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 SER 0 3 SER 0 4 SER 0 5 HIS 0 6 LYS 0 7 SER 0 8 TRP 0 9 ASN 0 10 SER 0 11 ILE 0 12 TYR 0 13 GLU 0 14 PHE 0 15 THR 0 16 VAL 0 17 LYS 0 18 ASP 0 19 ILE 0 20 ASN 0 21 GLY 0 22 VAL 0 23 ASP 0 24 VAL 0 25 SER 0 26 LEU 0 27 GLU 0 28 LYS 0 29 TYR 0 30 ARG 0 31 GLY 0 32 HIS 0 33 VAL 0 34 CYS 0 35 LEU 0 36 ILE 0 37 VAL 0 38 ASN 0 39 VAL 0 40 ALA 0 41 CYS 0 42 LYS 0 43 CYS 0 44 GLY 0 45 ALA 0 46 THR 0 47 ASP 0 48 LYS 0 49 ASN 0 50 TYR 0 51 ARG 0 52 GLN 0 53 LEU 0 54 GLN 0 55 GLU 0 56 MET 0 57 HIS 0 58 THR 0 59 ARG 0 60 LEU 0 61 VAL 0 62 GLY 0 63 LYS 0 64 GLY 0 65 LEU 0 66 ARG 0 67 ILE 0 68 LEU 0 69 ALA 0 70 PHE 0 71 PRO 0 72 CYS 0 73 ASN 0 74 GLN 0 75 PHE 0 76 GLY 0 77 GLY 0 78 GLN 0 79 GLU 0 80 PRO 0 81 TRP 0 82 ALA 0 83 GLU 0 84 ALA 0 85 GLU 0 86 ILE 0 87 LYS 0 88 LYS 0 89 PHE 0 90 VAL 0 91 THR 0 92 GLU 0 93 LYS 0 94 TYR 0 95 GLY 0 96 VAL 0 97 GLN 0 98 PHE 0 99 ASP 0 100 MET 0 101 PHE 0 102 SER 0 103 LYS 0 104 ILE 0 105 LYS 0 106 VAL 0 107 ASN 0 108 GLY 0 109 SER 0 110 ASP 0 111 ALA 0 112 ASP 0 113 ASP 0 114 LEU 0 115 TYR 0 116 LYS 0 117 PHE 0 118 LEU 0 119 LYS 0 120 SER 0 121 ARG 0 122 GLN 0 123 HIS 0 124 GLY 0 125 THR 0 126 LEU 0 127 THR 0 128 ASN 0 129 ASN 0 130 ILE 0 131 LYS 0 132 TRP 0 133 ASN 0 134 PHE 0 135 SER 0 136 LYS 0 137 PHE 0 138 LEU 0 139 VAL 0 140 ASP 0 141 ARG 0 142 GLN 0 143 GLY 0 144 GLN 0 145 PRO 0 146 VAL 0 147 LYS 0 148 ARG 0 149 TYR 0 150 SER 0 151 PRO 0 152 THR 0 153 THR 0 154 ALA 0 155 PRO 0 156 TYR 0 157 ASP 0 158 ILE 0 159 GLU 0 160 GLY 0 161 ASP 0 162 ILE 0 163 MET 0 164 GLU 0 165 LEU 0 166 LEU 0 167 GLU 0 168 LYS 0 169 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 . 23.480 -13.505 16.355 1.00 38.56 1 A 1 ATOM 2 C CA . MET A 0 1 . 22.741 -12.256 16.637 1.00 38.56 1 A 1 ATOM 3 C C . MET A 0 1 . 21.275 -12.537 16.352 1.00 38.56 1 A 1 ATOM 4 C CB . MET A 0 1 . 23.269 -11.093 15.780 1.00 38.56 1 A 1 ATOM 5 O O . MET A 0 1 . 20.936 -12.776 15.203 1.00 38.56 1 A 1 ATOM 6 C CG . MET A 0 1 . 24.714 -10.721 16.140 1.00 38.56 1 A 1 ATOM 7 S SD . MET A 0 1 . 25.407 -9.445 15.063 1.00 38.56 1 A 1 ATOM 8 C CE . MET A 0 1 . 27.163 -9.555 15.504 1.00 38.56 1 A 1 ATOM 9 N N . SER A 0 2 . 20.451 -12.664 17.395 1.00 37.26 2 A 1 ATOM 10 C CA . SER A 0 2 . 19.017 -12.948 17.260 1.00 37.26 2 A 1 ATOM 11 C C . SER A 0 2 . 18.326 -11.710 16.689 1.00 37.26 2 A 1 ATOM 12 C CB . SER A 0 2 . 18.442 -13.315 18.637 1.00 37.26 2 A 1 ATOM 13 O O . SER A 0 2 . 18.213 -10.699 17.379 1.00 37.26 2 A 1 ATOM 14 O OG . SER A 0 2 . 17.042 -13.442 18.573 1.00 37.26 2 A 1 ATOM 15 N N . SER A 0 3 . 17.931 -11.752 15.416 1.00 43.79 3 A 1 ATOM 16 C CA . SER A 0 3 . 17.015 -10.764 14.856 1.00 43.79 3 A 1 ATOM 17 C C . SER A 0 3 . 15.648 -11.015 15.482 1.00 43.79 3 A 1 ATOM 18 C CB . SER A 0 3 . 16.954 -10.880 13.325 1.00 43.79 3 A 1 ATOM 19 O O . SER A 0 3 . 14.990 -12.002 15.146 1.00 43.79 3 A 1 ATOM 20 O OG . SER A 0 3 . 16.559 -12.182 12.935 1.00 43.79 3 A 1 ATOM 21 N N . SER A 0 4 . 15.222 -10.153 16.401 1.00 50.81 4 A 1 ATOM 22 C CA . SER A 0 4 . 13.842 -10.134 16.870 1.00 50.81 4 A 1 ATOM 23 C C . SER A 0 4 . 12.928 -9.985 15.651 1.00 50.81 4 A 1 ATOM 24 C CB . SER A 0 4 . 13.643 -8.996 17.884 1.00 50.81 4 A 1 ATOM 25 O O . SER A 0 4 . 12.939 -8.966 14.962 1.00 50.81 4 A 1 ATOM 26 O OG . SER A 0 4 . 14.295 -7.806 17.473 1.00 50.81 4 A 1 ATOM 27 N N . HIS A 0 5 . 12.169 -11.033 15.324 1.00 58.36 5 A 1 ATOM 28 C CA . HIS A 0 5 . 11.113 -10.934 14.325 1.00 58.36 5 A 1 ATOM 29 C C . HIS A 0 5 . 10.075 -9.949 14.859 1.00 58.36 5 A 1 ATOM 30 C CB . HIS A 0 5 . 10.508 -12.318 14.034 1.00 58.36 5 A 1 ATOM 31 O O . HIS A 0 5 . 9.284 -10.286 15.736 1.00 58.36 5 A 1 ATOM 32 C CG . HIS A 0 5 . 11.347 -13.197 13.138 1.00 58.36 5 A 1 ATOM 33 C CD2 . HIS A 0 5 . 11.161 -14.535 12.913 1.00 58.36 5 A 1 ATOM 34 N ND1 . HIS A 0 5 . 12.389 -12.797 12.327 1.00 58.36 5 A 1 ATOM 35 C CE1 . HIS A 0 5 . 12.818 -13.866 11.637 1.00 58.36 5 A 1 ATOM 36 N NE2 . HIS A 0 5 . 12.098 -14.949 11.960 1.00 58.36 5 A 1 ATOM 37 N N . LYS A 0 6 . 10.112 -8.707 14.368 1.00 65.39 6 A 1 ATOM 38 C CA . LYS A 0 6 . 9.080 -7.710 14.644 1.00 65.39 6 A 1 ATOM 39 C C . LYS A 0 6 . 7.754 -8.277 14.128 1.00 65.39 6 A 1 ATOM 40 C CB . LYS A 0 6 . 9.486 -6.375 13.987 1.00 65.39 6 A 1 ATOM 41 O O . LYS A 0 6 . 7.555 -8.366 12.920 1.00 65.39 6 A 1 ATOM 42 C CG . LYS A 0 6 . 8.579 -5.207 14.406 1.00 65.39 6 A 1 ATOM 43 C CD . LYS A 0 6 . 9.099 -3.866 13.859 1.00 65.39 6 A 1 ATOM 44 C CE . LYS A 0 6 . 8.203 -2.716 14.345 1.00 65.39 6 A 1 ATOM 45 N NZ . LYS A 0 6 . 8.654 -1.388 13.849 1.00 65.39 6 A 1 ATOM 46 N N . SER A 0 7 . 6.880 -8.725 15.031 1.00 83.91 7 A 1 ATOM 47 C CA . SER A 0 7 . 5.543 -9.187 14.662 1.00 83.91 7 A 1 ATOM 48 C C . SER A 0 7 . 