.871 1.00 52.28 17 A 1 ATOM 124 C CA . SER A 0 17 . 24.044 39.469 -21.108 1.00 52.28 17 A 1 ATOM 125 C C . SER A 0 17 . 24.486 38.807 -19.800 1.00 52.28 17 A 1 ATOM 126 C CB . SER A 0 17 . 25.101 39.311 -22.211 1.00 52.28 17 A 1 ATOM 127 O O . SER A 0 17 . 25.668 38.776 -19.459 1.00 52.28 17 A 1 ATOM 128 O OG . SER A 0 17 . 26.302 39.956 -21.838 1.00 52.28 17 A 1 ATOM 129 N N . ARG A 0 18 . 23.530 38.295 -19.024 1.00 57.98 18 A 1 ATOM 130 C CA . ARG A 0 18 . 23.822 37.373 -17.926 1.00 57.98 18 A 1 ATOM 131 C C . ARG A 0 18 . 23.948 35.974 -18.516 1.00 57.98 18 A 1 ATOM 132 C CB . ARG A 0 18 . 22.757 37.472 -16.823 1.00 57.98 18 A 1 ATOM 133 O O . ARG A 0 18 . 22.959 35.407 -18.970 1.00 57.98 18 A 1 ATOM 134 C CG . ARG A 0 18 . 22.953 38.746 -15.986 1.00 57.98 18 A 1 ATOM 135 C CD . ARG A 0 18 . 21.963 38.792 -14.816 1.00 57.98 18 A 1 ATOM 136 N NE . ARG A 0 18 . 22.358 39.801 -13.813 1.00 57.98 18 A 1 ATOM 137 N NH1 . ARG A 0 18 . 20.730 39.339 -12.259 1.00 57.98 18 A 1 ATOM 138 N NH2 . ARG A 0 18 . 22.278 40.880 -11.808 1.00 57.98 18 A 1 ATOM 139 C CZ . ARG A 0 18 . 21.788 40.002 -12.637 1.00 57.98 18 A 1 ATOM 140 N N . ASN A 0 19 . 25.167 35.437 -18.495 1.00 53.15 19 A 1 ATOM 141 C CA . ASN A 0 19 . 25.436 34.015 -18.684 1.00 53.15 19 A 1 ATOM 142 C C . ASN A 0 19 . 24.648 33.231 -17.627 1.00 53.15 19 A 1 ATOM 143 C CB . ASN A 0 19 . 26.956 33.763 -18.572 1.00 53.15 19 A 1 ATOM 144 O O . ASN A 0 19 . 25.087 33.084 -16.489 1.00 53.15 19 A 1 ATOM 145 C CG . ASN A 0 19 . 27.721 34.098 -19.839 1.00 53.15 19 A 1 ATOM 146 N ND2 . ASN A 0 19 . 28.998 34.385 -19.739 1.00 53.15 19 A 1 ATOM 147 O OD1 . ASN A 0 19 . 27.191 34.090 -20.934 1.00 53.15 19 A 1 ATOM 148 N N . ALA A 0 20 . 23.447 32.785 -17.988 1.00 60.08 20 A 1 ATOM 149 C CA . ALA A 0 20 . 22.674 31.854 -17.192 1.00 60.08 20 A 1 ATOM 150 C C . ALA A 0 20 . 23.285 30.468 -17.398 1.00 60.08 20 A 1 ATOM 151 C CB . ALA A 0 20 . 21.197 31.939 -17.595 1.00 60.08 20 A 1 ATOM 152 O O . ALA A 0 20 . 23.072 29.820 -18.421 1.00 60.08 20 A 1 ATOM 153 N N . THR A 0 21 . 24.084 30.027 -16.432 1.00 53.17 21 A 1 ATOM 154 C CA . THR A 0 21 . 24.507 28.636 -16.317 1.00 53.17 21 A 1 ATOM 155 C C . THR A 0 21 . 23.242 27.785 -16.236 1.00 53.17 21 A 1 ATOM 156 C CB . THR A 0 21 . 25.398 28.420 -15.074 1.00 53.17 21 A 1 ATOM 157 O O . THR A 0 21 . 22.515 27.822 -15.243 1.00 53.17 21 A 1 ATOM 158 C CG2 . THR A 0 21 . 26.565 27.485 -15.384 1.00 53.17 21 A 1 ATOM 159 O OG1 . THR A 0 21 . 25.965 29.633 -14.624 1.00 53.17 21 A 1 ATOM 160 N N . VAL A 0 22 . 22.931 27.068 -17.315 1.00 59.77 22 A 1 ATOM 161 C CA . VAL A 0 22 . 21.805 26.136 -17.377 1.00 59.77 22 A 1 ATOM 162 C C . VAL A 0 22 . 22.106 25.003 -16.399 1.00 59.77 22 A 1 ATOM 163 C CB . VAL A 0 22 . 21.584 25.629 -18.820 1.00 59.77 22 A 1 ATOM 164 O O . VAL A 0 22 . 22.864 24.085 -16.703 1.00 59.77 22 A 1 ATOM 165 C CG1 . VAL A 0 22 . 20.432 24.618 -18.905 1.00 59.77 22 A 1 ATOM 166 C CG2 . VAL A 0 22 . 21.250 26.793 -19.765 1.00 59.77 22 A 1 ATOM 167 N N . LEU A 0 23 . 21.539 25.081 -15.195 1.00 57.84 23 A 1 ATOM 168 C CA . LEU A 0 23 . 21.468 23.952 -14.275 1.00 57.84 23 A 1 ATOM 169 C C . LEU A 0 23 . 20.642 22.868 -14.971 1.00 57.84 23 A 1 ATOM 170 C CB . LEU A 0 23 . 20.831 24.404 -12.945 1.00 57.84 23 A 1 ATOM 171 O O . LEU A 0 23 . 19.423 22.990 -15.093 1.00 57.84 23 A 1 ATOM 172 C CG . LEU A 0 23 . 21.766 25.242 -12.053 1.00 57.84 23 A 1 ATOM 173 C CD1 . LEU A 0 23 . 20.954 25.964 -10.977 1.00 57.84 23 A 1 ATOM 174 C CD2 . LEU A 0 23 . 22.807 24.365 -11.352 1.00 57.84 23 A 1 ATOM 175 N N . SER A 0 24 . 21.305 21.830 -15.485 1.00 55.29 24 A 1 ATOM 176 C CA . SER A 0 24 . 20.619 20.705 -16.112 1.00 55.29 24 A 1 ATOM 177 C C . SER A 0 24 . 19.695 20.070 -15.075 1.00 55.29 24 A 1 ATOM 178 C CB . SER A 0 24 . 21.609 19.683 -16.692 1.00 55.29 24 A 1 ATOM 179 O O . SER A 0 24 . 20.164 19.508 -14.081 1.00 55.29 24 A 1 ATOM 180 O OG . SER A 0 24 . 22.258 18.934 -15.685 1.00 55.29 24 A 1 ATOM 181 N N . SER A 0 25 . 18.381 20.160 -15.282 1.00 58.40 25 A 1 ATOM 182 C CA . SER A 0 25 . 17.427 19.440 -14.447 1.00 58.40 25 A 1 ATOM 183 C C . SER A 0 25 . 17.735 17.949 -14.571 1.00 58.40 25 A 1 ATOM 184 C CB . SER A 0 25 . 15.978 19.745 -14.857 1.00 58.40 25 A 1 ATOM 185 O O . SER A 0 25 . 17.636 17.394 -15.669 1.00 58.40 25 A 1 ATOM 186 O OG . SER A 0 25 . 15.668 19.191 -16.122 1.00 58.40 25 A 1 ATOM 187 N N . SER A 0 26 . 18.112 17.298 -13.468 1.00 56.07 26 A 1 ATOM 188 C CA . SER A 0 26 . 18.179 15.839 -13.408 1.00 56.07 26 A 1 ATOM 189 C C . SER A 0 26 . 16.825 15.300 -13.859 1.00 56.07 26 A 1 ATOM 190 C CB . SER A 0 26 . 18.519 15.377 -11.990 1.00 56.07 26 A 1 ATOM 191 O O . SER A 0 26 . 15.800 15.537 -13.213 1.00 56.07 26 A 1 ATOM 192 O OG . SER A 0 26 . 18.529 13.965 -11.936 1.00 56.07 26 A 1 ATOM 193 N N . ARG A 0 27 . 16.796 14.668 -15.035 1.00 62.23 27 A 1 ATOM 194 C CA . ARG A 0 27 . 15.578 14.148 -15.653 1.00 62.23 27 A 1 ATOM 195 C C . ARG A 0 27 . 15.143 12.962 -14.794 1.00 62.23 27 A 1 ATOM 196 C CB . ARG A 0 27 . 15.878 13.821 -17.136 1.00 62.23 27 A 1 ATOM 197 O O . ARG A 0 27 . 15.577 11.839 -15.042 1.00 62.23 27 A 1 ATOM 198 C CG . ARG A 0 27 . 14.690 14.022 -18.090 1.00 62.23 27 A 1 ATOM 199 C CD . ARG A 0 27 . 15.138 13.733 -19.534 1.00 62.23 27 A 1 ATOM 200 N NE . ARG A 0 27 . 14.181 14.236 -20.542 1.00 62.23 27 A 1 ATOM 201 N NH1 . ARG A 0 27 . 15.133 13.239 -22.386 1.00 62.23 27 A 1 ATOM 202 N NH2 . ARG A 0 27 . 13.377 14.579 -22.656 1.00 62.23 27 A 1 ATOM 203 C CZ . ARG A 0 27 . 14.233 14.016 -21.849 1.00 62.23 27 A 1 ATOM 204 N N . LYS A 0 28 . 14.361 13.218 -13.732 1.00 63.69 28 A 1 ATOM 205 C CA . LYS A 0 28 . 13.796 12.162 -12.880 1.00 63.69 28 A 1 ATOM 206 C C . LYS A 0 28 . 13.169 11.134 -13.812 1.00 63.69 28 A 1 ATOM 207 C CB . LYS A 0 28 . 12.749 12.699 -11.883 1.00 63.69 28 A 1 ATOM 208 O O . LYS A 0 28 . 12.281 11.473 -14.597 1.00 63.69 28 A 1 ATOM 209 C CG . LYS A 0 28 . 13.370 13.228 -10.578 1.00 63.69 28 A 1 ATOM 210 C CD . LYS A 0 28 . 12.278 13.577 -9.551 1.00 63.69 28 A 1 ATOM 211 C CE . LYS A 0 28 . 12.896 14.056 -8.229 1.00 63.69 28 A 1 ATOM 212 N NZ . LYS A 0 28 . 11.857 14.384 -7.216 1.00 63.69 28 A 1 ATOM 213 N N . ARG A 0 29 . 13.696 9.906 -13.782 1.00 70.75 29 A 1 ATOM 214 C CA . ARG A 0 29 . 13.160 8.807 -14.581 1.00 70.75 29 A 1 ATOM 215 C C . ARG A 0 29 . 11.694 8.657 -14.201 1.00 70.75 29 A 1 ATOM 216 C CB . ARG A 0 29 . 13.934 7.504 -14.328 1.00 70.75 29 A 1 ATOM 217 O O . ARG A 0 29 . 11.392 8.414 -13.036 1.00 70.75 29 A 1 ATOM 218 C CG . ARG A 0 29 . 15.300 7.493 -15.033 1.00 70.75 29 A 1 ATOM 219 C CD . ARG A 0 29 . 16.085 6.199 -14.767 1.00 70.75 29 A 1 ATOM 220 N NE . ARG A 0 29 . 15.365 4.997 -15.242 1.00 70.75 29 A 1 ATOM 221 N NH1 . ARG A 0 29 . 17.158 3.791 -16.045 1.00 70.75 29 A 1 ATOM 222 N NH2 . ARG A 0 29 . 15.109 2.922 -16.143 1.00 70.75 29 A 1 ATOM 223 C CZ . ARG A 0 29 . 15.881 3.916 -15.806 1.00 70.75 29 A 1 ATOM 224 N N . LYS A 0 30 . 10.808 8.853 -15.177 1.00 80.99 30 A 1 ATOM 225 C CA . LYS A 0 30 . 9.384 8.569 -15.012 1.00 80.99 30 A 1 ATOM 226 C C . LYS A 0 30 . 9.237 7.102 -14.622 1.00 80.99 30 A 1 ATOM 227 C CB . LYS A 0 30 . 8.619 8.869 -16.308 1.00 80.99 30 A 1 ATOM 228 O O . LYS A 0 30 . 9.944 6.251 -15.169 1.00 80.99 30 A 1 ATOM 229 C CG . LYS A 0 30 . 8.546 10.373 -16.608 1.00 80.99 30 A 1 ATOM 230 C CD . LYS A 0 30 . 7.769 10.606 -17.909 1.00 80.99 30 A 1 ATOM 231 C CE . LYS A 0 30 . 7.403 12.083 -18.076 1.00 80.99 30 A 1 ATOM 232 N NZ . LYS A 0 30 . 6.316 12.237 -19.073 1.00 80.99 30 A 1 ATOM 233 N N . MET A 0 31 . 8.349 6.823 -13.676 1.00 88.86 31 A 1 ATOM 234 C CA . MET A 0 31 . 7.957 5.452 -13.375 1.00 88.86 31 A 1 ATOM 235 C C . MET A 0 31 . 7.362 4.819 -14.649 1.00 88.86 31 A 1 ATOM 236 C CB . MET A 0 31 . 6.947 5.485 -12.222 1.00 88.86 31 A 1 ATOM 237 O O . MET A 0 31 . 6.560 5.482 -15.311 1.00 88.86 31 A 1 ATOM 238 C CG . MET A 0 31 . 6.585 4.094 -11.697 1.00 88.86 31 A 1 ATOM 239 S SD . MET A 0 31 . 7.926 3.124 -10.950 1.00 88.86 31 A 1 ATOM 240 C CE . MET A 0 31 . 8.441 4.179 -9.574 1.00 88.86 31 A 1 ATOM 241 N N . PRO A 0 32 . 7.760 3.597 -15.046 1.00 95.26 32 A 1 ATOM 242 C CA . PRO A 0 32 . 7.140 2.926 -16.181 1.00 95.26 32 A 1 ATOM 243 C C . PRO A 0 32 . 5.678 2.576 -15.883 1.00 95.26 32 A 1 ATOM 244 C CB . PRO A 0 32 . 7.994 1.681 -16.446 1.00 95.26 32 A 1 ATOM 245 O O . PRO A 0 32 . 5.301 2.328 -14.735 1.00 95.26 32 A 1 ATOM 246 C CG . PRO A 0 32 . 