4.623 -7.976 14.559 1.00 83.91 7 A 1 ATOM 49 C CB . SER A 0 7 . 4.993 -10.239 15.638 1.00 83.91 7 A 1 ATOM 50 O O . SER A 0 7 . 4.285 -7.370 15.573 1.00 83.91 7 A 1 ATOM 51 O OG . SER A 0 7 . 4.635 -9.675 16.880 1.00 83.91 7 A 1 ATOM 52 N N . TRP A 0 8 . 4.233 -7.611 13.344 1.00 91.48 8 A 1 ATOM 53 C CA . TRP A 0 8 . 3.213 -6.589 13.132 1.00 91.48 8 A 1 ATOM 54 C C . TRP A 0 8 . 1.826 -7.170 13.391 1.00 91.48 8 A 1 ATOM 55 C CB . TRP A 0 8 . 3.318 -6.047 11.711 1.00 91.48 8 A 1 ATOM 56 O O . TRP A 0 8 . 1.491 -8.241 12.879 1.00 91.48 8 A 1 ATOM 57 C CG . TRP A 0 8 . 4.627 -5.419 11.359 1.00 91.48 8 A 1 ATOM 58 C CD1 . TRP A 0 8 . 5.234 -4.434 12.058 1.00 91.48 8 A 1 ATOM 59 C CD2 . TRP A 0 8 . 5.446 -5.635 10.171 1.00 91.48 8 A 1 ATOM 60 C CE2 . TRP A 0 8 . 6.547 -4.731 10.215 1.00 91.48 8 A 1 ATOM 61 C CE3 . TRP A 0 8 . 5.331 -6.458 9.030 1.00 91.48 8 A 1 ATOM 62 N NE1 . TRP A 0 8 . 6.363 -4.019 11.379 1.00 91.48 8 A 1 ATOM 63 C CH2 . TRP A 0 8 . 7.356 -5.496 8.068 1.00 91.48 8 A 1 ATOM 64 C CZ2 . TRP A 0 8 . 7.499 -4.661 9.188 1.00 91.48 8 A 1 ATOM 65 C CZ3 . TRP A 0 8 . 6.265 -6.377 7.980 1.00 91.48 8 A 1 ATOM 66 N N . ASN A 0 9 . 1.009 -6.450 14.149 1.00 95.26 9 A 1 ATOM 67 C CA . ASN A 0 9 . -0.348 -6.849 14.501 1.00 95.26 9 A 1 ATOM 68 C C . ASN A 0 9 . -1.397 -6.037 13.744 1.00 95.26 9 A 1 ATOM 69 C CB . ASN A 0 9 . -0.530 -6.719 16.016 1.00 95.26 9 A 1 ATOM 70 O O . ASN A 0 9 . -2.442 -6.587 13.410 1.00 95.26 9 A 1 ATOM 71 C CG . ASN A 0 9 . 0.357 -7.695 16.759 1.00 95.26 9 A 1 ATOM 72 N ND2 . ASN A 0 9 . 1.325 -7.212 17.499 1.00 95.26 9 A 1 ATOM 73 O OD1 . ASN A 0 9 . 0.198 -8.899 16.659 1.00 95.26 9 A 1 ATOM 74 N N . SER A 0 10 . -1.148 -4.764 13.437 1.00 98.10 10 A 1 ATOM 75 C CA . SER A 0 10 . -2.096 -3.908 12.712 1.00 98.10 10 A 1 ATOM 76 C C . SER A 0 10 . -1.404 -2.944 11.754 1.00 98.10 10 A 1 ATOM 77 C CB . SER A 0 10 . -2.968 -3.125 13.702 1.00 98.10 10 A 1 ATOM 78 O O . SER A 0 10 . -0.221 -2.645 11.909 1.00 98.10 10 A 1 ATOM 79 O OG . SER A 0 10 . -2.313 -1.955 14.137 1.00 98.10 10 A 1 ATOM 80 N N . ILE A 0 11 . -2.167 -2.378 10.812 1.00 98.62 11 A 1 ATOM 81 C CA . ILE A 0 11 . -1.656 -1.318 9.933 1.00 98.62 11 A 1 ATOM 82 C C . ILE A 0 11 . -1.226 -0.058 10.700 1.00 98.62 11 A 1 ATOM 83 C CB . ILE A 0 11 . -2.641 -0.934 8.811 1.00 98.62 11 A 1 ATOM 84 O O . ILE A 0 11 . -0.480 0.746 10.158 1.00 98.62 11 A 1 ATOM 85 C CG1 . ILE A 0 11 . -3.910 -0.227 9.339 1.00 98.62 11 A 1 ATOM 86 C CG2 . ILE A 0 11 . -2.990 -2.162 7.950 1.00 98.62 11 A 1 ATOM 87 C CD1 . ILE A 0 11 . -4.626 0.605 8.269 1.00 98.62 11 A 1 ATOM 88 N N . TYR A 0 12 . -1.668 0.132 11.945 1.00 98.34 12 A 1 ATOM 89 C CA . TYR A 0 12 . -1.378 1.339 12.721 1.00 98.34 12 A 1 ATOM 90 C C . TYR A 0 12 . 0.087 1.439 13.166 1.00 98.34 12 A 1 ATOM 91 C CB . TYR A 0 12 . -2.331 1.391 13.918 1.00 98.34 12 A 1 ATOM 92 O O . TYR A 0 12 . 0.562 2.513 13.519 1.00 98.34 12 A 1 ATOM 93 C CG . TYR A 0 12 . -3.812 1.271 13.597 1.00 98.34 12 A 1 ATOM 94 C CD1 . TYR A 0 12 . -4.338 1.901 12.454 1.00 98.34 12 A 1 ATOM 95 C CD2 . TYR A 0 12 . -4.670 0.547 14.449 1.00 98.34 12 A 1 ATOM 96 C CE1 . TYR A 0 12 . -5.702 1.790 12.145 1.00 98.34 12 A 1 ATOM 97 C CE2 . TYR A 0 12 . -6.049 0.467 14.168 1.00 98.34 12 A 1 ATOM 98 O OH . TYR A 0 12 . -7.882 1.066 12.711 1.00 98.34 12 A 1 ATOM 99 C CZ . TYR A 0 12 . -6.559 1.079 13.002 1.00 98.34 12 A 1 ATOM 100 N N . GLU A 0 13 . 0.828 0.333 13.094 1.00 97.98 13 A 1 ATOM 101 C CA . GLU A 0 13 . 2.245 0.259 13.465 1.00 97.98 13 A 1 ATOM 102 C C . GLU A 0 13 . 3.197 0.709 12.342 1.00 97.98 13 A 1 ATOM 103 C CB . GLU A 0 13 . 2.560 -1.179 13.895 1.00 97.98 13 A 1 ATOM 104 O O . GLU A 0 13 . 4.420 0.669 12.514 1.00 97.98 13 A 1 ATOM 105 C CG . GLU A 0 13 . 1.782 -1.599 15.147 1.00 97.98 13 A 1 ATOM 106 C CD . GLU A 0 13 . 1.976 -3.092 15.394 1.00 97.98 13 A 1 ATOM 107 O OE1 . GLU A 0 13 . 3.054 -3.485 15.887 1.00 97.98 13 A 1 ATOM 108 O OE2 . GLU A 0 13 . 1.051 -3.860 15.038 1.00 97.98 13 A 1 ATOM 109 N N . PHE A 0 14 . 2.654 1.111 11.189 1.00 98.53 14 A 1 ATOM 110 C CA . PHE A 0 14 . 3.425 1.529 10.022 1.00 98.53 14 A 1 ATOM 111 C C . PHE A 0 14 . 3.402 3.049 9.852 1.00 98.53 14 A 1 ATOM 112 C CB . PHE A 0 14 . 2.930 0.810 8.758 1.00 98.53 14 A 1 ATOM 113 O O . PHE A 0 14 . 2.399 3.719 10.108 1.00 98.53 14 A 1 ATOM 114 C CG . PHE A 0 14 . 3.016 -0.702 8.826 1.00 98.53 14 A 1 ATOM 115 C CD1 . PHE A 0 14 . 4.139 -1.388 8.330 1.00 98.53 14 A 1 ATOM 116 C CD2 . PHE A 0 14 . 1.976 -1.429 9.426 1.00 98.53 14 A 1 ATOM 117 C CE1 . PHE A 0 14 . 4.206 -2.787 8.450 1.00 98.53 14 A 1 ATOM 118 C CE2 . PHE A 0 14 . 2.027 -2.823 9.524 1.00 98.53 14 A 1 ATOM 119 C CZ . PHE A 0 14 . 3.153 -3.497 9.045 1.00 98.53 14 A 1 ATOM 120 N N . THR A 0 15 . 4.514 3.575 9.345 1.00 98.51 15 A 1 ATOM 121 C CA . THR A 0 15 . 