8.573 1.360 -15.070 1.00 95.26 32 A 1 ATOM 247 C CD . PRO A 0 32 . 8.789 2.746 -14.465 1.00 95.26 32 A 1 ATOM 248 N N . LEU A 0 33 . 4.865 2.539 -16.939 1.00 97.03 33 A 1 ATOM 249 C CA . LEU A 0 33 . 3.553 1.898 -16.899 1.00 97.03 33 A 1 ATOM 250 C C . LEU A 0 33 . 3.723 0.393 -16.673 1.00 97.03 33 A 1 ATOM 251 C CB . LEU A 0 33 . 2.809 2.149 -18.223 1.00 97.03 33 A 1 ATOM 252 O O . LEU A 0 33 . 4.749 -0.173 -17.058 1.00 97.03 33 A 1 ATOM 253 C CG . LEU A 0 33 . 2.402 3.613 -18.458 1.00 97.03 33 A 1 ATOM 254 C CD1 . LEU A 0 33 . 1.889 3.781 -19.889 1.00 97.03 33 A 1 ATOM 255 C CD2 . LEU A 0 33 . 1.296 4.052 -17.500 1.00 97.03 33 A 1 ATOM 256 N N . LEU A 0 34 . 2.704 -0.253 -16.106 1.00 97.76 34 A 1 ATOM 257 C CA . LEU A 0 34 . 2.667 -1.712 -16.035 1.00 97.76 34 A 1 ATOM 258 C C . LEU A 0 34 . 2.753 -2.316 -17.443 1.00 97.76 34 A 1 ATOM 259 C CB . LEU A 0 34 . 1.384 -2.197 -15.344 1.00 97.76 34 A 1 ATOM 260 O O . LEU A 0 34 . 1.973 -1.972 -18.336 1.00 97.76 34 A 1 ATOM 261 C CG . LEU A 0 34 . 1.218 -1.797 -13.874 1.00 97.76 34 A 1 ATOM 262 C CD1 . LEU A 0 34 . -0.177 -2.200 -13.400 1.00 97.76 34 A 1 ATOM 263 C CD2 . LEU A 0 34 . 2.247 -2.480 -12.973 1.00 97.76 34 A 1 ATOM 264 N N . THR A 0 35 . 3.683 -3.245 -17.625 1.00 97.39 35 A 1 ATOM 265 C CA . THR A 0 35 . 3.803 -4.067 -18.834 1.00 97.39 35 A 1 ATOM 266 C C . THR A 0 35 . 2.658 -5.079 -18.933 1.00 97.39 35 A 1 ATOM 267 C CB . THR A 0 35 . 5.149 -4.802 -18.864 1.00 97.39 35 A 1 ATOM 268 O O . THR A 0 35 . 1.981 -5.358 -17.947 1.00 97.39 35 A 1 ATOM 269 C CG2 . THR A 0 35 . 6.354 -3.864 -18.824 1.00 97.39 35 A 1 ATOM 270 O OG1 . THR A 0 35 . 5.251 -5.671 -17.771 1.00 97.39 35 A 1 ATOM 271 N N . GLY A 0 36 . 2.442 -5.670 -20.114 1.00 97.62 36 A 1 ATOM 272 C CA . GLY A 0 36 . 1.439 -6.732 -20.306 1.00 97.62 36 A 1 ATOM 273 C C . GLY A 0 36 . 1.540 -7.859 -19.263 1.00 97.62 36 A 1 ATOM 274 O O . GLY A 0 36 . 0.573 -8.067 -18.531 1.00 97.62 36 A 1 ATOM 275 N N . PRO A 0 37 . 2.718 -8.493 -19.091 1.00 98.01 37 A 1 ATOM 276 C CA . PRO A 0 37 . 2.907 -9.538 -18.084 1.00 98.01 37 A 1 ATOM 277 C C . PRO A 0 37 . 2.647 -9.068 -16.646 1.00 98.01 37 A 1 ATOM 278 C CB . PRO A 0 37 . 4.355 -10.010 -18.258 1.00 98.01 37 A 1 ATOM 279 O O . PRO A 0 37 . 2.026 -9.780 -15.860 1.00 98.01 37 A 1 ATOM 280 C CG . PRO A 0 37 . 4.651 -9.710 -19.725 1.00 98.01 37 A 1 ATOM 281 C CD . PRO A 0 37 . 3.887 -8.411 -19.958 1.00 98.01 37 A 1 ATOM 282 N N . GLU A 0 38 . 3.075 -7.852 -16.287 1.00 98.12 38 A 1 ATOM 283 C CA . GLU A 0 38 . 2.802 -7.307 -14.952 1.00 98.12 38 A 1 ATOM 284 C C . GLU A 0 38 . 1.301 -7.100 -14.725 1.00 98.12 38 A 1 ATOM 285 C CB . GLU A 0 38 . 3.532 -5.974 -14.749 1.00 98.12 38 A 1 ATOM 286 O O . GLU A 0 38 . 0.798 -7.402 -13.647 1.00 98.12 38 A 1 ATOM 287 C CG . GLU A 0 38 . 5.056 -6.119 -14.624 1.00 98.12 38 A 1 ATOM 288 C CD . GLU A 0 38 . 5.730 -4.744 -14.619 1.00 98.12 38 A 1 ATOM 289 O OE1 . GLU A 0 38 . 6.548 -4.475 -13.714 1.00 98.12 38 A 1 ATOM 290 O OE2 . GLU A 0 38 . 5.418 -3.966 -15.553 1.00 98.12 38 A 1 ATOM 291 N N . ARG A 0 39 . 0.563 -6.633 -15.737 1.00 98.10 39 A 1 ATOM 292 C CA . ARG A 0 39 . -0.896 -6.460 -15.661 1.00 98.10 39 A 1 ATOM 293 C C . ARG A 0 39 . -1.606 -7.795 -15.479 1.00 98.10 39 A 1 ATOM 294 C CB . ARG A 0 39 . -1.415 -5.762 -16.924 1.00 98.10 39 A 1 ATOM 295 O O . ARG A 0 39 . -2.457 -7.898 -14.599 1.00 98.10 39 A 1 ATOM 296 C CG . ARG A 0 39 . -0.932 -4.313 -17.030 1.00 98.10 39 A 1 ATOM 297 C CD . ARG A 0 39 . -1.228 -3.745 -18.417 1.00 98.10 39 A 1 ATOM 298 N NE . ARG A 0 39 . -2.665 -3.457 -18.563 1.00 98.10 39 A 1 ATOM 299 N NH1 . ARG A 0 39 . -2.549 -1.177 -18.369 1.00 98.10 39 A 1 ATOM 300 N NH2 . ARG A 0 39 . -4.527 -2.187 -18.449 1.00 98.10 39 A 1 ATOM 301 C CZ . ARG A 0 39 . -3.235 -2.274 -18.466 1.00 98.10 39 A 1 ATOM 302 N N . GLU A 0 40 . -1.236 -8.797 -16.274 1.00 97.84 40 A 1 ATOM 303 C CA . GLU A 0 40 . -1.786 -10.158 -16.206 1.00 97.84 40 A 1 ATOM 304 C C . GLU A 0 40 . -1.561 -10.801 -14.834 1.00 97.84 40 A 1 ATOM 305 C CB . GLU A 0 40 . -1.130 -11.026 -17.290 1.00 97.84 40 A 1 ATOM 306 O O . GLU A 0 40 . -2.426 -11.515 -14.338 1.00 97.84 40 A 1 ATOM 307 C CG . GLU A 0 40 . -1.634 -10.681 -18.700 1.00 97.84 40 A 1 ATOM 308 C CD . GLU A 0 40 . -0.816 -11.358 -19.812 1.00 97.84 40 A 1 ATOM 309 O OE1 . GLU A 0 40 . -0.939 -10.892 -20.967 1.00 97.84 40 A 1 ATOM 310 O OE2 . GLU A 0 40 . -0.064 -12.313 -19.513 1.00 97.84 40 A 1 ATOM 311 N N . GLN A 0 41 . -0.431 -10.507 -14.189 1.00 97.97 41 A 1 ATOM 312 C CA . GLN A 0 41 . -0.118 -11.032 -12.865 1.00 97.97 41 A 1 ATOM 313 C C . GLN A 0 41 . -0.776 -10.236 -11.725 1.00 97.97 41 A 1 ATOM 314 C CB . GLN A 0 41 . 1.409 -11.058 -12.727 1.00 97.97 41 A 1 ATOM 315 O O . GLN A 0 41 . -1.245 -10.822 -10.751 1.00 97.97 41 A 1 ATOM 316 C CG . GLN A 0 41 . 1.854 -11.763 -11.439 1.00 97.97 41 A 1 ATOM 317 C CD . GLN A 0 41 . 3.364 -11.745 -11.237 1.00 97.97 41 A 1 ATOM 318 N NE2 . GLN A 0 41 . 3.859 -12.446 -10.242 1.00 97.97 41 A 1 ATOM 319 O OE1 . GLN A 0 41 . 4.129 -11.086 -11.920 1.00 97.97 41 A 1 ATOM 320 N N . MET A 0 42 . -0.762 -8.902 -11.794 1.00 98.29 42 A 1 ATOM 321 C CA . MET A 0 42 . -1.002 -8.038 -10.628 1.00 98.29 42 A 1 ATOM 322 C C . MET A 0 42 . -2.430 -7.510 -10.515 1.00 98.29 42 A 1 ATOM 323 C CB . MET A 0 42 . -0.044 -6.844 -10.664 1.00 98.29 42 A 1 ATOM 324 O O . MET A 0 42 . -2.886 -7.244 -9.405 1.00 98.29 42 A 1 ATOM 325 C CG . MET A 0 42 . 1.427 -7.257 -10.581 1.00 98.29 42 A 1 ATOM 326 S SD . MET A 0 42 . 2.571 -5.882 -10.859 1.00 98.29 42 A 1 ATOM 327 C CE . MET A 0 42 . 4.044 -6.856 -11.290 1.00 98.29 42 A 1 ATOM 328 N N . LEU A 0 43 . -3.136 -7.329 -11.635 1.00 98.37 43 A 1 ATOM 329 C CA . LEU A 0 43 . -4.501 -6.800 -11.612 1.00 98.37 43 A 1 ATOM 330 C C . LEU A 0 43 . -5.544 -7.830 -11.163 1.00 98.37 43 A 1 ATOM 331 C CB . LEU A 0 43 . -4.880 -6.181 -12.969 1.00 98.37 43 A 1 ATOM 332 O O . LEU A 0 43 . -6.399 -7.450 -10.364 1.00 98.37 43 A 1 ATOM 333 C CG . LEU A 0 43 . -4.097 -4.909 -13.330 1.00 98.37 43 A 1 ATOM 334 C CD1 . LEU A 0 43 . -4.458 -4.474 -14.752 1.00 98.37 43 A 1 ATOM 335 C CD2 . LEU A 0 43 . -4.427 -3.746 -12.391 1.00 98.37 43 A 1 ATOM 336 N N . PRO A 0 44 . -5.518 -9.108 -11.599 1.00 98.31 44 A 1 ATOM 337 C CA . PRO A 0 44 . -6.616 -10.024 -11.297 1.00 98.31 44 A 1 ATOM 338 C C . PRO A 0 44 . -6.944 -10.177 -9.804 1.00 98.31 44 A 1 ATOM 339 C CB . PRO A 0 44 . -6.265 -11.355 -11.963 1.00 98.31 44 A 1 ATOM 340 O O . PRO A 0 44 . -8.132 -10.157 -9.487 1.00 98.31 44 A 1 ATOM 341 C CG . PRO A 0 44 . -5.381 -10.924 -13.127 1.00 98.31 44 A 1 ATOM 342 C CD . PRO A 0 44 . -4.614 -9.732 -12.561 1.00 98.31 44 A 1 ATOM 343 N N . PRO A 0 45 . -5.979 -10.252 -8.862 1.00 98.00 45 A 1 ATOM 344 C CA . PRO A 0 45 . -6.311 -10.273 -7.436 1.00 98.00 45 A 1 ATOM 345 C C . PRO A 0 45 . -7.047 -9.006 -6.979 1.00 98.00 45 A 1 ATOM 346 C CB . PRO A 0 45 . -4.976 -10.451 -6.703 1.00 98.00 45 A 1 ATOM 347 O O . PRO A 0 45 . -8.053 -9.091 -6.277 1.00 98.00 45 A 1 ATOM 348 C CG . PRO A 0 45 . -4.078 -11.114 -7.747 1.00 98.00 45 A 1 ATOM 349 C CD . PRO A 0 45 . -4.548 -10.467 -9.045 1.00 98.00 45 A 1 ATOM 350 N N . LEU A 0 46 . -6.599 -7.826 -7.421 1.00 98.45 46 A 1 ATOM 351 C CA . LEU A 0 46 . -7.245 -6.557 -7.076 1.00 98.45 46 A 1 ATOM 352 C C . LEU A 0 46 . -8.683 -6.496 -7.601 1.00 98.45 46 A 1 ATOM 353 C CB . LEU A 0 46 . -6.425 -5.371 -7.615 1.00 98.45 46 A 1 ATOM 354 O O . LEU A 0 46 . -9.583 -6.100 -6.863 1.00 98.45 46 A 1 ATOM 355 C CG . LEU A 0 46 . -5.047 -5.180 -6.959 1.00 98.45 46 A 1 ATOM 356 C CD1 . LEU A 0 46 . -4.340 -4.000 -7.624 1.00 98.45 46 A 1 ATOM 357 C CD2 . LEU A 0 46 . -5.166 -4.884 -5.464 1.00 98.45 46 A 1 ATOM 358 N N . LEU A 0 47 . -8.896 -6.911 -8.851 1.00 98.17 47 A 1 ATOM 359 C CA . LEU A 0 47 . -10.196 -6.801 -9.512 1.00 98.17 47 A 1 ATOM 360 C C . LEU A 0 47 . -11.185 -7.878 -9.045 1.00 98.17 47 A 1 ATOM 361 C CB . LEU A 0 47 . -10.008 -6.829 -11.041 1.00 98.17 47 A 1 ATOM 362 O O . LEU A 0 47 . -12.336 -7.581 -8.736 1.00 98.17 47 A 1 ATOM 363 C CG . LEU A 0 47 . -9.053 -5.765 -11.619 1.00 98.17 47 A 1 ATOM 364 C CD1 . LEU A 0 47 . -9.008 -5.889 -13.142 1.00 98.17 47 A 1 ATOM 365 C CD2 . LEU A 0 47 . -9.419 -4.331 -11.249 1.00 98.17 47 A 1 ATOM 366 N N . ASN A 0 48 . -10.731 -9.129 -8.958 1.00 97.96 48 A 1 ATOM 367 C CA . ASN A 0 48 . -11.613 -10.279 -8.758 1.00 97.96 48 A 1 ATOM 368 C C . ASN A 0 48 . -11.840 -10.618 -7.280 1.00 97.96 48 A 1 ATOM 369 C CB . ASN A 0 48 . -11.039 -11.493 -9.509 1.00 97.96 48 A 1 ATOM 370 O O . ASN A 0 48 . -12.867 -11.207 -6.953 1.00 97.96 48 A 1 ATOM 371 C CG . ASN A 0 48 . -10.875 -11.278 -11.004 1.00 97.96 48 A 1 ATOM 372 N ND2 . ASN A 0 48 . -10.030 -12.052 -11.644 1.00 97.96 48 A 1 ATOM 373 O OD1 . ASN A 0 48 . -11.503 -10.445 -11.634 1.00 97.96 48 A 1 ATOM 374 N N . ILE A 0 49 . -10.889 -10.284 -6.398 1.00 97.20 49 A 1 ATOM 375 C CA . ILE A 0 49 . -10.946 -10.628 -4.966 1.00 97.20 49 A 1 ATOM 376 C C . ILE A 0 49 . -11.212 -9.379 -4.129 1.00 97.20 49 A 1 ATOM 377 C CB . ILE A 0 49 . -9.655 -11.351 -4.506 1.00 97.20 49 A 1 ATOM 378 O O . ILE A 0 49 . -12.084 -9.385 -3.270 1.00 97.20 49 A 1 ATOM 379 C CG1 . ILE A 0 49 . -9.358 -12.587 -5.390 1.00 97.20 49 A 1 ATOM 380 C CG2 . ILE A 0 49 . -9.761 -11.745 -3.021 1.00 97.20 49 A 1 ATOM 381 C CD1 . ILE A 0 49 . -8.014 -13.261 -5.091 1.00 97.20 49 A 1 ATOM 382 N N . HIS A 0 50 . -10.474 -8.299 -4.388 1.00 97.27 50 A 1 ATOM 383 C CA . HIS A 0 50 . -10.545 -7.075 -3.582 1.00 97.27 50 A 1 ATOM 384 C C . HIS A 0 50 . -11.503 -6.017 -4.145 1.00 97.27 50 A 1 ATOM 385 C CB . HIS A 0 50 . -9.132 -6.540 -3.360 1.00 97.27 50 A 1 ATOM 386 O O . HIS A 0 50 . -11.585 -4.911 -3.611 1.00 97.27 50 A 1 ATOM 387 C CG . HIS A 0 50 . -8.232 -7.538 -2.686 1.00 97.27 50 A 1 ATOM 388 C CD2 . HIS A 0 50 . -7.146 -8.161 -3.235 1.00 97.27 50 A 1 ATOM 389 N ND1 . HIS A 0 50 . -8.358 -8.000 -1.397 1.00 97.27 50 A 1 ATOM 390 C CE1 . HIS A 0 50 . -7.364 -8.874 -1.172 1.00 97.27 50 A 1 ATOM 391 N NE2 . HIS A 0 50 . -6.601 -9.007 -2.268 1.00 97.27 50 A 1 ATOM 392 N N . HIS A 0 51 . -12.241 -6.361 -5.205 1.00 97.52 51 A 1 ATOM 393 C CA . HIS A 0 51 . -13.310 -5.549 -5.785 1.00 97.52 51 A 1 ATOM 394 C C . HIS A 0 51 . -12.881 -4.136 -6.216 1.00 97.52 51 A 1 ATOM 395 C CB . HIS A 0 51 . -14.495 -5.520 -4.817 1.00 97.52 51 A 1 ATOM 396 O O . HIS A 0 51 . -13.691 -3.202 -6.178 1.00 97.52 51 A 1 ATOM 397 C CG . HIS A 0 51 . -14.954 -6.849 -4.302 1.00 97.52 51 A 1 ATOM 398 C CD2 . HIS A 0 51 . -14.985 -7.250 -2.994 1.00 97.52 51 A 1 ATOM 399 N ND1 . HIS A 0 51 . -15.474 -7.869 -5.060 1.00 97.52 51 A 1 ATOM 400 C CE1 . HIS A 0 51 . -15.808 -8.866 -4.226 1.00 97.52 51 A 1 ATOM 401 N NE2 . HIS A 0 51 . -15.552 -8.525 -2.955 1.00 97.52 51 A 1 ATOM 402 N N . TRP A 0 52 . -11.611 -3.965 -6.588 1.00 98.54 52 A 1 ATOM 403 C CA . TRP A 0 52 . -11.166 -2.778 -7.307 1.00 98.54 52 A 1 ATOM 404 C C . TRP A 0 52 . -11.720 -2.807 -8.731 1.00 98.54 52 A 1 ATOM 405 C CB . TRP A 0 52 . -9.636 -2.679 -7.325 1.00 98.54 52 A 1 ATOM 406 O O . TRP A 0 52 . -11.910 -3.865 -9.324 1.00 98.54 52 A 1 ATOM 407 C CG . TRP A 0 52 . -8.997 -2.358 -6.010 1.00 98.54 52 A 1 ATOM 408 C CD1 . TRP A 0 52 . -8.818 -3.223 -4.989 1.00 98.54 52 A 1 ATOM 409 C CD2 . TRP A 0 52 . -8.521 -1.068 -5.521 1.00 98.54 52 A 1 ATOM 410 C CE2 . TRP A 0 52 . -8.050 -1.236 -4.186 1.00 98.54 52 A 1 ATOM 411 C CE3 . TRP A 0 52 . -8.492 0.239 -6.053 1.00 98.54 52 A 1 ATOM 412 N NE1 . TRP A 0 52 . -8.250 -2.569 -3.914 1.00 98.54 52 A 1 ATOM 413 C CH2 . TRP A 0 52 . -7.534 1.119 -3.987 1.00 98.54 52 A 1 ATOM 414 C CZ2 . TRP A 0 52 . -7.554 -0.169 -3.425 1.00 98.54 52 A 1 ATOM 415 C CZ3 . TRP A 0 52 . -8.008 1.323 -5.296 1.00 98.54 52 A 1 ATOM 416 N N . GLU A 0 53 . -11.931 -1.634 -9.307 1.00 98.52 53 A 1 ATOM 417 C CA . GLU A 0 53 . -12.456 -1.482 -10.659 1.00 98.52 53 A 1 ATOM 418 C C . GLU A 0 53 . -11.459 -0.716 -11.521 1.00 98.52 53 A 1 ATOM 419 C CB . GLU A 0 53 . -13.802 -0.751 -10.617 1.00 98.52 53 A 1 ATOM 420 O O . GLU A 0 53 . -10.948 0.328 -11.111 1.00 98.52 53 A 1 ATOM 421 C CG . GLU A 0 53 . -14.886 -1.560 -9.887 1.00 98.52 53 A 1 ATOM 422 C CD . GLU A 0 53 . -16.215 -0.800 -9.762 1.00 98.52 53 A 1 ATOM 423 O OE1 . GLU A 0 53 . -17.154 -1.386 -9.177 1.00 98.52 53 A 1 ATOM 424 O OE2 . GLU A 0 53 . -16.291 0.364 -10.224 1.00 98.52 53 A 1 ATOM 425 N N . LEU A 0 54 . -11.203 -1.208 -12.734 1.00 98.08 54 A 1 ATOM 426 C CA . LEU A 0 54 . -10.502 -0.426 -13.749 1.00 98.08 54 A 1 ATOM 427 C C . LEU A 0 54 . -11.408 0.701 -14.239 1.00 98.08 54 A 1 ATOM 428 C CB . LEU A 0 54 . -10.077 -1.317 -14.929 1.00 98.08 54 A 1 ATOM 429 O O . LEU A 0 54 . -12.559 0.475 -14.608 1.00 98.08 54 A 1 ATOM 430 C CG . LEU A 0 54 . -8.844 -2.188 -14.651 1.00 98.08 54 A 1 ATOM 431 C CD1 . LEU A 0 54 . -8.682 -3.217 -15.770 1.00 98.08 54 A 1 ATOM 432 C CD2 . LEU A 0 54 . -7.556 -1.362 -14.592 1.00 98.08 54 A 1 ATOM 433 N N . CYS A 0 55 . -10.875 1.916 -14.295 1.00 97.90 55 A 1 ATOM 434 C CA . CYS A 0 55 . -11.595 3.071 -14.813 1.00 97.90 55 A 1 ATOM 435 C C . CYS A 0 55 . -10.678 4.020 -15.590 1.00 97.90 55 A 1 ATOM 436 C CB . CYS A 0 55 . -12.346 3.762 -13.661 1.00 97.90 55 A 1 ATOM 437 O O . CYS A 0 55 . -9.451 3.909 -15.575 1.00 97.90 55 A 1 ATOM 438 S SG . CYS A 0 55 . -11.195 4.380 -12.402 1.00 97.90 55 A 1 ATOM 439 N N . GLN A 0 56 . -11.303 4.965 -16.292 1.00 96.13 56 A 1 ATOM 440 C CA . GLN A 0 56 . -10.617 6.079 -16.934 1.00 96.13 56 A 1 ATOM 441 C C . GLN A 0 56 . -10.758 7.330 -16.071 1.00 96.13 56 A 1 ATOM 442 C CB . GLN A 0 56 . -11.170 6.306 -18.349 1.00 96.13 56 A 1 ATOM 443 O O . GLN A 0 56 . -11.859 7.697 -15.662 1.00 96.13 56 A 1 ATOM 444 C CG . GLN A 0 56 . -10.805 5.163 -19.308 1.00 96.13 56 A 1 ATOM 445 C CD . GLN A 0 56 . -9.298 5.033 -19.511 1.00 96.13 56 A 1 ATOM 446 N NE2 . GLN A 0 56 . -8.733 3.855 -19.363 1.00 96.13 56 A 1 ATOM 447 O OE1 . GLN A 0 56 . -8.604 5.996 -19.793 1.00 96.13 56 A 1 ATOM 448 N N . HIS A 0 57 . -9.643 8.007 -15.830 1.00 93.22 57 A 1 ATOM 449 C CA . HIS A 0 57 . -9.583 9.240 -15.068 1.00 93.22 57 A 1 ATOM 450 C C . HIS A 0 57 . -8.727 10.269 -15.810 1.00 93.22 57 A 1 ATOM 451 C CB . HIS A 0 57 . -9.065 8.925 -13.663 1.00 93.22 57 A 1 ATOM 452 O O . HIS A 0 57 . -7.507 10.129 -15.921 1.00 93.22 57 A 1 ATOM 453 C CG . HIS A 0 57 . -8.954 10.177 -12.844 1.00 93.22 57 A 1 ATOM 454 C CD2 . HIS A 0 57 . -7.912 11.048 -12.920 1.00 93.22 57 A 1 ATOM 455 N ND1 . HIS A 0 57 . -9.926 10.774 -12.078 1.00 93.22 57 A 1 ATOM 456 C CE1 . HIS A 0 57 . -9.456 11.974 -11.689 1.00 93.22 57 A 1 ATOM 457 N NE2 . HIS A 0 57 . -8.262 12.219 -12.259 1.00 93.22 57 A 1 ATOM 458 N N . SER A 0 58 . -9.366 11.325 -16.322 1.00 90.68 58 A 1 ATOM 459 C CA . SER A 0 58 . -8.696 12.420 -17.038 1.00 90.68 58 A 1 ATOM 460 C C . SER A 0 58 . -7.778 11.927 -18.170 1.00 90.68 58 A 1 ATOM 461 C CB . SER A 0 58 . -7.963 13.335 -16.041 1.00 90.68 58 A 1 ATOM 462 O O . SER A 0 58 . -6.632 12.357 -18.261 1.00 90.68 58 A 1 ATOM 463 O OG . SER A 0 58 . -8.856 13.790 -15.042 1.00 90.68 58 A 1 ATOM 464 N N . SER A 0 59 . -8.267 11.006 -19.016 1.00 90.62 59 A 1 ATOM 465 C CA . SER A 0 59 . -7.539 10.319 -20.113 1.00 90.62 59 A 1 ATOM 466 C C . SER A 0 59 . -6.445 9.319 -19.706 1.00 90.62 59 A 1 ATOM 467 C CB . SER A 0 59 . -7.048 11.311 -21.181 1.00 90.62 59 A 1 ATOM 468 O O . SER A 0 59 . -5.657 8.885 -20.543 1.00 90.62 59 A 1 ATOM 469 O OG . SER A 0 59 . -5.944 12.077 -20.737 1.00 90.62 59 A 1 ATOM 470 N N . ARG A 0 60 . -6.400 8.938 -18.426 1.00 93.67 60 A 1 ATOM 471 C CA . ARG A 0 60 . -5.448 7.973 -17.868 1.00 93.67 60 A 1 ATOM 472 C C . ARG A 0 60 . -6.191 6.750 -17.367 1.00 93.67 60 A 1 ATOM 473 C CB . ARG A 0 60 . -4.667 8.593 -16.698 1.00 93.67 60 A 1 ATOM 474 O O . ARG A 0 60 . -7.294 6.870 -16.839 1.00 93.67 60 A 1 ATOM 475 C CG . ARG A 0 60 . -4.177 10.024 -16.959 1.00 93.67 60 A 1 ATOM 476 C CD . ARG A 0 60 . -3.420 10.575 -15.749 1.00 93.67 60 A 1 ATOM 477 N NE . ARG A 0 60 . -4.318 10.951 -14.630 1.00 93.67 60 A 1 ATOM 478 N NH1 . ARG A 0 60 . -2.753 10.806 -12.985 1.00 93.67 60 A 1 ATOM 479 N NH2 . ARG A 0 60 . -4.756 11.599 -12.453 1.00 93.67 60 A 1 ATOM 480 C CZ . ARG A 0 60 . -3.951 11.125 -13.369 1.00 93.67 60 A 1 ATOM 481 N N . GLU A 0 61 . -5.549 5.597 -17.429 1.00 97.39 61 A 1 ATOM 482 C CA . GLU A 0 61 . -6.047 4.429 -16.713 1.00 97.39 61 A 1 ATOM 483 C C . GLU A 0 61 . -5.801 4.564 -15.203 1.00 97.39 61 A 1 ATOM 484 C CB . GLU A 0 61 . -5.407 3.173 -17.288 1.00 97.39 61 A 1 ATOM 485 O O . GLU A 0 61 . -4.749 5.045 -14.761 1.00 97.39 61 A 1 ATOM 486 C CG . GLU A 0 61 . -6.115 1.913 -16.791 1.00 97.39 61 A 1 ATOM 487 C CD . GLU A 0 61 . -5.463 0.705 -17.438 1.00 97.39 61 A 1 ATOM 488 O OE1 . GLU A 0 61 . -4.259 0.485 -17.190 1.00 97.39 61 A 1 ATOM 489 O OE2 . GLU A 0 61 . -6.115 0.004 -18.238 1.00 97.39 61 A 1 ATOM 490 N N . ALA A 0 62 . -6.785 4.133 -14.425 