4.650 4.954 8.874 1.00 98.51 15 A 1 ATOM 122 C C . THR A 0 15 . 5.028 4.904 7.404 1.00 98.51 15 A 1 ATOM 123 C CB . THR A 0 15 . 5.699 5.726 9.683 1.00 98.51 15 A 1 ATOM 124 O O . THR A 0 15 . 5.927 4.159 7.024 1.00 98.51 15 A 1 ATOM 125 C CG2 . THR A 0 15 . 5.921 7.155 9.192 1.00 98.51 15 A 1 ATOM 126 O OG1 . THR A 0 15 . 5.277 5.834 11.024 1.00 98.51 15 A 1 ATOM 127 N N . VAL A 0 16 . 4.337 5.690 6.589 1.00 98.70 16 A 1 ATOM 128 C CA . VAL A 0 16 . 4.540 5.786 5.138 1.00 98.70 16 A 1 ATOM 129 C C . VAL A 0 16 . 4.645 7.254 4.742 1.00 98.70 16 A 1 ATOM 130 C CB . VAL A 0 16 . 3.396 5.098 4.368 1.00 98.70 16 A 1 ATOM 131 O O . VAL A 0 16 . 4.179 8.120 5.477 1.00 98.70 16 A 1 ATOM 132 C CG1 . VAL A 0 16 . 3.396 3.579 4.566 1.00 98.70 16 A 1 ATOM 133 C CG2 . VAL A 0 16 . 2.027 5.634 4.791 1.00 98.70 16 A 1 ATOM 134 N N . LYS A 0 17 . 5.218 7.560 3.579 1.00 98.73 17 A 1 ATOM 135 C CA . LYS A 0 17 . 5.259 8.940 3.076 1.00 98.73 17 A 1 ATOM 136 C C . LYS A 0 17 . 3.997 9.269 2.298 1.00 98.73 17 A 1 ATOM 137 C CB . LYS A 0 17 . 6.527 9.189 2.252 1.00 98.73 17 A 1 ATOM 138 O O . LYS A 0 17 . 3.617 8.509 1.405 1.00 98.73 17 A 1 ATOM 139 C CG . LYS A 0 17 . 7.745 9.181 3.180 1.00 98.73 17 A 1 ATOM 140 C CD . LYS A 0 17 . 9.031 9.589 2.451 1.00 98.73 17 A 1 ATOM 141 C CE . LYS A 0 17 . 10.233 9.590 3.407 1.00 98.73 17 A 1 ATOM 142 N NZ . LYS A 0 17 . 10.007 10.489 4.569 1.00 98.73 17 A 1 ATOM 143 N N . ASP A 0 18 . 3.364 10.398 2.598 1.00 98.70 18 A 1 ATOM 144 C CA . ASP A 0 18 . 2.296 10.935 1.758 1.00 98.70 18 A 1 ATOM 145 C C . ASP A 0 18 . 2.844 11.341 0.376 1.00 98.70 18 A 1 ATOM 146 C CB . ASP A 0 18 . 1.520 12.054 2.478 1.00 98.70 18 A 1 ATOM 147 O O . ASP A 0 18 . 4.051 11.295 0.124 1.00 98.70 18 A 1 ATOM 148 C CG . ASP A 0 18 . 2.147 13.453 2.442 1.00 98.70 18 A 1 ATOM 149 O OD1 . ASP A 0 18 . 3.307 13.594 2.004 1.00 98.70 18 A 1 ATOM 150 O OD2 . ASP A 0 18 . 1.421 14.429 2.729 1.00 98.70 18 A 1 ATOM 151 N N . ILE A 0 19 . 1.975 11.734 -0.553 1.00 98.66 19 A 1 ATOM 152 C CA . ILE A 0 19 . 2.405 12.153 -1.897 1.00 98.66 19 A 1 ATOM 153 C C . ILE A 0 19 . 3.237 13.454 -1.899 1.00 98.66 19 A 1 ATOM 154 C CB . ILE A 0 19 . 1.179 12.214 -2.830 1.00 98.66 19 A 1 ATOM 155 O O . ILE A 0 19 . 3.789 13.832 -2.926 1.00 98.66 19 A 1 ATOM 156 C CG1 . ILE A 0 19 . 1.600 12.190 -4.313 1.00 98.66 19 A 1 ATOM 157 C CG2 . ILE A 0 19 . 0.283 13.422 -2.489 1.00 98.66 19 A 1 ATOM 158 C CD1 . ILE A 0 19 . 0.486 11.729 -5.258 1.00 98.66 19 A 1 ATOM 159 N N . ASN A 0 20 . 3.337 14.156 -0.766 1.00 98.45 20 A 1 ATOM 160 C CA . ASN A 0 20 . 4.159 15.355 -0.594 1.00 98.45 20 A 1 ATOM 161 C C . ASN A 0 20 . 5.505 15.046 0.093 1.00 98.45 20 A 1 ATOM 162 C CB . ASN A 0 20 . 3.363 16.420 0.180 1.00 98.45 20 A 1 ATOM 163 O O . ASN A 0 20 . 6.275 15.966 0.359 1.00 98.45 20 A 1 ATOM 164 C CG . ASN A 0 20 . 1.941 16.585 -0.310 1.00 98.45 20 A 1 ATOM 165 N ND2 . ASN A 0 20 . 0.979 16.212 0.502 1.00 98.45 20 A 1 ATOM 166 O OD1 . ASN A 0 20 . 1.665 17.037 -1.417 1.00 98.45 20 A 1 ATOM 167 N N . GLY A 0 21 . 5.792 13.772 0.388 1.00 98.32 21 A 1 ATOM 168 C CA . GLY A 0 21 . 7.025 13.323 1.038 1.00 98.32 21 A 1 ATOM 169 C C . GLY A 0 21 . 7.018 13.410 2.569 1.00 98.32 21 A 1 ATOM 170 O O . GLY A 0 21 . 8.050 13.146 3.194 1.00 98.32 21 A 1 ATOM 171 N N . VAL A 0 22 . 5.881 13.750 3.183 1.00 98.64 22 A 1 ATOM 172 C CA . VAL A 0 22 . 5.726 13.876 4.638 1.00 98.64 22 A 1 ATOM 173 C C . VAL A 0 22 . 5.451 12.507 5.247 1.00 98.64 22 A 1 ATOM 174 C CB . VAL A 0 22 . 4.607 14.874 4.998 1.00 98.64 22 A 1 ATOM 175 O O . VAL A 0 22 . 4.601 11.764 4.761 1.00 98.64 22 A 1 ATOM 176 C CG1 . VAL A 0 22 . 4.480 15.060 6.516 1.00 98.64 22 A 1 ATOM 177 C CG2 . VAL A 0 22 . 4.880 16.255 4.383 1.00 98.64 22 A 1 ATOM 178 N N . ASP A 0 23 . 6.156 12.163 6.324 1.00 98.70 23 A 1 ATOM 179 C CA . ASP A 0 23 . 5.909 10.920 7.055 1.00 98.70 23 A 1 ATOM 180 C C . ASP A 0 23 . 4.545 10.958 7.763 1.00 98.70 23 A 1 ATOM 181 C CB . ASP A 0 23 . 7.061 10.635 8.031 1.00 98.70 23 A 1 ATOM 182 O O . ASP A 0 23 . 4.252 11.849 8.560 1.00 98.70 23 A 1 ATOM 183 C CG . ASP A 0 23 . 8.345 10.266 7.282 1.00 98.70 23 A 1 ATOM 184 O OD1 . ASP A 0 23 . 8.311 9.348 6.432 1.00 98.70 23 A 1 ATOM 185 O OD2 . ASP A 0 23 . 9.377 10.951 7.439 1.00 98.70 23 A 1 ATOM 186 N N . VAL A 0 24 . 3.713 9.959 7.480 1.00 98.76 24 A 1 ATOM 187 C CA . VAL A 0 24 . 2.370 9.777 8.031 1.00 98.76 24 A 1 ATOM 188 C C . VAL A 0 24 . 2.321 8.445 8.758 1.00 98.76 24 A 1 ATOM 189 C CB . VAL A 0 24 . 1.293 9.844 6.929 1.00 98.76 24 A 1 ATOM 190 O O . VAL A 0 24 . 2.393 7.377 8.146 1.00 98.76 24 A 1 ATOM 191 C CG1 . VAL A 0 24 . -0.118 9.611 7.496 1.00 98.76 24 A 1 ATOM 192 C CG2 . VAL A 0 24 . 1.289 11.220 6.259 1.00 98.76 24 A 1 ATOM 193 N N . SER A 0 25 . 