1.00 98.50 62 A 1 ATOM 491 C CA . ALA A 0 62 . -6.770 4.135 -12.974 1.00 98.50 62 A 1 ATOM 492 C C . ALA A 0 62 . -7.480 2.890 -12.427 1.00 98.50 62 A 1 ATOM 493 C CB . ALA A 0 62 . -7.452 5.424 -12.498 1.00 98.50 62 A 1 ATOM 494 O O . ALA A 0 62 . -8.230 2.219 -13.139 1.00 98.50 62 A 1 ATOM 495 N N . ILE A 0 63 . -7.276 2.619 -11.141 1.00 98.76 63 A 1 ATOM 496 C CA . ILE A 0 63 . -8.103 1.690 -10.367 1.00 98.76 63 A 1 ATOM 497 C C . ILE A 0 63 . -8.852 2.454 -9.282 1.00 98.76 63 A 1 ATOM 498 C CB . ILE A 0 63 . -7.311 0.495 -9.796 1.00 98.76 63 A 1 ATOM 499 O O . ILE A 0 63 . -8.326 3.417 -8.721 1.00 98.76 63 A 1 ATOM 500 C CG1 . ILE A 0 63 . -6.116 0.962 -8.941 1.00 98.76 63 A 1 ATOM 501 C CG2 . ILE A 0 63 . -6.902 -0.447 -10.938 1.00 98.76 63 A 1 ATOM 502 C CD1 . ILE A 0 63 . -5.324 -0.168 -8.280 1.00 98.76 63 A 1 ATOM 503 N N . ARG A 0 64 . -10.077 2.028 -8.980 1.00 98.71 64 A 1 ATOM 504 C CA . ARG A 0 64 . -10.925 2.650 -7.962 1.00 98.71 64 A 1 ATOM 505 C C . ARG A 0 64 . -11.526 1.611 -7.025 1.00 98.71 64 A 1 ATOM 506 C CB . ARG A 0 64 . -12.008 3.487 -8.657 1.00 98.71 64 A 1 ATOM 507 O O . ARG A 0 64 . -11.877 0.523 -7.468 1.00 98.71 64 A 1 ATOM 508 C CG . ARG A 0 64 . -12.716 4.422 -7.672 1.00 98.71 64 A 1 ATOM 509 C CD . ARG A 0 64 . -13.786 5.261 -8.359 1.00 98.71 64 A 1 ATOM 510 N NE . ARG A 0 64 . -14.230 6.336 -7.455 1.00 98.71 64 A 1 ATOM 511 N NH1 . ARG A 0 64 . -15.270 7.633 -9.027 1.00 98.71 64 A 1 ATOM 512 N NH2 . ARG A 0 64 . -15.135 8.348 -6.910 1.00 98.71 64 A 1 ATOM 513 C CZ . ARG A 0 64 . -14.875 7.432 -7.800 1.00 98.71 64 A 1 ATOM 514 N N . ARG A 0 65 . -11.688 1.964 -5.751 1.00 98.53 65 A 1 ATOM 515 C CA . ARG A 0 65 . -12.445 1.180 -4.769 1.00 98.53 65 A 1 ATOM 516 C C . ARG A 0 65 . -13.152 2.094 -3.772 1.00 98.53 65 A 1 ATOM 517 C CB . ARG A 0 65 . -11.494 0.183 -4.079 1.00 98.53 65 A 1 ATOM 518 O O . ARG A 0 65 . -12.621 3.134 -3.388 1.00 98.53 65 A 1 ATOM 519 C CG . ARG A 0 65 . -12.145 -0.725 -3.025 1.00 98.53 65 A 1 ATOM 520 C CD . ARG A 0 65 . -13.167 -1.691 -3.622 1.00 98.53 65 A 1 ATOM 521 N NE . ARG A 0 65 . -14.027 -2.286 -2.585 1.00 98.53 65 A 1 ATOM 522 N NH1 . ARG A 0 65 . -15.773 -2.838 -3.957 1.00 98.53 65 A 1 ATOM 523 N NH2 . ARG A 0 65 . -15.894 -3.314 -1.768 1.00 98.53 65 A 1 ATOM 524 C CZ . ARG A 0 65 . -15.226 -2.805 -2.769 1.00 98.53 65 A 1 ATOM 525 N N . SER A 0 66 . -14.343 1.685 -3.350 1.00 98.61 66 A 1 ATOM 526 C CA . SER A 0 66 . -15.107 2.312 -2.272 1.00 98.61 66 A 1 ATOM 527 C C . SER A 0 66 . -15.063 1.428 -1.032 1.00 98.61 66 A 1 ATOM 528 C CB . SER A 0 66 . -16.561 2.509 -2.695 1.00 98.61 66 A 1 ATOM 529 O O . SER A 0 66 . -15.257 0.220 -1.141 1.00 98.61 66 A 1 ATOM 530 O OG . SER A 0 66 . -16.640 3.321 -3.846 1.00 98.61 66 A 1 ATOM 531 N N . PHE A 0 67 . -14.850 2.036 0.130 1.00 98.71 67 A 1 ATOM 532 C CA . PHE A 0 67 . -14.828 1.365 1.427 1.00 98.71 67 A 1 ATOM 533 C C . PHE A 0 67 . -15.886 1.971 2.344 1.00 98.71 67 A 1 ATOM 534 C CB . PHE A 0 67 . -13.432 1.501 2.045 1.00 98.71 67 A 1 ATOM 535 O O . PHE A 0 67 . -16.024 3.199 2.403 1.00 98.71 67 A 1 ATOM 536 C CG . PHE A 0 67 . -12.328 0.873 1.219 1.00 98.71 67 A 1 ATOM 537 C CD1 . PHE A 0 67 . -12.033 -0.495 1.365 1.00 98.71 67 A 1 ATOM 538 C CD2 . PHE A 0 67 . -11.615 1.648 0.285 1.00 98.71 67 A 1 ATOM 539 C CE1 . PHE A 0 67 . -11.015 -1.081 0.593 1.00 98.71 67 A 1 ATOM 540 C CE2 . PHE A 0 67 . -10.603 1.058 -0.492 1.00 98.71 67 A 1 ATOM 541 C CZ . PHE A 0 67 . -10.297 -0.304 -0.329 1.00 98.71 67 A 1 ATOM 542 N N . LEU A 0 68 . -16.619 1.119 3.061 1.00 98.63 68 A 1 ATOM 543 C CA . LEU A 0 68 . -17.602 1.529 4.059 1.00 98.63 68 A 1 ATOM 544 C C . LEU A 0 68 . -17.172 1.081 5.458 1.00 98.63 68 A 1 ATOM 545 C CB . LEU A 0 68 . -18.972 0.959 3.666 1.00 98.63 68 A 1 ATOM 546 O O . LEU A 0 68 . -16.952 -0.102 5.705 1.00 98.63 68 A 1 ATOM 547 C CG . LEU A 0 68 . -20.134 1.491 4.522 1.00 98.63 68 A 1 ATOM 548 C CD1 . LEU A 0 68 . -20.449 2.950 4.180 1.00 98.63 68 A 1 ATOM 549 C CD2 . LEU A 0 68 . -21.391 0.658 4.263 1.00 98.63 68 A 1 ATOM 550 N N . PHE A 0 69 . -17.115 2.027 6.387 1.00 98.69 69 A 1 ATOM 551 C CA . PHE A 0 69 . -16.720 1.812 7.776 1.00 98.69 69 A 1 ATOM 552 C C . PHE A 0 69 . -17.913 1.937 8.725 1.00 98.69 69 A 1 ATOM 553 C CB . PHE A 0 69 . -15.587 2.786 8.123 1.00 98.69 69 A 1 ATOM 554 O O . PHE A 0 69 . -19.029 2.294 8.332 1.00 98.69 69 A 1 ATOM 555 C CG . PHE A 0 69 . -14.364 2.584 7.254 1.00 98.69 69 A 1 ATOM 556 C CD1 . PHE A 0 69 . -13.433 1.580 7.578 1.00 98.69 69 A 1 ATOM 557 C CD2 . PHE A 0 69 . -14.188 3.351 6.086 1.00 98.69 69 A 1 ATOM 558 C CE1 . PHE A 0 69 . -12.328 1.353 6.744 1.00 98.69 69 A 1 ATOM 559 C CE2 . PHE A 0 69 . -13.094 3.105 5.240 1.00 98.69 69 A 1 ATOM 560 C CZ . PHE A 0 69 . -12.174 2.095 5.564 1.00 98.69 69 A 1 ATOM 561 N N . LYS A 0 70 . -17.680 1.632 10.002 1.00 98.43 70 A 1 ATOM 562 C CA . LYS A 0 70 . -18.690 1.751 11.058 1.00 98.43 70 A 1 ATOM 563 C C . LYS A 0 70 . -19.164 3.197 11.244 1.00 98.43 70 A 1 ATOM 564 C CB . LYS A 0 70 . -18.083 1.191 12.348 1.00 98.43 70 A 1 ATOM 565 O O . LYS A 0 70 . -20.363 3.442 11.331 1.00 98.43 70 A 1 ATOM 566 C CG . LYS A 0 70 . -19.082 1.201 13.509 1.00 98.43 70 A 1 ATOM 567 C CD . LYS A 0 70 . -18.359 0.808 14.795 1.00 98.43 70 A 1 ATOM 568 C CE . LYS A 0 70 . -19.293 1.010 15.985 1.00 98.43 70 A 1 ATOM 569 N NZ . LYS A 0 70 . -18.504 1.087 17.232 1.00 98.43 70 A 1 ATOM 570 N N . ASP A 0 71 . -18.223 4.129 11.300 1.00 98.60 71 A 1 ATOM 571 C CA . ASP A 0 71 . -18.425 5.546 11.587 1.00 98.60 71 A 1 ATOM 572 C C . ASP A 0 71 . -17.265 6.369 10.990 1.00 98.60 71 A 1 ATOM 573 C CB . ASP A 0 71 . -18.582 5.741 13.112 1.00 98.60 71 A 1 ATOM 574 O O . ASP A 0 71 . -16.406 5.842 10.274 1.00 98.60 71 A 1 ATOM 575 C CG . ASP A 0 71 . -17.472 5.072 13.931 1.00 98.60 71 A 1 ATOM 576 O OD1 . ASP A 0 71 . -16.301 5.209 13.513 1.00 98.60 71 A 1 ATOM 577 O OD2 . ASP A 0 71 . -17.814 4.366 14.912 1.00 98.60 71 A 1 ATOM 578 N N . PHE A 0 72 . -17.281 7.680 11.226 1.00 98.65 72 A 1 ATOM 579 C CA . PHE A 0 72 . -16.256 8.595 10.726 1.00 98.65 72 A 1 ATOM 580 C C . PHE A 0 72 . -14.888 8.381 11.381 1.00 98.65 72 A 1 ATOM 581 C CB . PHE A 0 72 . -16.734 10.032 10.942 1.00 98.65 72 A 1 ATOM 582 O O . PHE A 0 72 . -13.879 8.478 10.687 1.00 98.65 72 A 1 ATOM 583 C CG . PHE A 0 72 . -15.727 11.088 10.537 1.00 98.65 72 A 1 ATOM 584 C CD1 . PHE A 0 72 . -14.981 11.768 11.518 1.00 98.65 72 A 1 ATOM 585 C CD2 . PHE A 0 72 . -15.501 11.363 9.176 1.00 98.65 72 A 1 ATOM 586 C CE1 . PHE A 0 72 . -14.033 12.732 11.134 1.00 98.65 72 A 1 ATOM 587 C CE2 . PHE A 0 72 . -14.554 12.326 8.792 1.00 98.65 72 A 1 ATOM 588 C CZ . PHE A 0 72 . -13.821 13.014 9.773 1.00 98.65 72 A 1 ATOM 589 N N . ASP A 0 73 . -14.840 8.061 12.675 1.00 98.59 73 A 1 ATOM 590 C CA . ASP A 0 73 . -13.574 7.914 13.398 1.00 98.59 73 A 1 ATOM 591 C C . ASP A 0 73 . -12.762 6.746 12.822 1.00 98.59 73 A 1 ATOM 592 C CB . ASP A 0 73 . -13.836 7.738 14.905 1.00 98.59 73 A 1 ATOM 593 O O . ASP A 0 73 . -11.589 6.912 12.481 1.00 98.59 73 A 1 ATOM 594 C CG . ASP A 0 73 . -14.434 8.981 15.583 1.00 98.59 73 A 1 ATOM 595 O OD1 . ASP A 0 73 . -14.290 10.098 15.032 1.00 98.59 73 A 1 ATOM 596 O OD2 . ASP A 0 73 . -15.050 8.808 16.659 1.00 98.59 73 A 1 ATOM 597 N N . VAL A 0 74 . -13.413 5.598 12.583 1.00 98.68 74 A 1 ATOM 598 C CA . VAL A 0 74 . -12.769 4.438 11.944 1.00 98.68 74 A 1 ATOM 599 C C . VAL A 0 74 . -12.338 4.753 10.506 1.00 98.68 74 A 1 ATOM 600 C CB . VAL A 0 74 . -13.692 3.204 11.986 1.00 98.68 74 A 1 ATOM 601 O O . VAL A 0 74 . -11.228 4.400 10.103 1.00 98.68 74 A 1 ATOM 602 C CG1 . VAL A 0 74 . -13.047 1.983 11.316 1.00 98.68 74 A 1 ATOM 603 C CG2 . VAL A 0 74 . -14.015 2.778 13.425 1.00 98.68 74 A 1 ATOM 604 N N . ALA A 0 75 . -13.179 5.445 9.726 1.00 98.82 75 A 1 ATOM 605 C CA . ALA A 0 75 . -12.831 5.842 8.360 1.00 98.82 75 A 1 ATOM 606 C C . ALA A 0 75 . -11.603 6.768 8.326 1.00 98.82 75 A 1 ATOM 607 C CB . ALA A 0 75 . -14.047 6.521 7.715 1.00 98.82 75 A 1 ATOM 608 O O . ALA A 0 75 . -10.715 6.607 7.486 1.00 98.82 75 A 1 ATOM 609 N N . PHE A 0 76 . -11.526 7.722 9.254 1.00 98.77 76 A 1 ATOM 610 C CA . PHE A 0 76 . -10.422 8.668 9.327 1.00 98.77 76 A 1 ATOM 611 C C . PHE A 0 76 . -9.126 8.012 9.829 1.00 98.77 76 A 1 ATOM 612 C CB . PHE A 0 76 . -10.842 9.864 10.186 1.00 98.77 76 A 1 ATOM 613 O O . PHE A 0 76 . -8.044 8.335 9.335 1.00 98.77 76 A 1 ATOM 614 C CG . PHE A 0 76 . -9.962 11.074 9.963 1.00 98.77 76 A 1 ATOM 615 C CD1 . PHE A 0 76 . -8.910 11.366 10.849 1.00 98.77 76 A 1 ATOM 616 C CD2 . PHE A 0 76 . -10.188 11.899 8.846 1.00 98.77 76 A 1 ATOM 617 C CE1 . PHE A 0 76 . -8.088 12.485 10.621 1.00 98.77 76 A 1 ATOM 618 C CE2 . PHE A 0 76 . -9.367 13.016 8.616 1.00 98.77 76 A 1 ATOM 619 C CZ . PHE A 0 76 . -8.318 13.310 9.504 1.00 98.77 76 A 1 ATOM 620 N N . ASP A 0 77 . -9.206 7.047 10.749 1.00 98.73 77 A 1 ATOM 621 C CA . ASP A 0 77 . -8.058 6.236 11.174 1.00 98.73 77 A 1 ATOM 622 C C . ASP A 0 77 . -7.467 5.419 10.018 1.00 98.73 77 A 1 ATOM 623 C CB . ASP A 0 77 . -8.448 5.331 12.352 1.00 98.73 77 A 1 ATOM 624 O O . ASP A 0 77 . -6.253 5.462 9.784 1.00 98.73 77 A 1 ATOM 625 C CG . ASP A 0 77 . -8.513 6.051 13.703 1.00 98.73 77 A 1 ATOM 626 O OD1 . ASP A 0 77 . -8.002 7.195 13.800 1.00 98.73 77 A 1 ATOM 627 O OD2 . ASP A 0 77 . -8.917 5.400 14.685 1.00 98.73 77 A 1 ATOM 628 N N . PHE A 0 78 . -8.323 4.774 9.225 1.00 98.83 78 A 1 ATOM 629 C CA . PHE A 0 78 . -7.927 4.121 7.979 1.00 98.83 78 A 1 ATOM 630 C C . PHE A 0 78 . -7.227 5.093 7.016 1.00 98.83 78 A 1 ATOM 631 C CB . PHE A 0 78 . -9.176 3.497 7.352 1.00 98.83 78 A 1 ATOM 632 O O . PHE A 0 78 . -6.151 4.795 6.489 1.00 98.83 78 A 1 ATOM 633 C CG . PHE A 0 78 . -9.028 3.115 5.896 1.00 98.83 78 A 1 ATOM 634 C CD1 . PHE A 0 78 . -9.573 3.946 4.899 1.00 98.83 78 A 1 ATOM 635 C CD2 . PHE A 0 78 . -8.402 1.907 5.542 1.00 98.83 78 A 1 ATOM 636 C CE1 . PHE A 0 78 . -9.573 3.525 3.560 1.00 98.83 78 A 1 ATOM 637 C CE2 . PHE A 0 78 . -8.385 1.495 4.199 1.00 98.83 78 A 1 ATOM 638 C CZ . PHE A 0 78 . -9.014 2.282 3.219 1.00 98.83 78 A 1 ATOM 639 N N . MET A 0 79 . -7.782 6.294 6.830 1.00 98.86 79 A 1 ATOM 640 C CA . MET A 0 79 . -7.179 7.324 5.981 1.00 98.86 79 A 1 ATOM 641 C C . MET A 0 79 . -5.799 7.770 6.490 1.00 98.86 79 A 1 ATOM 642 C CB . MET A 0 79 . -8.124 8.526 5.858 1.00 98.86 79 A 1 ATOM 643 O O . MET A 0 79 . -4.871 7.895 5.688 1.00 98.86 79 A 1 ATOM 644 C CG . MET A 0 79 . -9.341 8.227 4.977 1.00 98.86 79 A 1 ATOM 645 S SD . MET A 0 79 . -10.581 9.550 4.959 1.00 98.86 79 A 1 ATOM 646 C CE . MET A 0 79 . -9.693 10.821 4.025 1.00 98.86 79 A 1 ATOM 647 N N . LYS A 0 80 . -5.614 7.961 7.805 1.00 98.75 80 A 1 ATOM 648 C CA . LYS A 0 80 . -4.300 8.296 8.391 1.00 98.75 80 A 1 ATOM 649 C C . LYS A 0 80 . -3.253 7.232 8.067 1.00 98.75 80 A 1 ATOM 650 C CB . LYS A 0 80 . -4.402 8.462 9.913 1.00 98.75 80 A 1 ATOM 651 O O . LYS A 0 80 . -2.157 7.577 7.626 1.00 98.75 80 A 1 ATOM 652 C CG . LYS A 0 80 . -5.058 9.786 10.336 1.00 98.75 80 A 1 ATOM 653 C CD . LYS A 0 80 . -5.080 9.956 11.864 1.00 98.75 80 A 1 ATOM 654 C CE . LYS A 0 80 . -5.917 8.847 12.507 1.00 98.75 80 A 1 ATOM 655 N NZ . LYS A 0 80 . -6.072 8.971 13.973 1.00 98.75 80 A 1 ATOM 656 N N . LYS A 0 81 . -3.607 5.950 8.196 1.00 98.71 81 A 1 ATOM 657 C CA . LYS A 0 81 . -2.710 4.832 7.869 1.00 98.71 81 A 1 ATOM 658 C C . LYS A 0 81 . -2.269 4.855 6.401 1.00 98.71 81 A 1 ATOM 659 C CB . LYS A 0 81 . -3.419 3.528 8.258 1.00 98.71 81 A 1 ATOM 660 O O . LYS A 0 81 . -1.091 4.664 6.095 1.00 98.71 81 A 1 ATOM 661 C CG . LYS A 0 81 . -2.497 2.311 8.119 1.00 98.71 81 A 1 ATOM 662 C CD . LYS A 0 81 . -3.119 1.100 8.815 1.00 98.71 81 A 1 ATOM 663 C CE . LYS A 0 81 . -2.179 -0.102 8.853 1.00 98.71 81 A 1 ATOM 664 N NZ . LYS A 0 81 . -2.283 -0.796 10.154 1.00 98.71 81 A 1 ATOM 665 N N . ILE A 0 82 . -3.189 5.161 5.484 1.00 98.79 82 A 1 ATOM 666 C CA . ILE A 0 82 . -2.870 5.340 4.059 1.00 98.79 82 A 1 ATOM 667 C C . ILE A 0 82 . -1.969 6.555 3.841 1.00 98.79 82 A 1 ATOM 668 C CB . ILE A 0 82 . -4.156 5.447 3.219 1.00 98.79 82 A 1 ATOM 669 O O . ILE A 0 82 . -1.018 6.467 3.063 1.00 98.79 82 A 1 ATOM 670 C CG1 . ILE A 0 82 . -4.919 4.114 3.303 1.00 98.79 82 A 1 ATOM 671 C CG2 . ILE A 0 82 . -3.836 5.792 1.747 1.00 98.79 82 A 1 ATOM 672 C CD1 . ILE A 0 82 . -6.326 4.191 2.715 1.00 98.79 82 A 1 ATOM 673 N N . ALA A 0 83 . -2.227 7.676 4.517 1.00 98.78 83 A 1 ATOM 674 C CA . ALA A 0 83 . -1.428 8.892 4.382 1.00 98.78 83 A 1 ATOM 675 C C . ALA A 0 83 . 0.035 8.670 4.807 1.00 98.78 83 A 1 ATOM 676 C CB . ALA A 0 83 . -2.094 10.014 5.189 1.00 98.78 83 A 1 ATOM 677 O O . ALA A 0 83 . 0.956 9.107 4.112 1.00 98.78 83 A 1 ATOM 678 N N . GLU A 0 84 . 0.266 7.931 5.895 1.00 98.69 84 A 1 ATOM 679 C CA . GLU A 0 84 . 1.608 7.551 6.347 1.00 98.69 84 A 1 ATOM 680 C C . GLU A 0 84 . 2.342 6.702 5.305 1.00 98.69 84 A 1 ATOM 681 C CB . GLU A 0 84 . 1.516 6.781 7.668 1.00 98.69 84 A 1 ATOM 682 O O . GLU A 0 84 . 3.478 7.014 4.931 1.00 98.69 84 A 1 ATOM 683 C CG . GLU A 0 84 . 1.120 7.694 8.836 1.00 98.69 84 A 1 ATOM 684 C CD . GLU A 0 84 . 0.959 6.935 10.160 1.00 98.69 84 A 1 ATOM 685 O OE1 . GLU A 0 84 . 0.753 7.634 11.177 1.00 98.69 84 A 1 ATOM 686 O OE2 . GLU A 0 84 . 1.074 5.688 10.153 1.00 98.69 84 A 1 ATOM 687 N N . LYS A 0 85 . 1.679 5.674 4.762 1.00 98.62 85 A 1 ATOM 688 C CA . LYS A 0 85 . 2.259 4.841 3.701 1.00 98.62 85 A 1 ATOM 689 C C . LYS A 0 85 . 2.533 5.638 2.428 1.00 98.62 85 A 1 ATOM 690 C CB . LYS A 0 85 . 1.325 3.660 3.422 1.00 98.62 85 A 1 ATOM 691 O O . LYS A 0 85 . 3.604 5.497 1.837 1.00 98.62 85 A 1 ATOM 692 C CG . LYS A 0 85 . 1.890 2.681 2.382 1.00 98.62 85 A 1 ATOM 693 C CD . LYS A 0 85 . 3.153 1.964 2.878 1.00 98.62 85 A 1 ATOM 694 C CE . LYS A 0 85 . 3.540 0.873 1.879 1.00 98.62 85 A 1 ATOM 695 N NZ . LYS A 0 85 . 4.700 0.082 2.352 1.00 98.62 85 A 1 ATOM 696 N N . SER A 0 86 . 1.599 6.502 2.042 1.00 98.56 86 A 1 ATOM 697 C CA . SER A 0 86 . 1.690 7.355 0.854 1.00 98.56 86 A 1 ATOM 698 C C . SER A 0 86 . 2.900 8.284 0.926 1.00 98.56 86 A 1 ATOM 699 C CB . SER A 0 86 . 0.421 8.200 0.712 1.00 98.56 86 A 1 ATOM 700 O O . SER A 0 86 . 3.650 8.407 -0.045 1.00 98.56 86 A 1 ATOM 701 O OG . SER A 0 86 . -0.713 7.375 0.545 1.00 98.56 86 A 1 ATOM 702 N N . LYS A 0 87 . 3.158 8.862 2.109 1.00 98.26 87 A 1 ATOM 703 C CA . LYS A 0 87 . 4.344 9.684 2.380 1.00 98.26 87 A 1 ATOM 704 C C . LYS A 0 87 . 5.639 8.895 2.186 1.00 98.26 87 A 1 ATOM 705 C CB . LYS A 0 87 . 4.232 10.253 3.803 1.00 98.26 87 A 1 ATOM 706 O O . LYS A 0 87 . 6.562 9.400 1.553 1.00 98.26 87 A 1 ATOM 707 C CG . LYS A 0 87 . 5.420 11.150 4.181 1.00 98.26 87 A 1 ATOM 708 C CD . LYS A 0 87 . 5.265 11.648 5.621 1.00 98.26 87 A 1 ATOM 709 C CE . LYS A 0 87 . 6.479 12.489 6.028 1.00 98.26 87 A 1 ATOM 710 N NZ . LYS A 0 87 . 6.371 12.924 7.443 1.00 98.26 87 A 1 ATOM 711 N N . VAL A 0 88 . 5.708 7.663 2.698 1.00 98.05 88 A 1 ATOM 712 C CA . VAL A 0 88 . 6.885 6.787 2.540 1.00 98.05 88 A 1 ATOM 713 C C . VAL A 0 88 . 7.102 6.403 1.074 1.00 98.05 88 A 1 ATOM 714 C CB . VAL A 0 88 . 6.754 5.530 3.424 1.00 98.05 88 A 1 ATOM 715 O O . VAL A 0 88 . 8.232 6.418 0.593 1.00 98.05 88 A 1 ATOM 716 C CG1 . VAL A 0 88 . 7.884 4.517 3.186 1.00 98.05 88 A 1 ATOM 717 C CG2 . VAL A 0 88 . 6.789 5.907 4.910 1.00 98.05 88 A 1 ATOM 718 N N . MET A 0 89 . 6.029 6.088 0.347 1.00 97.25 89 A 1 ATOM 719 C CA . MET A 0 89 . 6.090 5.712 -1.071 1.00 97.25 89 A 1 ATOM 720 C C . MET A 0 89 . 6.290 6.907 -2.012 1.00 97.25 89 A 1 ATOM 721 C CB . MET A 0 89 . 4.807 4.961 -1.451 1.00 97.25 89 A 1 ATOM 722 O O . MET A 0 89 . 6.584 6.710 -3.193 1.00 97.25 89 A 1 ATOM 723 C CG . MET A 0 89 . 4.727 3.595 -0.764 1.00 97.25 89 A 1 ATOM 724 S SD . MET A 0 89 . 3.229 2.649 -1.143 1.00 97.25 89 A 1 ATOM 725 C CE . MET A 0 89 . 3.449 2.319 -2.913 1.00 97.25 89 A 1 ATOM 726 N N . ASN A 0 90 . 6.095 8.133 -1.515 1.00 97.16 90 A 1 ATOM 727 C CA . ASN A 0 90 . 5.923 9.334 -2.327 1.00 97.16 90 A 1 ATOM 728 C C . ASN A 0 90 . 4.926 9.091 -3.483 1.00 97.16 90 A 1 ATOM 729 C CB . ASN A 0 90 . 7.303 9.860 -2.741 1.00 97.16 90 A 1 ATOM 730 O O . ASN A 0 90 . 5.200 9.378 -4.654 1.00 97.16 90 A 1 ATOM 731 C CG . ASN A 0 90 . 7.202 11.198 -3.443 1.00 97.16 90 A 1 ATOM 732 N ND2 . ASN A 0 90 . 7.910 11.374 -4.533 1.00 97.16 90 A 1 ATOM 733 O OD1 . ASN A 0 90 . 6.489 12.103 -3.046 1.00 97.16 90 A 1 ATOM 734 N N . HIS A 0 91 . 3.790 8.482 -3.137 1.00 97.64 91 A 1 ATOM 735 C CA . HIS A 0 91 . 2.701 8.120 -4.040 1.00 97.64 91 A 1 ATOM 736 C C . HIS A 0 91 . 1.390 8.304 -3.293 1.00 97.64 91 A 1 ATOM 737 C CB . HIS A 0 91 . 2.850 6.667 -4.504 1.00 97.64 91 A 1 ATOM 738 O O . HIS A 0 91 . 1.209 7.691 -2.248 1.00 97.64 91 A 1 ATOM 739 C CG . HIS A 0 91 . 1.931 6.373 -5.657 1.00 97.64 91 A 1 ATOM 740 C CD2 . HIS A 0 91 . 0.980 5.396 -5.717 1.00 97.64 91 A 1 ATOM 741 N ND1 . HIS A 0 91 . 