2.162 8.505 10.079 1.00 98.63 25 A 1 ATOM 194 C CA . SER A 0 25 . 1.806 7.319 10.853 1.00 98.63 25 A 1 ATOM 195 C C . SER A 0 25 . 0.385 6.890 10.499 1.00 98.63 25 A 1 ATOM 196 C CB . SER A 0 25 . 1.926 7.578 12.352 1.00 98.63 25 A 1 ATOM 197 O O . SER A 0 25 . -0.555 7.691 10.557 1.00 98.63 25 A 1 ATOM 198 O OG . SER A 0 25 . 1.561 6.407 13.051 1.00 98.63 25 A 1 ATOM 199 N N . LEU A 0 26 . 0.214 5.614 10.158 1.00 98.76 26 A 1 ATOM 200 C CA . LEU A 0 26 . -1.099 5.056 9.846 1.00 98.76 26 A 1 ATOM 201 C C . LEU A 0 26 . -1.999 4.922 11.081 1.00 98.76 26 A 1 ATOM 202 C CB . LEU A 0 26 . -0.936 3.717 9.124 1.00 98.76 26 A 1 ATOM 203 O O . LEU A 0 26 . -3.198 4.708 10.926 1.00 98.76 26 A 1 ATOM 204 C CG . LEU A 0 26 . -0.263 3.770 7.742 1.00 98.76 26 A 1 ATOM 205 C CD1 . LEU A 0 26 . -0.460 2.426 7.046 1.00 98.76 26 A 1 ATOM 206 C CD2 . LEU A 0 26 . -0.856 4.835 6.820 1.00 98.76 26 A 1 ATOM 207 N N . GLU A 0 27 . -1.469 5.149 12.285 1.00 98.60 27 A 1 ATOM 208 C CA . GLU A 0 27 . -2.244 5.412 13.503 1.00 98.60 27 A 1 ATOM 209 C C . GLU A 0 27 . -3.338 6.476 13.283 1.00 98.60 27 A 1 ATOM 210 C CB . GLU A 0 27 . -1.254 5.880 14.582 1.00 98.60 27 A 1 ATOM 211 O O . GLU A 0 27 . -4.424 6.363 13.850 1.00 98.60 27 A 1 ATOM 212 C CG . GLU A 0 27 . -1.867 6.159 15.959 1.00 98.60 27 A 1 ATOM 213 C CD . GLU A 0 27 . -2.478 4.927 16.623 1.00 98.60 27 A 1 ATOM 214 O OE1 . GLU A 0 27 . -3.293 5.094 17.551 1.00 98.60 27 A 1 ATOM 215 O OE2 . GLU A 0 27 . -2.166 3.780 16.249 1.00 98.60 27 A 1 ATOM 216 N N . LYS A 0 28 . -3.109 7.450 12.380 1.00 98.59 28 A 1 ATOM 217 C CA . LYS A 0 28 . -4.102 8.447 11.917 1.00 98.59 28 A 1 ATOM 218 C C . LYS A 0 28 . -5.448 7.819 11.529 1.00 98.59 28 A 1 ATOM 219 C CB . LYS A 0 28 . -3.502 9.195 10.704 1.00 98.59 28 A 1 ATOM 220 O O . LYS A 0 28 . -6.489 8.464 11.640 1.00 98.59 28 A 1 ATOM 221 C CG . LYS A 0 28 . -4.425 10.263 10.075 1.00 98.59 28 A 1 ATOM 222 C CD . LYS A 0 28 . -3.859 10.812 8.754 1.00 98.59 28 A 1 ATOM 223 C CE . LYS A 0 28 . -4.881 11.723 8.046 1.00 98.59 28 A 1 ATOM 224 N NZ . LYS A 0 28 . -4.547 11.942 6.607 1.00 98.59 28 A 1 ATOM 225 N N . TYR A 0 29 . -5.435 6.580 11.045 1.00 98.69 29 A 1 ATOM 226 C CA . TYR A 0 29 . -6.612 5.876 10.552 1.00 98.69 29 A 1 ATOM 227 C C . TYR A 0 29 . -7.306 5.015 11.607 1.00 98.69 29 A 1 ATOM 228 C CB . TYR A 0 29 . -6.232 5.072 9.310 1.00 98.69 29 A 1 ATOM 229 O O . TYR A 0 29 . -8.272 4.326 11.277 1.00 98.69 29 A 1 ATOM 230 C CG . TYR A 0 29 . -5.688 5.943 8.200 1.00 98.69 29 A 1 ATOM 231 C CD1 . TYR A 0 29 . -6.564 6.791 7.505 1.00 98.69 29 A 1 ATOM 232 C CD2 . TYR A 0 29 . -4.313 5.967 7.917 1.00 98.69 29 A 1 ATOM 233 C CE1 . TYR A 0 29 . -6.077 7.659 6.517 1.00 98.69 29 A 1 ATOM 234 C CE2 . TYR A 0 29 . -3.810 6.861 6.952 1.00 98.69 29 A 1 ATOM 235 O OH . TYR A 0 29 . -4.213 8.577 5.342 1.00 98.69 29 A 1 ATOM 236 C CZ . TYR A 0 29 . -4.694 7.698 6.248 1.00 98.69 29 A 1 ATOM 237 N N . ARG A 0 30 . -6.874 5.061 12.874 1.00 98.38 30 A 1 ATOM 238 C CA . ARG A 0 30 . -7.508 4.300 13.953 1.00 98.38 30 A 1 ATOM 239 C C . ARG A 0 30 . -9.020 4.509 13.981 1.00 98.38 30 A 1 ATOM 240 C CB . ARG A 0 30 . -6.836 4.594 15.299 1.00 98.38 30 A 1 ATOM 241 O O . ARG A 0 30 . -9.510 5.630 13.849 1.00 98.38 30 A 1 ATOM 242 C CG . ARG A 0 30 . -7.437 3.711 16.407 1.00 98.38 30 A 1 ATOM 243 C CD . ARG A 0 30 . -6.716 3.869 17.746 1.00 98.38 30 A 1 ATOM 244 N NE . ARG A 0 30 . -5.333 3.391 17.675 1.00 98.38 30 A 1 ATOM 245 N NH1 . ARG A 0 30 . -5.620 1.136 17.919 1.00 98.38 30 A 1 ATOM 246 N NH2 . ARG A 0 30 . -3.578 1.961 17.607 1.00 98.38 30 A 1 ATOM 247 C CZ . ARG A 0 30 . -4.850 2.170 17.732 1.00 98.38 30 A 1 ATOM 248 N N . GLY A 0 31 . -9.755 3.409 14.133 1.00 98.09 31 A 1 ATOM 249 C CA . GLY A 0 31 . -11.214 3.414 14.208 1.00 98.09 31 A 1 ATOM 250 C C . GLY A 0 31 . -11.921 3.594 12.864 1.00 98.09 31 A 1 ATOM 251 O O . GLY A 0 31 . -13.149 3.586 12.838 1.00 98.09 31 A 1 ATOM 252 N N . HIS A 0 32 . -11.195 3.730 11.752 1.00 98.64 32 A 1 ATOM 253 C CA . HIS A 0 32 . -11.761 3.860 10.410 1.00 98.64 32 A 1 ATOM 254 C C . HIS A 0 32 . -11.656 2.549 9.632 1.00 98.64 32 A 1 ATOM 255 C CB . HIS A 0 32 . -11.064 4.994 9.654 1.00 98.64 32 A 1 ATOM 256 O O . HIS A 0 32 . -10.728 1.770 9.830 1.00 98.64 32 A 1 ATOM 257 C CG . HIS A 0 32 . -11.248 6.343 10.296 1.00 98.64 32 A 1 ATOM 258 C CD2 . HIS A 0 32 . -12.253 7.230 10.037 1.00 98.64 32 A 1 ATOM 259 N ND1 . HIS A 0 32 . -10.450 6.910 11.261 1.00 98.64 32 A 1 ATOM 260 C CE1 . HIS A 0 32 . -10.956 8.115 11.565 1.00 98.64 32 A 1 ATOM 261 N NE2 . HIS A 0 32 . -12.049 8.370 10.824 1.00 98.64 32 A 1 ATOM 262 N N . VAL A 0 33 . -12.581 2.334 8.699 1.00 98.73 33 A 1 ATOM 263 C CA . VAL A 0 33 . -12.455 1.262 7.705 1.00 98.73 33 A 1 ATOM 264 C C . VAL