1.900 7.127 -6.832 1.00 97.64 91 A 1 ATOM 742 C CE1 . HIS A 0 91 . 0.909 6.599 -7.567 1.00 97.64 91 A 1 ATOM 743 N NE2 . HIS A 0 91 . 0.356 5.560 -6.932 1.00 97.64 91 A 1 ATOM 744 N N . HIS A 0 92 . 0.519 9.180 -3.779 1.00 98.40 92 A 1 ATOM 745 C CA . HIS A 0 92 . -0.635 9.654 -3.019 1.00 98.40 92 A 1 ATOM 746 C C . HIS A 0 92 . -1.927 9.273 -3.746 1.00 98.40 92 A 1 ATOM 747 C CB . HIS A 0 92 . -0.535 11.173 -2.801 1.00 98.40 92 A 1 ATOM 748 O O . HIS A 0 92 . -1.967 9.401 -4.972 1.00 98.40 92 A 1 ATOM 749 C CG . HIS A 0 92 . 0.757 11.615 -2.155 1.00 98.40 92 A 1 ATOM 750 C CD2 . HIS A 0 92 . 0.984 11.821 -0.820 1.00 98.40 92 A 1 ATOM 751 N ND1 . HIS A 0 92 . 1.943 11.869 -2.807 1.00 98.40 92 A 1 ATOM 752 C CE1 . HIS A 0 92 . 2.863 12.211 -1.891 1.00 98.40 92 A 1 ATOM 753 N NE2 . HIS A 0 92 . 2.324 12.199 -0.662 1.00 98.40 92 A 1 ATOM 754 N N . PRO A 0 93 . -2.969 8.825 -3.026 1.00 98.62 93 A 1 ATOM 755 C CA . PRO A 0 93 . -4.261 8.556 -3.633 1.00 98.62 93 A 1 ATOM 756 C C . PRO A 0 93 . -4.969 9.855 -4.019 1.00 98.62 93 A 1 ATOM 757 C CB . PRO A 0 93 . -5.054 7.792 -2.569 1.00 98.62 93 A 1 ATOM 758 O O . PRO A 0 93 . -4.787 10.900 -3.392 1.00 98.62 93 A 1 ATOM 759 C CG . PRO A 0 93 . -4.510 8.366 -1.262 1.00 98.62 93 A 1 ATOM 760 C CD . PRO A 0 93 . -3.035 8.603 -1.585 1.00 98.62 93 A 1 ATOM 761 N N . GLU A 0 94 . -5.864 9.752 -4.992 1.00 98.38 94 A 1 ATOM 762 C CA . GLU A 0 94 . -6.990 10.669 -5.100 1.00 98.38 94 A 1 ATOM 763 C C . GLU A 0 94 . -8.143 10.056 -4.299 1.00 98.38 94 A 1 ATOM 764 C CB . GLU A 0 94 . -7.369 10.880 -6.571 1.00 98.38 94 A 1 ATOM 765 O O . GLU A 0 94 . -8.488 8.892 -4.502 1.00 98.38 94 A 1 ATOM 766 C CG . GLU A 0 94 . -6.264 11.554 -7.408 1.00 98.38 94 A 1 ATOM 767 C CD . GLU A 0 94 . -6.681 11.749 -8.878 1.00 98.38 94 A 1 ATOM 768 O OE1 . GLU A 0 94 . -5.791 11.747 -9.771 1.00 98.38 94 A 1 ATOM 769 O OE2 . GLU A 0 94 . -7.901 11.915 -9.110 1.00 98.38 94 A 1 ATOM 770 N N . TRP A 0 95 . -8.739 10.791 -3.364 1.00 98.31 95 A 1 ATOM 771 C CA . TRP A 0 95 . -9.840 10.248 -2.568 1.00 98.31 95 A 1 ATOM 772 C C . TRP A 0 95 . -10.948 11.256 -2.291 1.00 98.31 95 A 1 ATOM 773 C CB . TRP A 0 95 . -9.314 9.572 -1.290 1.00 98.31 95 A 1 ATOM 774 O O . TRP A 0 95 . -10.757 12.471 -2.345 1.00 98.31 95 A 1 ATOM 775 C CG . TRP A 0 95 . -8.582 10.410 -0.283 1.00 98.31 95 A 1 ATOM 776 C CD1 . TRP A 0 95 . -8.483 11.761 -0.249 1.00 98.31 95 A 1 ATOM 777 C CD2 . TRP A 0 95 . -7.801 9.939 0.857 1.00 98.31 95 A 1 ATOM 778 C CE2 . TRP A 0 95 . -7.255 11.073 1.531 1.00 98.31 95 A 1 ATOM 779 C CE3 . TRP A 0 95 . -7.490 8.668 1.383 1.00 98.31 95 A 1 ATOM 780 N NE1 . TRP A 0 95 . -7.721 12.155 0.827 1.00 98.31 95 A 1 ATOM 781 C CH2 . TRP A 0 95 . -6.125 9.680 3.140 1.00 98.31 95 A 1 ATOM 782 C CZ2 . TRP A 0 95 . -6.434 10.960 2.658 1.00 98.31 95 A 1 ATOM 783 C CZ3 . TRP A 0 95 . -6.658 8.541 2.510 1.00 98.31 95 A 1 ATOM 784 N N . PHE A 0 96 . -12.123 10.726 -1.982 1.00 98.61 96 A 1 ATOM 785 C CA . PHE A 0 96 . -13.286 11.468 -1.529 1.00 98.61 96 A 1 ATOM 786 C C . PHE A 0 96 . -13.858 10.762 -0.302 1.00 98.61 96 A 1 ATOM 787 C CB . PHE A 0 96 . -14.293 11.560 -2.679 1.00 98.61 96 A 1 ATOM 788 O O . PHE A 0 96 . -14.029 9.545 -0.309 1.00 98.61 96 A 1 ATOM 789 C CG . PHE A 0 96 . -15.596 12.235 -2.313 1.00 98.61 96 A 1 ATOM 790 C CD1 . PHE A 0 96 . -16.765 11.471 -2.141 1.00 98.61 96 A 1 ATOM 791 C CD2 . PHE A 0 96 . -15.640 13.633 -2.155 1.00 98.61 96 A 1 ATOM 792 C CE1 . PHE A 0 96 . -17.982 12.110 -1.852 1.00 98.61 96 A 1 ATOM 793 C CE2 . PHE A 0 96 . -16.853 14.268 -1.840 1.00 98.61 96 A 1 ATOM 794 C CZ . PHE A 0 96 . -18.026 13.507 -1.700 1.00 98.61 96 A 1 ATOM 795 N N . ASN A 0 97 . -14.139 11.515 0.758 1.00 98.69 97 A 1 ATOM 796 C CA . ASN A 0 97 . -14.704 10.979 1.989 1.00 98.69 97 A 1 ATOM 797 C C . ASN A 0 97 . -15.980 11.735 2.358 1.00 98.69 97 A 1 ATOM 798 C CB . ASN A 0 97 . -13.643 10.993 3.105 1.00 98.69 97 A 1 ATOM 799 O O . ASN A 0 97 . -16.019 12.964 2.317 1.00 98.69 97 A 1 ATOM 800 C CG . ASN A 0 97 . -14.231 10.724 4.483 1.00 98.69 97 A 1 ATOM 801 N ND2 . ASN A 0 97 . -14.796 9.565 4.722 1.00 98.69 97 A 1 ATOM 802 O OD1 . ASN A 0 97 . -14.245 11.585 5.341 1.00 98.69 97 A 1 ATOM 803 N N . VAL A 0 98 . -17.008 10.979 2.742 1.00 98.68 98 A 1 ATOM 804 C CA . VAL A 0 98 . -18.228 11.494 3.368 1.00 98.68 98 A 1 ATOM 805 C C . VAL A 0 98 . -18.558 10.574 4.529 1.00 98.68 98 A 1 ATOM 806 C CB . VAL A 0 98 . -19.407 11.576 2.379 1.00 98.68 98 A 1 ATOM 807 O O . VAL A 0 98 . -18.965 9.431 4.321 1.00 98.68 98 A 1 ATOM 808 C CG1 . VAL A 0 98 . -20.688 12.076 3.062 1.00 98.68 98 A 1 ATOM 809 C CG2 . VAL A 0 98 . -19.101 12.552 1.244 1.00 98.68 98 A 1 ATOM 810 N N . TYR A 0 99 . -18.382 11.080 5.750 1.00 98.50 99 A 1 ATOM 811 C CA . TYR A 0 99 . -18.623 10.334 6.983 1.00 98.50 99 A 1 ATOM 812 C C . TYR A 0 99 . -17.881 8.982 6.975 1.00 98.50 99 A 1 ATOM 813 C CB . TYR A 0 99 . -20.142 10.275 7.248 1.00 98.50 99 A 1 ATOM 814 O O . TYR A 0 99 . -16.654 8.949 6.916 1.00 98.50 99 A 1 ATOM 815 C CG . TYR A 0 99 . -20.518 9.772 8.627 1.00 98.50 99 A 1 ATOM 816 C CD1 . TYR A 0 99 . -21.236 8.570 8.784 1.00 98.50 99 A 1 ATOM 817 C CD2 . TYR A 0 99 . -20.149 10.521 9.760 1.00 98.50 99 A 1 ATOM 818 C CE1 . TYR A 0 99 . -21.552 8.103 10.074 1.00 98.50 99 A 1 ATOM 819 C CE2 . TYR A 0 99 . -20.458 10.055 11.051 1.00 98.50 99 A 1 ATOM 820 O OH . TYR A 0 99 . -21.464 8.384 12.450 1.00 98.50 99 A 1 ATOM 821 C CZ . TYR A 0 99 . -21.161 8.843 11.209 1.00 98.50 99 A 1 ATOM 822 N N . ASN A 0 100 . -18.605 7.868 6.981 1.00 98.55 100 A 1 ATOM 823 C CA . ASN A 0 100 . -18.057 6.519 7.049 1.00 98.55 100 A 1 ATOM 824 C C . ASN A 0 100 . -17.708 5.907 5.680 1.00 98.55 100 A 1 ATOM 825 C CB . ASN A 0 100 . -19.044 5.648 7.833 1.00 98.55 100 A 1 ATOM 826 O O . ASN A 0 100 . -17.376 4.725 5.618 1.00 98.55 100 A 1 ATOM 827 C CG . ASN A 0 100 . -20.321 5.339 7.071 1.00 98.55 100 A 1 ATOM 828 N ND2 . ASN A 0 100 . -20.894 4.185 7.293 1.00 98.55 100 A 1 ATOM 829 O OD1 . ASN A 0 100 . -20.833 6.132 6.294 1.00 98.55 100 A 1 ATOM 830 N N . LYS A 0 101 . -17.807 6.662 4.579 1.00 98.79 101 A 1 ATOM 831 C CA . LYS A 0 101 . -17.478 6.184 3.230 1.00 98.79 101 A 1 ATOM 832 C C . LYS A 0 101 . -16.196 6.830 2.720 1.00 98.79 101 A 1 ATOM 833 C CB . LYS A 0 101 . -18.663 6.449 2.295 1.00 98.79 101 A 1 ATOM 834 O O . LYS A 0 101 . -16.081 8.056 2.742 1.00 98.79 101 A 1 ATOM 835 C CG . LYS A 0 101 . -18.471 5.730 0.953 1.00 98.79 101 A 1 ATOM 836 C CD . LYS A 0 101 . -19.564 6.120 -0.043 1.00 98.79 101 A 1 ATOM 837 C CE . LYS A 0 101 . -19.378 5.291 -1.317 1.00 98.79 101 A 1 ATOM 838 N NZ . LYS A 0 101 . -19.461 6.119 -2.534 1.00 98.79 101 A 1 ATOM 839 N N . VAL A 0 102 . -15.264 6.029 2.208 1.00 98.85 102 A 1 ATOM 840 C CA . VAL A 0 102 . -14.033 6.506 1.556 1.00 98.85 102 A 1 ATOM 841 C C . VAL A 0 102 . -13.947 5.919 0.148 1.00 98.85 102 A 1 ATOM 842 C CB . VAL A 0 102 . -12.772 6.170 2.381 1.00 98.85 102 A 1 ATOM 843 O O . VAL A 0 102 . -13.844 4.708 -0.027 1.00 98.85 102 A 1 ATOM 844 C CG1 . VAL A 0 102 . -11.542 6.883 1.804 1.00 98.85 102 A 1 ATOM 845 C CG2 . VAL A 0 102 . -12.884 6.612 3.846 1.00 98.85 102 A 1 ATOM 846 N N . ASP A 0 103 . -13.994 6.780 -0.862 1.00 98.75 103 A 1 ATOM 847 C CA . ASP A 0 103 . -13.821 6.433 -2.271 1.00 98.75 103 A 1 ATOM 848 C C . ASP A 0 103 . -12.381 6.758 -2.692 1.00 98.75 103 A 1 ATOM 849 C CB . ASP A 0 103 . -14.839 7.221 -3.116 1.00 98.75 103 A 1 ATOM 850 O O . ASP A 0 103 . -11.999 7.926 -2.682 1.00 98.75 103 A 1 ATOM 851 C CG . ASP A 0 103 . -16.297 6.852 -2.830 1.00 98.75 103 A 1 ATOM 852 O OD1 . ASP A 0 103 . -16.651 5.667 -2.971 1.00 98.75 103 A 1 ATOM 853 O OD2 . ASP A 0 103 . -17.154 7.731 -2.590 1.00 98.75 103 A 1 ATOM 854 N N . ILE A 0 104 . -11.589 5.753 -3.072 1.00 98.82 104 A 1 ATOM 855 C CA . ILE A 0 104 . -10.164 5.892 -3.416 1.00 98.82 104 A 1 ATOM 856 C C . ILE A 0 104 . -9.938 5.581 -4.894 1.00 98.82 104 A 1 ATOM 857 C CB . ILE A 0 104 . -9.273 4.998 -2.518 1.00 98.82 104 A 1 ATOM 858 O O . ILE A 0 104 . -10.440 4.581 -5.404 1.00 98.82 104 A 1 ATOM 859 C CG1 . ILE A 0 104 . -9.410 5.420 -1.040 1.00 98.82 104 A 1 ATOM 860 C CG2 . ILE A 0 104 . -7.802 5.111 -2.969 1.00 98.82 104 A 1 ATOM 861 C CD1 . ILE A 0 104 . -8.792 4.459 -0.020 1.00 98.82 104 A 1 ATOM 862 N N . LEU A 0 105 . -9.141 6.414 -5.558 1.00 98.67 105 A 1 ATOM 863 C CA . LEU A 0 105 . -8.666 6.264 -6.926 1.00 98.67 105 A 1 ATOM 864 C C . LEU A 0 105 . -7.133 6.308 -6.951 1.00 98.67 105 A 1 ATOM 865 C CB . LEU A 0 105 . -9.331 7.359 -7.775 1.00 98.67 105 A 1 ATOM 866 O O . LEU A 0 105 . -6.517 7.184 -6.342 1.00 98.67 105 A 1 ATOM 867 C CG . LEU A 0 105 . -9.006 7.290 -9.277 1.00 98.67 105 A 1 ATOM 868 C CD1 . LEU A 0 105 . -10.187 7.865 -10.059 1.00 98.67 105 A 1 ATOM 869 C CD2 . LEU A 0 105 . -7.764 8.091 -9.681 1.00 98.67 105 A 1 ATOM 870 N N . LEU A 0 106 . -6.521 5.367 -7.671 1.00 98.73 106 A 1 ATOM 871 C CA . LEU A 0 106 . -5.071 5.260 -7.827 1.00 98.73 106 A 1 ATOM 872 C C . LEU A 0 106 . -4.675 5.286 -9.301 1.00 98.73 106 A 1 ATOM 873 C CB . LEU A 0 106 . -4.541 3.985 -7.158 1.00 98.73 106 A 1 ATOM 874 O O . LEU A 0 106 . -5.209 4.539 -10.125 1.00 98.73 106 A 1 ATOM 875 C CG . LEU A 0 106 . -4.878 3.832 -5.667 1.00 98.73 106 A 1 ATOM 876 C CD1 . LEU A 0 106 . -4.329 2.500 -5.178 1.00 98.73 106 A 1 ATOM 877 C CD2 . LEU A 0 106 . -4.264 4.945 -4.824 1.00 98.73 106 A 1 ATOM 878 N N . THR A 0 107 . -3.721 6.154 -9.617 1.00 98.16 107 A 1 ATOM 879 C CA . THR A 0 107 . -3.053 6.251 -10.915 1.00 98.16 107 A 1 ATOM 880 C C . THR A 0 107 . -1.745 7.029 -10.754 1.00 98.16 107 A 1 ATOM 881 C CB . THR A 0 107 . -3.980 6.909 -11.950 1.00 98.16 107 A 1 ATOM 882 O O . THR A 0 107 . -1.626 7.924 -9.912 1.00 98.16 107 A 1 ATOM 883 C CG2 . THR A 0 107 . -4.427 8.318 -11.564 1.00 98.16 107 A 1 ATOM 884 O OG1 . THR A 0 107 . -3.391 6.961 -13.232 1.00 98.16 107 A 1 ATOM 885 N N . SER A 0 108 . -0.747 6.738 -11.584 1.00 97.10 108 A 1 ATOM 886 C CA . SER A 0 108 . 0.547 7.418 -11.542 1.00 97.10 108 A 1 ATOM 887 C C . SER A 0 108 . 0.607 8.558 -12.562 1.00 97.10 108 A 1 ATOM 888 C CB . SER A 0 108 . 1.669 6.403 -11.732 1.00 97.10 108 A 1 ATOM 889 O O . SER A 0 108 . 0.678 8.342 -13.773 1.00 97.10 108 A 1 ATOM 890 O OG . SER A 0 108 . 1.675 5.500 -10.645 1.00 97.10 108 A 1 ATOM 891 N N . HIS A 0 109 . 0.610 9.804 -12.076 1.00 93.78 109 A 1 ATOM 892 C CA . HIS A 0 109 . 0.637 11.016 -12.914 1.00 93.78 109 A 1 ATOM 893 C C . HIS A 0 109 . 1.881 11.126 -13.802 1.00 93.78 109 A 1 ATOM 894 C CB . HIS A 0 109 . 0.572 12.267 -12.024 1.00 93.78 109 A 1 ATOM 895 O O . HIS A 0 109 . 1.793 11.534 -14.956 1.00 93.78 109 A 1 ATOM 896 C CG . HIS A 0 109 . -0.763 12.488 -11.372 1.00 93.78 109 A 1 ATOM 897 C CD2 . HIS A 0 109 . -1.249 11.844 -10.267 1.00 93.78 109 A 1 ATOM 898 N ND1 . HIS A 0 109 . -1.740 13.367 -11.797 1.00 93.78 109 A 1 ATOM 899 C CE1 . HIS A 0 109 . -2.787 13.260 -10.963 1.00 93.78 109 A 1 ATOM 900 N NE2 . HIS A 0 109 . -2.538 12.313 -10.053 1.00 93.78 109 A 1 ATOM 901 N N . ASP A 0 110 . 3.045 10.775 -13.267 1.00 93.20 110 A 1 ATOM 902 C CA . ASP A 0 110 . 4.323 10.835 -13.977 1.00 93.20 110 A 1 ATOM 903 C C . ASP A 0 110 . 4.481 9.722 -15.026 1.00 93.20 110 A 1 ATOM 904 C CB . ASP A 0 110 . 5.472 10.817 -12.955 1.00 93.20 110 A 1 ATOM 905 O O . ASP A 0 110 . 5.176 9.941 -16.022 1.00 93.20 110 A 1 ATOM 906 C CG . ASP A 0 110 . 5.509 9.562 -12.077 1.00 93.20 110 A 1 ATOM 907 O OD1 . ASP A 0 110 . 4.479 8.865 -11.958 1.00 93.20 110 A 1 ATOM 908 O OD2 . ASP A 0 110 . 6.563 9.301 -11.458 1.00 93.20 110 A 1 ATOM 909 N N . ALA A 0 111 . 3.819 8.577 -14.825 1.00 94.78 111 A 1 ATOM 910 C CA . ALA A 0 111 . 3.738 7.468 -15.778 1.00 94.78 111 A 1 ATOM 911 C C . ALA A 0 111 . 2.650 7.673 -16.851 1.00 94.78 111 A 1 ATOM 912 C CB . ALA A 0 111 . 3.485 6.174 -14.996 1.00 94.78 111 A 1 ATOM 913 O O . ALA A 0 111 . 2.800 7.195 -17.972 1.00 94.78 111 A 1 ATOM 914 N N . GLY A 0 112 . 1.574 8.400 -16.523 1.00 94.98 112 A 1 ATOM 915 C CA . GLY A 0 112 . 0.409 8.598 -17.395 1.00 94.98 112 A 1 ATOM 916 C C . GLY A 0 112 . -0.650 7.490 -17.299 1.00 94.98 112 A 1 ATOM 917 O O . GLY A 0 112 . -1.448 7.336 -18.217 1.00 94.98 112 A 1 ATOM 918 N N . GLY A 0 113 . -0.663 6.711 -16.216 1.00 97.29 113 A 1 ATOM 919 C CA . GLY A 0 113 . -1.552 5.560 -16.038 1.00 97.29 113 A 1 ATOM 920 C C . GLY A 0 113 . -1.101 4.677 -14.877 1.00 97.29 113 A 1 ATOM 921 O O . GLY A 0 113 . -0.361 5.135 -14.006 1.00 97.29 113 A 1 ATOM 922 N N . LEU A 0 114 . -1.519 3.411 -14.868 1.00 98.22 114 A 1 ATOM 923 C CA . LEU A 0 114 . -1.152 2.468 -13.811 1.00 98.22 114 A 1 ATOM 924 C C . LEU A 0 114 . 0.337 2.110 -13.843 1.00 98.22 114 A 1 ATOM 925 C CB . LEU A 0 114 . -2.009 1.196 -13.907 1.00 98.22 114 A 1 ATOM 926 O O . LEU A 0 114 . 0.876 1.699 -14.873 1.00 98.22 114 A 1 ATOM 927 C CG . LEU A 0 114 . -3.505 1.416 -13.634 1.00 98.22 114 A 1 ATOM 928 C CD1 . LEU A 0 114 . -4.243 0.089 -13.778 1.00 98.22 114 A 1 ATOM 929 C CD2 . LEU A 0 114 . -3.750 1.943 -12.218 1.00 98.22 114 A 1 ATOM 930 N N . SER A 0 115 . 0.979 2.206 -12.683 1.00 97.88 115 A 1 ATOM 931 C CA . SER A 0 115 . 2.330 1.715 -12.424 1.00 97.88 115 A 1 ATOM 932 C C . SER A 0 115 . 2.351 0.742 -11.248 1.00 97.88 115 A 1 ATOM 933 C CB . SER A 0 115 . 3.292 2.882 -12.180 1.00 97.88 115 A 1 ATOM 934 O O . SER A 0 115 . 1.362 0.562 -10.535 1.00 97.88 115 A 1 ATOM 935 O OG . SER A 0 115 . 3.255 3.352 -10.840 1.00 97.88 115 A 1 ATOM 936 N N . ARG A 0 116 . 3.520 0.152 -10.981 1.00 97.69 116 A 1 ATOM 937 C CA . ARG A 0 116 . 3.718 -0.730 -9.826 1.00 97.69 116 A 1 ATOM 938 C C . ARG A 0 116 . 3.387 -0.056 -8.484 1.00 97.69 116 A 1 ATOM 939 C CB . ARG A 0 116 . 5.153 -1.281 -9.880 1.00 97.69 116 A 1 ATOM 940 O O . ARG A 0 116 . 2.894 -0.727 -7.585 1.00 97.69 116 A 1 ATOM 941 C CG . ARG A 0 116 . 5.457 -2.323 -8.797 1.00 97.69 116 A 1 ATOM 942 C CD . ARG A 0 116 . 4.625 -3.605 -8.931 1.00 97.69 116 A 1 ATOM 943 N NE . ARG A 0 116 . 4.658 -4.337 -7.665 1.00 97.69 116 A 1 ATOM 944 N NH1 . ARG A 0 116 . 4.136 -6.465 -8.359 1.00 97.69 116 A 1 ATOM 945 N NH2 . ARG A 0 116 . 4.468 -6.032 -6.219 1.00 97.69 116 A 1 ATOM 946 C CZ . ARG A 0 116 . 4.433 -5.610 -7.439 1.00 97.69 116 A 1 ATOM 947 N N . ARG A 0 117 . 3.563 1.268 -8.364 1.00 97.95 117 A 1 ATOM 948 C CA . ARG A 0 117 . 3.215 2.010 -7.136 1.00 97.95 117 A 1 ATOM 949 C C . ARG A 0 117 . 1.719 2.011 -6.843 1.00 97.95 117 A 1 ATOM 950 C CB . ARG A 0 117 . 3.697 3.460 -7.209 1.00 97.95 117 A 1 ATOM 951 O O . ARG A 0 117 . 1.347 1.980 -5.675 1.00 97.95 117 A 1 ATOM 952 C CG . ARG A 0 117 . 5.223 3.582 -7.148 1.00 97.95 117 A 1 ATOM 953 C CD . ARG A 0 117 . 5.626 5.057 -7.092 1.00 97.95 117 A 1 ATOM 954 N NE . ARG A 0 117 . 5.295 5.731 -8.353 1.00 97.95 117 A 1 ATOM 955 N NH1 . ARG A 0 117 . 5.887 7.886 -7.791 1.00 97.95 117 A 1 ATOM 956 N NH2 . ARG A 0 117 . 5.339 7.344 -9.885 1.00 97.95 117 A 1 ATOM 957 C CZ . ARG A 0 117 . 5.507 6.990 -8.657 1.00 97.95 117 A 1 ATOM 958 N N . ASP A 0 118 . 0.883 2.029 -7.882 1.00 98.63 118 A 1 ATOM 959 C CA . ASP A 0 118 . -0.572 1.948 -7.729 1.00 98.63 118 A 1 ATOM 960 C C . ASP A 0 118 . -0.973 0.578 -7.177 1.00 98.63 118 A 1 ATOM 961 C CB . ASP A 0 118 . -1.264 2.225 -9.075 1.00 98.63 118 A 1 ATOM 962 O O . ASP A 0 118 . -1.755 0.499 -6.237 1.00 98.63 118 A 1 ATOM 963 C CG . ASP A 0 118 . -0.912 3.611 -9.607 1.00 98.63 118 A 1 ATOM 964 O OD1 . ASP A 0 118 . -1.212 4.594 -8.905 1.00 98.63 118 A 1 ATOM 965 O OD2 . ASP A 0 118 . -0.268 3.719 -10.676 1.00 98.63 118 A 1 ATOM 966 N N . ILE A 0 119 . -0.362 -0.491 -7.696 1.00 98.58 119 A 1 ATOM 967 C CA . ILE A 0 119 . -0.571 -1.867 -7.224 1.00 98.58 119 A 1 ATOM 968 C C . ILE A 0 119 . -0.112 -2.033 -5.772 1.00 98.58 119 A 1 ATOM 969 C CB . ILE A 0 119 . 0.172 -2.857 -8.150 1.00 98.58 119 A 1 ATOM 970 O O . ILE A 0 119 . -0.846 -2.568 -4.943 1.00 98.58 119 A 1 ATOM 971 C CG1 . ILE A 0 119 . -0.246 -2.727 -9.632 1.00 98.58 119 A 1 ATOM 972 C CG2 . ILE A 0 119 . 0.030 -4.310 -7.667 1.00 98.58 119 A 1 ATOM 973 C CD1 . ILE A 0 119 . -1.747 -2.886 -9.910 1.00 98.58 119 A 1 ATOM 974 N N . ASP A 0 120 . 1.096 -1.573 -5.448 1.00 98.44 120 A 1 ATOM 975 C CA . ASP A 0 120 . 1.656 -1.718 -4.104 1.00 98.44 120 A 1 ATOM 976 C C . ASP A 0 120 . 0.839 -0.927 -3.065 1.00 98.44 120 A 1 ATOM 977 C CB . ASP A 0 120 . 3.127 -1.271 -4.100 1.00 98.44 120 A 1 ATOM 978 O O . ASP A 0 120 . 0.613 -1.415 -1.956 1.00 98.44 120 A 1 ATOM 979 C CG . ASP A 0 120 . 4.088 -2.168 -4.900 1.00 98.44 120 A 1 ATOM 980 O OD1 . ASP A 0 120 . 3.812 -3.374 -5.130 1.00 98.44 120 A 1 ATOM 981 O OD2 . ASP A 0 120 . 5.162 -1.649 -5.270 1.00 98.44 120 A 1 ATOM 982 N N . LEU A 0 121 . 