A 0 33 . -11.560 1.775 6.588 1.00 98.73 33 A 1 ATOM 265 C CB . VAL A 0 33 . -13.828 0.829 7.171 1.00 98.73 33 A 1 ATOM 266 O O . VAL A 0 33 . -11.850 2.823 6.006 1.00 98.73 33 A 1 ATOM 267 C CG1 . VAL A 0 33 . -13.716 -0.215 6.054 1.00 98.73 33 A 1 ATOM 268 C CG2 . VAL A 0 33 . -14.661 0.227 8.307 1.00 98.73 33 A 1 ATOM 269 N N . CYS A 0 34 . -10.481 1.056 6.280 1.00 98.90 34 A 1 ATOM 270 C CA . CYS A 0 34 . -9.530 1.481 5.257 1.00 98.90 34 A 1 ATOM 271 C C . CYS A 0 34 . -9.583 0.584 4.022 1.00 98.90 34 A 1 ATOM 272 C CB . CYS A 0 34 . -8.112 1.618 5.821 1.00 98.90 34 A 1 ATOM 273 O O . CYS A 0 34 . -9.502 -0.639 4.124 1.00 98.90 34 A 1 ATOM 274 S SG . CYS A 0 34 . -8.096 2.822 7.169 1.00 98.90 34 A 1 ATOM 275 N N . LEU A 0 35 . -9.647 1.200 2.844 1.00 98.92 35 A 1 ATOM 276 C CA . LEU A 0 35 . -9.430 0.535 1.565 1.00 98.92 35 A 1 ATOM 277 C C . LEU A 0 35 . -8.061 0.954 1.020 1.00 98.92 35 A 1 ATOM 278 C CB . LEU A 0 35 . -10.589 0.869 0.614 1.00 98.92 35 A 1 ATOM 279 O O . LEU A 0 35 . -7.880 2.087 0.573 1.00 98.92 35 A 1 ATOM 280 C CG . LEU A 0 35 . -10.524 0.099 -0.716 1.00 98.92 35 A 1 ATOM 281 C CD1 . LEU A 0 35 . -10.809 -1.394 -0.527 1.00 98.92 35 A 1 ATOM 282 C CD2 . LEU A 0 35 . -11.553 0.664 -1.693 1.00 98.92 35 A 1 ATOM 283 N N . ILE A 0 36 . -7.096 0.038 1.064 1.00 98.93 36 A 1 ATOM 284 C CA . ILE A 0 36 . -5.725 0.266 0.595 1.00 98.93 36 A 1 ATOM 285 C C . ILE A 0 36 . -5.596 -0.254 -0.836 1.00 98.93 36 A 1 ATOM 286 C CB . ILE A 0 36 . -4.692 -0.377 1.547 1.00 98.93 36 A 1 ATOM 287 O O . ILE A 0 36 . -5.909 -1.417 -1.101 1.00 98.93 36 A 1 ATOM 288 C CG1 . ILE A 0 36 . -4.841 0.195 2.978 1.00 98.93 36 A 1 ATOM 289 C CG2 . ILE A 0 36 . -3.277 -0.137 0.987 1.00 98.93 36 A 1 ATOM 290 C CD1 . ILE A 0 36 . -3.944 -0.473 4.023 1.00 98.93 36 A 1 ATOM 291 N N . VAL A 0 37 . -5.125 0.590 -1.758 1.00 98.92 37 A 1 ATOM 292 C CA . VAL A 0 37 . -5.078 0.288 -3.198 1.00 98.92 37 A 1 ATOM 293 C C . VAL A 0 37 . -3.713 0.646 -3.783 1.00 98.92 37 A 1 ATOM 294 C CB . VAL A 0 37 . -6.203 1.034 -3.953 1.00 98.92 37 A 1 ATOM 295 O O . VAL A 0 37 . -3.231 1.759 -3.580 1.00 98.92 37 A 1 ATOM 296 C CG1 . VAL A 0 37 . -6.314 0.535 -5.402 1.00 98.92 37 A 1 ATOM 297 C CG2 . VAL A 0 37 . -7.573 0.876 -3.274 1.00 98.92 37 A 1 ATOM 298 N N . ASN A 0 38 . -3.096 -0.258 -4.555 1.00 98.86 38 A 1 ATOM 299 C CA . ASN A 0 38 . -1.924 0.097 -5.365 1.00 98.86 38 A 1 ATOM 300 C C . ASN A 0 38 . -2.386 0.684 -6.701 1.00 98.86 38 A 1 ATOM 301 C CB . ASN A 0 38 . -0.957 -1.086 -5.537 1.00 98.86 38 A 1 ATOM 302 O O . ASN A 0 38 . -3.186 0.058 -7.391 1.00 98.86 38 A 1 ATOM 303 C CG . ASN A 0 38 . -1.483 -2.209 -6.412 1.00 98.86 38 A 1 ATOM 304 N ND2 . ASN A 0 38 . -0.906 -2.431 -7.569 1.00 98.86 38 A 1 ATOM 305 O OD1 . ASN A 0 38 . -2.394 -2.936 -6.063 1.00 98.86 38 A 1 ATOM 306 N N . VAL A 0 39 . -1.904 1.858 -7.091 1.00 98.86 39 A 1 ATOM 307 C CA . VAL A 0 39 . -2.453 2.606 -8.235 1.00 98.86 39 A 1 ATOM 308 C C . VAL A 0 39 . -1.424 2.846 -9.342 1.00 98.86 39 A 1 ATOM 309 C CB . VAL A 0 39 . -3.150 3.902 -7.780 1.00 98.86 39 A 1 ATOM 310 O O . VAL A 0 39 . -0.220 2.695 -9.131 1.00 98.86 39 A 1 ATOM 311 C CG1 . VAL A 0 39 . -4.320 3.610 -6.830 1.00 98.86 39 A 1 ATOM 312 C CG2 . VAL A 0 39 . -2.202 4.892 -7.102 1.00 98.86 39 A 1 ATOM 313 N N . ALA A 0 40 . -1.941 3.153 -10.534 1.00 98.63 40 A 1 ATOM 314 C CA . ALA A 0 40 . -1.184 3.516 -11.730 1.00 98.63 40 A 1 ATOM 315 C C . ALA A 0 40 . -1.958 4.559 -12.557 1.00 98.63 40 A 1 ATOM 316 C CB . ALA A 0 40 . -0.900 2.256 -12.543 1.00 98.63 40 A 1 ATOM 317 O O . ALA A 0 40 . -3.162 4.387 -12.775 1.00 98.63 40 A 1 ATOM 318 N N . CYS A 0 41 . -1.312 5.600 -13.081 1.00 98.36 41 A 1 ATOM 319 C CA . CYS A 0 41 . -1.945 6.611 -13.932 1.00 98.36 41 A 1 ATOM 320 C C . CYS A 0 41 . -2.079 6.192 -15.405 1.00 98.36 41 A 1 ATOM 321 C CB . CYS A 0 41 . -1.162 7.923 -13.832 1.00 98.36 41 A 1 ATOM 322 O O . CYS A 0 41 . -2.973 6.682 -16.094 1.00 98.36 41 A 1 ATOM 323 S SG . CYS A 0 41 . -1.332 8.674 -12.187 1.00 98.36 41 A 1 ATOM 324 N N . LYS A 0 42 . -1.221 5.291 -15.905 1.00 97.66 42 A 1 ATOM 325 C CA . LYS A 0 42 . -1.180 4.857 -17.318 1.00 97.66 42 A 1 ATOM 326 C C . LYS A 0 42 . -1.642 3.410 -17.521 1.00 97.66 42 A 1 ATOM 327 C CB . LYS A 0 42 . 0.210 5.111 -17.926 1.00 97.66 42 A 1 ATOM 328 O O . LYS A 0 42 . -1.060 2.666 -18.307 1.00 97.66 42 A 1 ATOM 329 C CG . LYS A 0 42 . 0.629 6.585 -17.918 1.00 97.66 42 A 1 ATOM 330 C CD . LYS A 0 42 . 1.913 6.742 -18.741 1.00 97.66 42 A 1 ATOM 331 C CE . LYS A 0 42 . 2.283 8.219 -18.864 1.00 97.66 42 A 1 ATOM 332 N NZ . LYS A 0 42 . 