0.353 0.269 -3.425 1.00 98.81 121 A 1 ATOM 983 C CA . LEU A 0 121 . -0.511 1.059 -2.549 1.00 98.81 121 A 1 ATOM 984 C C . LEU A 0 121 . -1.908 0.432 -2.423 1.00 98.81 121 A 1 ATOM 985 C CB . LEU A 0 121 . -0.542 2.521 -3.031 1.00 98.81 121 A 1 ATOM 986 O O . LEU A 0 121 . -2.432 0.383 -1.316 1.00 98.81 121 A 1 ATOM 987 C CG . LEU A 0 121 . -1.330 3.480 -2.117 1.00 98.81 121 A 1 ATOM 988 C CD1 . LEU A 0 121 . -0.825 3.486 -0.669 1.00 98.81 121 A 1 ATOM 989 C CD2 . LEU A 0 121 . -1.218 4.910 -2.644 1.00 98.81 121 A 1 ATOM 990 N N . ALA A 0 122 . -2.484 -0.105 -3.504 1.00 98.85 122 A 1 ATOM 991 C CA . ALA A 0 122 . -3.766 -0.814 -3.462 1.00 98.85 122 A 1 ATOM 992 C C . ALA A 0 122 . -3.728 -2.031 -2.527 1.00 98.85 122 A 1 ATOM 993 C CB . ALA A 0 122 . -4.152 -1.252 -4.877 1.00 98.85 122 A 1 ATOM 994 O O . ALA A 0 122 . -4.634 -2.209 -1.718 1.00 98.85 122 A 1 ATOM 995 N N . ASN A 0 123 . -2.661 -2.834 -2.588 1.00 98.67 123 A 1 ATOM 996 C CA . ASN A 0 123 . -2.488 -3.979 -1.692 1.00 98.67 123 A 1 ATOM 997 C C . ASN A 0 123 . -2.381 -3.543 -0.227 1.00 98.67 123 A 1 ATOM 998 C CB . ASN A 0 123 . -1.262 -4.790 -2.130 1.00 98.67 123 A 1 ATOM 999 O O . ASN A 0 123 . -3.083 -4.082 0.621 1.00 98.67 123 A 1 ATOM 1000 C CG . ASN A 0 123 . -1.522 -5.578 -3.399 1.00 98.67 123 A 1 ATOM 1001 N ND2 . ASN A 0 123 . -0.569 -5.639 -4.297 1.00 98.67 123 A 1 ATOM 1002 O OD1 . ASN A 0 123 . -2.576 -6.150 -3.613 1.00 98.67 123 A 1 ATOM 1003 N N . PHE A 0 124 . -1.589 -2.505 0.063 1.00 98.80 124 A 1 ATOM 1004 C CA . PHE A 0 124 . -1.530 -1.942 1.415 1.00 98.80 124 A 1 ATOM 1005 C C . PHE A 0 124 . -2.899 -1.437 1.896 1.00 98.80 124 A 1 ATOM 1006 C CB . PHE A 0 124 . -0.509 -0.801 1.435 1.00 98.80 124 A 1 ATOM 1007 O O . PHE A 0 124 . -3.258 -1.614 3.059 1.00 98.80 124 A 1 ATOM 1008 C CG . PHE A 0 124 . -0.437 -0.104 2.778 1.00 98.80 124 A 1 ATOM 1009 C CD1 . PHE A 0 124 . -1.262 1.006 3.049 1.00 98.80 124 A 1 ATOM 1010 C CD2 . PHE A 0 124 . 0.419 -0.602 3.777 1.00 98.80 124 A 1 ATOM 1011 C CE1 . PHE A 0 124 . -1.218 1.619 4.313 1.00 98.80 124 A 1 ATOM 1012 C CE2 . PHE A 0 124 . 0.478 0.028 5.032 1.00 98.80 124 A 1 ATOM 1013 C CZ . PHE A 0 124 . -0.336 1.141 5.297 1.00 98.80 124 A 1 ATOM 1014 N N . ILE A 0 125 . -3.667 -0.800 1.008 1.00 98.85 125 A 1 ATOM 1015 C CA . ILE A 0 125 . -5.019 -0.329 1.310 1.00 98.85 125 A 1 ATOM 1016 C C . ILE A 0 125 . -5.945 -1.507 1.628 1.00 98.85 125 A 1 ATOM 1017 C CB . ILE A 0 125 . -5.551 0.546 0.153 1.00 98.85 125 A 1 ATOM 1018 O O . ILE A 0 125 . -6.733 -1.389 2.559 1.00 98.85 125 A 1 ATOM 1019 C CG1 . ILE A 0 125 . -4.824 1.907 0.145 1.00 98.85 125 A 1 ATOM 1020 C CG2 . ILE A 0 125 . -7.062 0.788 0.289 1.00 98.85 125 A 1 ATOM 1021 C CD1 . ILE A 0 125 . -4.985 2.679 -1.164 1.00 98.85 125 A 1 ATOM 1022 N N . ASN A 0 126 . -5.844 -2.634 0.917 1.00 98.55 126 A 1 ATOM 1023 C CA . ASN A 0 126 . -6.631 -3.834 1.217 1.00 98.55 126 A 1 ATOM 1024 C C . ASN A 0 126 . -6.316 -4.381 2.616 1.00 98.55 126 A 1 ATOM 1025 C CB . ASN A 0 126 . -6.382 -4.913 0.150 1.00 98.55 126 A 1 ATOM 1026 O O . ASN A 0 126 . -7.241 -4.669 3.374 1.00 98.55 126 A 1 ATOM 1027 C CG . ASN A 0 126 . -6.855 -4.514 -1.230 1.00 98.55 126 A 1 ATOM 1028 N ND2 . ASN A 0 126 . -6.229 -5.034 -2.260 1.00 98.55 126 A 1 ATOM 1029 O OD1 . ASN A 0 126 . -7.795 -3.755 -1.412 1.00 98.55 126 A 1 ATOM 1030 N N . ASP A 0 127 . -5.034 -4.461 2.981 1.00 98.51 127 A 1 ATOM 1031 C CA . ASP A 0 127 . -4.609 -4.916 4.311 1.00 98.51 127 A 1 ATOM 1032 C C . ASP A 0 127 . -5.130 -3.978 5.410 1.00 98.51 127 A 1 ATOM 1033 C CB . ASP A 0 127 . -3.074 -4.989 4.385 1.00 98.51 127 A 1 ATOM 1034 O O . ASP A 0 127 . -5.694 -4.422 6.412 1.00 98.51 127 A 1 ATOM 1035 C CG . ASP A 0 127 . -2.432 -6.027 3.459 1.00 98.51 127 A 1 ATOM 1036 O OD1 . ASP A 0 127 . -3.129 -6.986 3.059 1.00 98.51 127 A 1 ATOM 1037 O OD2 . ASP A 0 127 . -1.220 -5.856 3.184 1.00 98.51 127 A 1 ATOM 1038 N N . ALA A 0 128 . -5.008 -2.664 5.196 1.00 98.62 128 A 1 ATOM 1039 C CA . ALA A 0 128 . -5.552 -1.663 6.106 1.00 98.62 128 A 1 ATOM 1040 C C . ALA A 0 128 . -7.084 -1.760 6.201 1.00 98.62 128 A 1 ATOM 1041 C CB . ALA A 0 128 . -5.094 -0.274 5.640 1.00 98.62 128 A 1 ATOM 1042 O O . ALA A 0 128 . -7.642 -1.702 7.291 1.00 98.62 128 A 1 ATOM 1043 N N . ALA A 0 129 . -7.779 -1.938 5.079 1.00 98.62 129 A 1 ATOM 1044 C CA . ALA A 0 129 . -9.230 -2.068 5.045 1.00 98.62 129 A 1 ATOM 1045 C C . ALA A 0 129 . -9.703 -3.301 5.830 1.00 98.62 129 A 1 ATOM 1046 C CB . ALA A 0 129 . -9.674 -2.118 3.580 1.00 98.62 129 A 1 ATOM 1047 O O . ALA A 0 129 . -10.683 -3.208 6.567 1.00 98.62 129 A 1 ATOM 1048 N N . PHE A 0 130 . -8.982 -4.422 5.732 1.00 98.15 130 A 1 ATOM 1049 C CA . PHE A 0 130 . -9.247 -5.618 6.530 1.00 98.15 130 A 1 ATOM 1050 C C . PHE A 0 130 . -9.059 -5.356 8.033 1.00 98.15 130 A 1 ATOM 1051 C CB . PHE A 0 130 . -8.347 -6.757 6.036 1.00 98.15 130 A 1 ATOM 1052 O O . PHE A 0 130 . -9.937 -5.687 8.828 1.00 98.15 130 A 1 ATOM 1053 C CG . PHE A 0 130 . -8.549 -8.053 6.793 1.00 98.15 130 A 1 ATOM 1054 C CD1 . PHE A 0 130 . -7.679 -8.406 7.841 1.00 98.15 130 A 1 ATOM 1055 C CD2 . PHE A 0 130 . -9.630 -8.893 6.468 1.00 98.15 130 A 1 ATOM 1056 C CE1 . PHE A 0 130 . -7.889 -9.595 8.561 1.00 98.15 130 A 1 ATOM 1057 C CE2 . PHE A 0 130 . -9.839 -10.084 7.186 1.00 98.15 130 A 1 ATOM 1058 C CZ . PHE A 0 130 . -8.968 -10.435 8.233 1.00 98.15 130 A 1 ATOM 1059 N N . GLU A 0 131 . -7.963 -4.699 8.423 1.00 98.54 131 A 1 ATOM 1060 C CA . GLU A 0 131 . -7.684 -4.329 9.819 1.00 98.54 131 A 1 ATOM 1061 C C . GLU A 0 131 . -8.773 -3.428 10.423 1.00 98.54 131 A 1 ATOM 1062 C CB . GLU A 0 131 . -6.312 -3.644 9.865 1.00 98.54 131 A 1 ATOM 1063 O O . GLU A 0 131 . -9.213 -3.651 11.552 1.00 98.54 131 A 1 ATOM 1064 C CG . GLU A 0 131 . -5.850 -3.249 11.275 1.00 98.54 131 A 1 ATOM 1065 C CD . GLU A 0 131 . -4.479 -2.568 11.214 1.00 98.54 131 A 1 ATOM 1066 O OE1 . GLU A 0 131 . -4.232 -1.553 11.905 1.00 98.54 131 A 1 ATOM 1067 O OE2 . GLU A 0 131 . -3.619 -2.988 10.406 1.00 98.54 131 A 1 ATOM 1068 N N . TYR A 0 132 . -9.256 -2.452 9.650 1.00 98.47 132 A 1 ATOM 1069 C CA . TYR A 0 132 . -10.324 -1.530 10.053 1.00 98.47 132 A 1 ATOM 1070 C C . TYR A 0 132 . -11.741 -2.051 9.760 1.00 98.47 132 A 1 ATOM 1071 C CB . TYR A 0 132 . -10.062 -0.144 9.448 1.00 98.47 132 A 1 ATOM 1072 O O . TYR A 0 132 . -12.709 -1.305 9.916 1.00 98.47 132 A 1 ATOM 1073 C CG . TYR A 0 132 . -8.881 0.573 10.070 1.00 98.47 132 A 1 ATOM 1074 C CD1 . TYR A 0 132 . -8.986 1.115 11.365 1.00 98.47 132 A 1 ATOM 1075 C CD2 . TYR A 0 132 . -7.683 0.722 9.353 1.00 98.47 132 A 1 ATOM 1076 C CE1 . TYR A 0 132 . -7.892 1.782 11.948 1.00 98.47 132 A 1 ATOM 1077 C CE2 . TYR A 0 132 . -6.593 1.390 9.928 1.00 98.47 132 A 1 ATOM 1078 O OH . TYR A 0 132 . -5.621 2.562 11.763 1.00 98.47 132 A 1 ATOM 1079 C CZ . TYR A 0 132 . -6.686 1.912 11.228 1.00 98.47 132 A 1 ATOM 1080 N N . GLN A 0 133 . -11.880 -3.326 9.375 1.00 98.13 133 A 1 ATOM 1081 C CA . GLN A 0 133 . -13.164 -4.006 9.156 1.00 98.13 133 A 1 ATOM 1082 C C . GLN A 0 133 . -14.069 -3.286 8.141 1.00 98.13 133 A 1 ATOM 1083 C CB . GLN A 0 133 . -13.871 -4.269 10.498 1.00 98.13 133 A 1 ATOM 1084 O O . GLN A 0 133 . -15.288 -3.194 8.321 1.00 98.13 133 A 1 ATOM 1085 C CG . GLN A 0 133 . -13.009 -5.052 11.495 1.00 98.13 133 A 1 ATOM 1086 C CD . GLN A 0 133 . -13.644 -5.104 12.879 1.00 98.13 133 A 1 ATOM 1087 N NE2 . GLN A 0 133 . -12.840 -5.086 13.920 1.00 98.13 133 A 1 ATOM 1088 O OE1 . GLN A 0 133 . -14.851 -5.160 13.066 1.00 98.13 133 A 1 ATOM 1089 N N . ALA A 0 134 . -13.466 -2.754 7.078 1.00 97.56 134 A 1 ATOM 1090 C CA . ALA A 0 134 . -14.198 -2.151 5.977 1.00 97.56 134 A 1 ATOM 1091 C C . ALA A 0 134 . -15.086 -3.187 5.270 1.00 97.56 134 A 1 ATOM 1092 C CB . ALA A 0 134 . -13.213 -1.541 4.981 1.00 97.56 134 A 1 ATOM 1093 O O . ALA A 0 134 . -14.728 -4.362 5.154 1.00 97.56 134 A 1 ATOM 1094 N N . LYS A 0 135 . -16.220 -2.723 4.749 1.00 90.43 135 A 1 ATOM 1095 C CA . LYS A 0 135 . -17.058 -3.449 3.786 1.00 90.43 135 A 1 ATOM 1096 C C . LYS A 0 135 . -16.826 -2.913 2.375 1.00 90.43 135 A 1 ATOM 1097 C CB . LYS A 0 135 . -18.533 -3.365 4.197 1.00 90.43 135 A 1 ATOM 1098 O O . LYS A 0 135 . -16.657 -1.677 2.245 1.00 90.43 135 A 1 ATOM 1099 C CG . LYS A 0 135 . -18.804 -3.964 5.585 1.00 90.43 135 A 1 ATOM 1100 C CD . LYS A 0 135 . -20.285 -3.805 5.938 1.00 90.43 135 A 1 ATOM 1101 C CE . LYS A 0 135 . -20.532 -4.350 7.345 1.00 90.43 135 A 1 ATOM 1102 N NZ . LYS A 0 135 . -21.947 -4.168 7.749 1.00 90.43 135 A 1 ATOM 1103 O OXT . LYS A 0 135 . -16.851 -3.745 1.445 1.00 90.43 135 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 88.98 # loop_ _atom_type.symbol C N O S #