3.444 8.419 -19.767 1.00 97.66 42 A 1 ATOM 333 N N . CYS A 0 43 . -2.671 2.984 -16.794 1.00 95.72 43 A 1 ATOM 334 C CA . CYS A 0 43 . -3.253 1.649 -16.908 1.00 95.72 43 A 1 ATOM 335 C C . CYS A 0 43 . -4.627 1.712 -17.592 1.00 95.72 43 A 1 ATOM 336 C CB . CYS A 0 43 . -3.335 1.052 -15.499 1.00 95.72 43 A 1 ATOM 337 O O . CYS A 0 43 . -5.408 2.628 -17.348 1.00 95.72 43 A 1 ATOM 338 S SG . CYS A 0 43 . -3.875 -0.679 -15.546 1.00 95.72 43 A 1 ATOM 339 N N . GLY A 0 44 . -4.992 0.693 -18.377 1.00 96.65 44 A 1 ATOM 340 C CA . GLY A 0 44 . -6.343 0.593 -18.955 1.00 96.65 44 A 1 ATOM 341 C C . GLY A 0 44 . -7.465 0.542 -17.904 1.00 96.65 44 A 1 ATOM 342 O O . GLY A 0 44 . -8.611 0.860 -18.199 1.00 96.65 44 A 1 ATOM 343 N N . ALA A 0 45 . -7.135 0.194 -16.655 1.00 97.27 45 A 1 ATOM 344 C CA . ALA A 0 45 . -8.071 0.163 -15.535 1.00 97.27 45 A 1 ATOM 345 C C . ALA A 0 45 . -8.142 1.486 -14.739 1.00 97.27 45 A 1 ATOM 346 C CB . ALA A 0 45 . -7.687 -1.031 -14.652 1.00 97.27 45 A 1 ATOM 347 O O . ALA A 0 45 . -8.987 1.602 -13.848 1.00 97.27 45 A 1 ATOM 348 N N . THR A 0 46 . -7.280 2.470 -15.035 1.00 98.33 46 A 1 ATOM 349 C CA . THR A 0 46 . -7.132 3.718 -14.264 1.00 98.33 46 A 1 ATOM 350 C C . THR A 0 46 . -8.448 4.480 -14.165 1.00 98.33 46 A 1 ATOM 351 C CB . THR A 0 46 . -6.036 4.602 -14.893 1.00 98.33 46 A 1 ATOM 352 O O . THR A 0 46 . -8.926 4.754 -13.067 1.00 98.33 46 A 1 ATOM 353 C CG2 . THR A 0 46 . -5.820 5.946 -14.211 1.00 98.33 46 A 1 ATOM 354 O OG1 . THR A 0 46 . -4.796 3.938 -14.823 1.00 98.33 46 A 1 ATOM 355 N N . ASP A 0 47 . -9.065 4.760 -15.309 1.00 98.41 47 A 1 ATOM 356 C CA . ASP A 0 47 . -10.268 5.582 -15.413 1.00 98.41 47 A 1 ATOM 357 C C . ASP A 0 47 . -11.453 5.018 -14.614 1.00 98.41 47 A 1 ATOM 358 C CB . ASP A 0 47 . -10.613 5.695 -16.909 1.00 98.41 47 A 1 ATOM 359 O O . ASP A 0 47 . -12.145 5.764 -13.922 1.00 98.41 47 A 1 ATOM 360 C CG . ASP A 0 47 . -10.126 7.013 -17.511 1.00 98.41 47 A 1 ATOM 361 O OD1 . ASP A 0 47 . -8.943 7.358 -17.329 1.00 98.41 47 A 1 ATOM 362 O OD2 . ASP A 0 47 . -10.957 7.720 -18.123 1.00 98.41 47 A 1 ATOM 363 N N . LYS A 0 48 . -11.681 3.699 -14.685 1.00 98.53 48 A 1 ATOM 364 C CA . LYS A 0 48 . -12.750 3.027 -13.930 1.00 98.53 48 A 1 ATOM 365 C C . LYS A 0 48 . -12.468 3.071 -12.430 1.00 98.53 48 A 1 ATOM 366 C CB . LYS A 0 48 . -12.935 1.582 -14.438 1.00 98.53 48 A 1 ATOM 367 O O . LYS A 0 48 . -13.354 3.417 -11.656 1.00 98.53 48 A 1 ATOM 368 C CG . LYS A 0 48 . -14.042 0.822 -13.678 1.00 98.53 48 A 1 ATOM 369 C CD . LYS A 0 48 . -14.219 -0.622 -14.181 1.00 98.53 48 A 1 ATOM 370 C CE . LYS A 0 48 . -15.259 -1.344 -13.307 1.00 98.53 48 A 1 ATOM 371 N NZ . LYS A 0 48 . -15.461 -2.771 -13.683 1.00 98.53 48 A 1 ATOM 372 N N . ASN A 0 49 . -11.249 2.720 -12.017 1.00 98.80 49 A 1 ATOM 373 C CA . ASN A 0 49 . -10.926 2.607 -10.596 1.00 98.80 49 A 1 ATOM 374 C C . ASN A 0 49 . -10.961 3.970 -9.899 1.00 98.80 49 A 1 ATOM 375 C CB . ASN A 0 49 . -9.581 1.893 -10.393 1.00 98.80 49 A 1 ATOM 376 O O . ASN A 0 49 . -11.634 4.091 -8.883 1.00 98.80 49 A 1 ATOM 377 C CG . ASN A 0 49 . -9.696 0.387 -10.526 1.00 98.80 49 A 1 ATOM 378 N ND2 . ASN A 0 49 . -9.569 -0.145 -11.714 1.00 98.80 49 A 1 ATOM 379 O OD1 . ASN A 0 49 . -9.914 -0.343 -9.571 1.00 98.80 49 A 1 ATOM 380 N N . TYR A 0 50 . -10.303 5.000 -10.441 1.00 98.82 50 A 1 ATOM 381 C CA . TYR A 0 50 . -10.261 6.310 -9.783 1.00 98.82 50 A 1 ATOM 382 C C . TYR A 0 50 . -11.645 6.956 -9.654 1.00 98.82 50 A 1 ATOM 383 C CB . TYR A 0 50 . -9.293 7.249 -10.507 1.00 98.82 50 A 1 ATOM 384 O O . TYR A 0 50 . -11.965 7.460 -8.581 1.00 98.82 50 A 1 ATOM 385 C CG . TYR A 0 50 . -7.847 7.091 -10.080 1.00 98.82 50 A 1 ATOM 386 C CD1 . TYR A 0 50 . -7.439 7.608 -8.838 1.00 98.82 50 A 1 ATOM 387 C CD2 . TYR A 0 50 . -6.905 6.470 -10.919 1.00 98.82 50 A 1 ATOM 388 C CE1 . TYR A 0 50 . -6.095 7.508 -8.434 1.00 98.82 50 A 1 ATOM 389 C CE2 . TYR A 0 50 . -5.550 6.394 -10.534 1.00 98.82 50 A 1 ATOM 390 O OH . TYR A 0 50 . -3.835 6.914 -8.935 1.00 98.82 50 A 1 ATOM 391 C CZ . TYR A 0 50 . -5.143 6.924 -9.294 1.00 98.82 50 A 1 ATOM 392 N N . ARG A 0 51 . -12.488 6.897 -10.699 1.00 98.71 51 A 1 ATOM 393 C CA . ARG A 0 51 . -13.849 7.460 -10.634 1.00 98.71 51 A 1 ATOM 394 C C . ARG A 0 51 . -14.702 6.775 -9.566 1.00 98.71 51 A 1 ATOM 395 C CB . ARG A 0 51 . -14.549 7.399 -12.001 1.00 98.71 51 A 1 ATOM 396 O O . ARG A 0 51 . -15.330 7.465 -8.771 1.00 98.71 51 A 1 ATOM 397 C CG . ARG A 0 51 . -13.965 8.398 -13.010 1.00 98.71 51 A 1 ATOM 398 C CD . ARG A 0 51 . -14.828 8.428 -14.280 1.00 98.71 51 A 1 ATOM 399 N NE . ARG A 0 51 . -14.221 9.264 -15.339 1.00 98.71 51 A 1 ATOM 400 N NH1 . ARG A 0 51 . -13.241 7.576 -16.543 1.00 98.71 51 A 1 ATOM 401 N NH2 . ARG A 0 51 . -12.940 9.637 -17.210 1.00 98.71 51 A 1 ATOM 402 C CZ . ARG A 0 51 . -13.491 8.832 -16.352 1.00 98.71 51 A 1 ATOM 403 N N . GLN A 0 52 . -14.689 5.441 -9.512 1.00 98.81 52 A 1 ATOM 404 C CA . GLN A 0 52 . -15.470 4.708 -8.510 1.00 98.81 52 A 1 ATOM 405 C C . GLN A 0 52 . -14.926 4.916 -7.090 1.00 98.81 52 A 1 ATOM 406 C CB . GLN A 0 52 . -15.523 3.216 -8.848 1.00 98.81 52 A 1 ATOM 407 O O . GLN A 0 52 . -15.707 5.152 -6.176 1.00 98.81 52 A 1 ATOM 408 C CG . GLN A 0 52 . -16.278 2.917 -10.149 1.00 98.81 52 A 1 ATOM 409 C CD . GLN A 0 52 . -16.498 1.423 -10.371 1.00 98.81 52 A 1 ATOM 410 N NE2 . GLN A 0 52 . -17.152 1.038 -11.444 1.00 98.81 52 A 1 ATOM 411 O OE1 . GLN A 0 52 . -16.093 0.557 -9.612 1.00 98.81 52 A 1 ATOM 412 N N . LEU A 0 53 . -13.600 4.898 -6.897 1.00 98.87 53 A 1 ATOM 413 C CA . LEU A 0 53 . -12.986 5.177 -5.592 1.00 98.87 53 A 1 ATOM 414 C C . LEU A 0 53 . -13.336 6.583 -5.093 1.00 98.87 53 A 1 ATOM 415 C CB . LEU A 0 53 . -11.455 5.025 -5.676 1.00 98.87 53 A 1 ATOM 416 O O . LEU A 0 53 . -13.680 6.739 -3.925 1.00 98.87 53 A 1 ATOM 417 C CG . LEU A 0 53 . -10.953 3.579 -5.823 1.00 98.87 53 A 1 ATOM 418 C CD1 . LEU A 0 53 . -9.471 3.578 -6.206 1.00 98.87 53 A 1 ATOM 419 C CD2 . LEU A 0 53 . -11.103 2.760 -4.542 1.00 98.87 53 A 1 ATOM 420 N N . GLN A 0 54 . -13.278 7.598 -5.961 1.00 98.81 54 A 1 ATOM 421 C CA . GLN A 0 54 . -13.623 8.964 -5.573 1.00 98.81 54 A 1 ATOM 422 C C . GLN A 0 54 . -15.107 9.096 -5.217 1.00 98.81 54 A 1 ATOM 423 C CB . GLN A 0 54 . -13.219 9.951 -6.681 1.00 98.81 54 A 1 ATOM 424 O O . GLN A 0 54 . -15.435 9.711 -4.208 1.00 98.81 54 A 1 ATOM 425 C CG . GLN A 0 54 . -13.594 11.402 -6.326 1.00 98.81 54 A 1 ATOM 426 C CD . GLN A 0 54 . -13.056 11.839 -4.966 1.00 98.81 54 A 1 ATOM 427 N NE2 . GLN A 0 54 . -13.849 12.470 -4.131 1.00 98.81 54 A 1 ATOM 428 O OE1 . GLN A 0 54 . -11.926 11.566 -4.594 1.00 98.81 54 A 1 ATOM 429 N N . GLU A 0 55 . -15.999 8.499 -6.006 1.00 98.68 55 A 1 ATOM 430 C CA . GLU A 0 55 . -17.436 8.513 -5.726 1.00 98.68 55 A 1 ATOM 431 C C . GLU A 0 55 . -17.750 7.836 -4.377 1.00 98.68 55 A 1 ATOM 432 C CB . GLU A 0 55 . -18.147 7.865 -6.923 1.00 98.68 55 A 1 ATOM 433 O O . GLU A 0 55 . -18.406 8.433 -3.519 1.00 98.68 55 A 1 ATOM 434 C CG . GLU A 0 55 . -19.663 8.073 -6.937 1.00 98.68 55 A 1 ATOM 435 C CD . GLU A 0 55 . -20.407 7.247 -5.888 1.00 98.68 55 A 1 ATOM 436 O OE1 . GLU A 0 55 . -21.376 7.785 -5.329 1.00 98.68 55 A 1 ATOM 437 O OE2 . GLU A 0 55 . -20.030 6.080 -5.627 1.00 98.68 55 A 1 ATOM 438 N N . MET A 0 56 . -17.181 6.649 -4.130 1.00 98.60 56 A 1 ATOM 439 C CA . MET A 0 56 . -17.305 5.954 -2.845 1.00 98.60 56 A 1 ATOM 440 C C . MET A 0 56 . -16.736 6.780 -1.693 1.00 98.60 56 A 1 ATOM 441 C CB . MET A 0 56 . -16.554 4.619 -2.873 1.00 98.60 56 A 1 ATOM 442 O O . MET A 0 56 . -17.354 6.856 -0.632 1.00 98.60 56 A 1 ATOM 443 C CG . MET A 0 56 . -17.223 3.577 -3.761 1.00 98.60 56 A 1 ATOM 444 S SD . MET A 0 56 . -16.257 2.055 -3.899 1.00 98.60 56 A 1 ATOM 445 C CE . MET A 0 56 . -16.582 1.344 -2.268 1.00 98.60 56 A 1 ATOM 446 N N . HIS A 0 57 . -15.572 7.411 -1.883 1.00 98.66 57 A 1 ATOM 447 C CA . HIS A 0 57 . -14.992 8.301 -0.882 1.00 98.66 57 A 1 ATOM 448 C C . HIS A 0 57 . -15.969 9.426 -0.537 1.00 98.66 57 A 1 ATOM 449 C CB . HIS A 0 57 . -13.649 8.857 -1.367 1.00 98.66 57 A 1 ATOM 450 O O . HIS A 0 57 . -16.302 9.588 0.633 1.00 98.66 57 A 1 ATOM 451 C CG . HIS A 0 57 . -13.076 9.881 -0.428 1.00 98.66 57 A 1 ATOM 452 C CD2 . HIS A 0 57 . -13.211 11.238 -0.534 1.00 98.66 57 A 1 ATOM 453 N ND1 . HIS A 0 57 . -12.360 9.631 0.720 1.00 98.66 57 A 1 ATOM 454 C CE1 . HIS A 0 57 . -12.035 10.814 1.270 1.00 98.66 57 A 1 ATOM 455 N NE2 . HIS A 0 57 . -12.549 11.818 0.548 1.00 98.66 57 A 1 ATOM 456 N N . THR A 0 58 . -16.492 10.143 -1.534 1.00 98.62 58 A 1 ATOM 457 C CA . THR A 0 58 . -17.447 11.239 -1.324 1.00 98.62 58 A 1 ATOM 458 C C . THR A 0 58 . -18.663 10.796 -0.505 1.00 98.62 58 A 1 ATOM 459 C CB . THR A 0 58 . -17.880 11.827 -2.676 1.00 98.62 58 A 1 ATOM 460 O O . THR A 0 58 . -19.060 11.504 0.419 1.00 98.62 58 A 1 ATOM 461 C CG2 . THR A 0 58 . -18.944 12.918 -2.551 1.00 98.62 58 A 1 ATOM 462 O OG1 . THR A 0 58 . -16.778 12.454 -3.298 1.00 98.62 58 A 1 ATOM 463 N N . ARG A 0 59 . -19.235 9.616 -0.777 1.00 98.47 59 A 1 ATOM 464 C CA . ARG A 0 59 . -20.406 9.116 -0.034 1.00 98.47 59 A 1 ATOM 465 C C . ARG A 0 59 . -20.089 8.575 1.358 1.00 98.47 59 A 1 ATOM 466 C CB . ARG A 0 59 . -21.097 8.019 -0.845 1.00 98.47 59 A 1 ATOM 467 O O . ARG A 0 59 . -20.893 8.734 2.276 1.00 98.47 59 A 1 ATOM 468 C CG . ARG A 0 59 . -21.813 8.563 -2.087 1.00 98.47 59 A 1 ATOM 469 C CD . ARG A 0 59 . -22.693 7.466 -2.688 1.00 98.47 59 A 1 ATOM 470 N NE . ARG A 0 59 . -21.874 6.329 -3.115 1.00 98.47 59 A 1 ATOM 471 N NH1 . ARG A 0 59 . -22.661 4.648 -1.768 1.00 98.47 59 A 1 ATOM 472 N NH2 . ARG A 0 59 . -20.972 4.303 -3.195 1.00 98.47 59 A 1 ATOM 473 C CZ . ARG A 0 59 . -21.845 5.098 -2.673 1.00 98.47 59 A 1 ATOM 474 N N . LEU A 0 60 . -18.962 7.882 1.519 1.00 98.43 60 A 1 ATOM 475 C CA . LEU A 0 60 . -18.707 7.030 2.687 1.00 98.43 60 A 1 ATOM 476 C C . LEU A 0 60 . -17.649 7.595 3.645 1.00 98.43 60 A 1 ATOM 477 C CB . LEU A 0 60 . -18.372 5.602 2.216 1.00 98.43 60 A 1 ATOM 478 O O . LEU A 0 60 . -17.515 7.093 4.764 1.00 98.43 60 A 1 ATOM 479 C CG . LEU A 0 60 . -19.438 4.925 1.328 1.00 98.43 60 A 1 ATOM 480 C CD1 . LEU A 0 60 . -18.952 3.544 0.893 1.00 98.43 60 A 1 ATOM 481 C CD2 . LEU A 0 60 . -20.771 4.760 2.060 1.00 98.43 60 A 1 ATOM 482 N N . VAL A 0 61 . -16.936 8.666 3.277 1.00 98.23 61 A 1 ATOM 483 C CA . VAL A 0 61 . -15.922 9.296 4.144 1.00 98.23 61 A 1 ATOM 484 C C . VAL A 0 61 . -16.511 9.745 5.484 1.00 98.23 61 A 1 ATOM 485 C CB . VAL A 0 61 . -15.190 10.445 3.416 1.00 98.23 61 A 1 ATOM 486 O O . VAL A 0 61 . -15.907 9.497 6.531 1.00 98.23 61 A 1 ATOM 487 C CG1 . VAL A 0 61 . -16.090 11.643 3.082 1.00 98.23 61 A 1 ATOM 488 C CG2 . VAL A 0 61 . -13.982 10.947 4.210 1.00 98.23 61 A 1 ATOM 489 N N . GLY A 0 62 . -17.726 10.307 5.478 1.00 97.59 62 A 1 ATOM 490 C CA . GLY A 0 62 . -18.441 10.730 6.689 1.00 97.59 62 A 1 ATOM 491 C C . GLY A 0 62 . -18.918 9.575 7.577 1.00 97.59 62 A 1 ATOM 492 O O . GLY A 0 62 . -19.158 9.776 8.761 1.00 97.59 62 A 1 ATOM 493 N N . LYS A 0 63 . -19.012 8.353 7.033 1.00 97.62 63 A 1 ATOM 494 C CA . LYS A 0 63 . -19.361 7.130 7.783 1.00 97.62 63 A 1 ATOM 495 C C . LYS A 0 63 . -18.131 6.411 8.352 1.00 97.62 63 A 1 ATOM 496 C CB . LYS A 0 63 . -20.191 6.195 6.889 1.00 97.62 63 A 1 ATOM 497 O O . LYS A 0 63 . -18.262 5.504 9.174 1.00 97.62 63 A 1 ATOM 498 C CG . LYS A 0 63 . -21.549 6.804 6.502 1.00 97.62 63 A 1 ATOM 499 C CD . LYS A 0 63 . -22.323 5.843 5.589 1.00 97.62 63 A 1 ATOM 500 C CE . LYS A 0 63 . -23.677 6.413 5.146 1.00 97.62 63 A 1 ATOM 501 N NZ . LYS A 0 63 . -24.703 6.321 6.216 1.00 97.62 63 A 1 ATOM 502 N N . GLY A 0 64 . -16.936 6.827 7.933 1.00 98.12 64 A 1 ATOM 503 C CA . GLY A 0 64 . -15.667 6.306 8.430 1.00 98.12 64 A 1 ATOM 504 C C . GLY A 0 64 . -14.827 5.548 7.403 1.00 98.12 64 A 1 ATOM 505 O O . GLY A 0 64 . -13.843 4.936 7.808 1.00 98.12 64 A 1 ATOM 506 N N . LEU A 0 65 . -15.165 5.584 6.106 1.00 98.78 65 A 1 ATOM 507 C CA . LEU A 0 65 . -14.292 5.032 5.063 1.00 98.78 65 A 1 ATOM 508 C C . LEU A 0 65 . -13.073 5.938 4.844 1.00 98.78 65 A 1 ATOM 509 C CB . LEU A 0 65 . -15.070 4.818 3.749 1.00 98.78 65 A 1 ATOM 510 O O . LEU A 0 65 . -13.192 7.162 4.739 1.00 98.78 65 A 1 ATOM 511 C CG . LEU A 0 65 . -14.222 4.230 2.596 1.00 98.78 65 A 1 ATOM 512 C CD1 . LEU A 0 65 . -13.718 2.816 2.893 1.00 98.78 65 A 1 ATOM 513 C CD2 . LEU A 0 65 . -15.030 4.182 1.302 1.00 98.78 65 A 1 ATOM 514 N N . ARG A 0 66 . -11.892 5.338 4.714 1.00 98.85 66 A 1 ATOM 515 C CA . ARG A 0 66 . -10.649 6.000 4.307 1.00 98.85 66 A 1 ATOM 516 C C . ARG A 0 66 . -10.030 5.214 3.157 1.00 98.85 66 A 1 ATOM 517 C CB . ARG A 0 66 . -9.710 6.113 5.522 1.00 98.85 66 A 1 ATOM 518 O O . ARG A 0 66 . -9.843 4.008 3.259 1.00 98.85 66 A 1 ATOM 519 C CG . ARG A 0 66 . -10.299 6.981 6.651 1.00 98.85 66 A 1 ATOM 520 C CD . ARG A 0 66 . -10.338 8.472 6.292 1.00 98.85 66 A 1 ATOM 521 N NE . ARG A 0 66 . -10.926 9.263 7.389 1.00 98.85 66 A 1 ATOM 522 N NH1 . ARG A 0 66 . -13.141 9.071 6.793 1.00 98.85 66 A 1 ATOM 523 N NH2 . ARG A 0 66 . -12.591 10.260 8.576 1.00 98.85 66 A 1 ATOM 524 C CZ . ARG A 0 66 . -12.207 9.532 7.572 1.00 98.85 66 A 1 ATOM 525 N N . ILE A 0 67 . -9.749 5.880 2.042 1.00 98.90 67 A 1 ATOM 526 C CA . ILE A 0 67 . -9.087 5.255 0.890 1.00 98.90 67 A 1 ATOM 527 C C . ILE A 0 67 . -7.636 5.721 0.895 1.00 98.90 67 A 1 ATOM 528 C CB . ILE A 0 67 . -9.825 5.548 -0.433 1.00 98.90 67 A 1 ATOM 529 O O . ILE A 0 67 . -7.384 6.920 0.997 1.00 98.90 67 A 1 ATOM 530 C CG1 . ILE A 0 67 . -11.283 5.040 -0.357 1.00 98.90 67 A 1 ATOM 531 C CG2 . ILE A 0 67 . -9.059 4.941 -1.625 1.00 98.90 67 A 1 ATOM 532 C CD1 . ILE A 0 67 . -12.085 5.249 -1.643 1.00 98.90 67 A 1 ATOM 533 N N . LEU A 0 68 . -6.706 4.769 0.827 1.00 98.92 68 A 1 ATOM 534 C CA . LEU A 0 68 . -5.268 5.018 0.827 1.00 98.92 68 A 1 ATOM 535 C C . LEU A 0 68 . -4.685 4.491 -0.486 1.00 98.92 68 A 1 ATOM 536 C CB . LEU A 0 68 . -4.591 4.343 2.034 1.00 98.92 68 A 1 ATOM 537 O O . LEU A 0 68 . -4.667 3.280 -0.727 1.00 98.92 68 A 1 ATOM 538 C CG . LEU A 0 68 . -4.863 4.921 3.438 1.00 98.92 68 A 1 ATOM 539 C CD1 . LEU A 0 68 . -6.286 4.676 3.943 1.00 98.92 68 A 1 ATOM 540 C CD2 . LEU A 0 68 . -3.895 4.249 4.415 1.00 98.92 68 A 1 ATOM 541 N N . ALA A 0 69 . -4.223 5.398 -1.341 1.00 98.93 69 A 1 ATOM 542 C CA . ALA A 0 69 . -3.738 5.068 -2.675 1.00 98.93 69 A 1 ATOM 543 C C . ALA A 0 69 . -2.211 5.181 -2.762 1.00 98.93 69 A 1 ATOM 544 C CB . ALA A 0 69 . -4.461 5.959 -3.679 1.00 98.93 69 A 1 ATOM 545 O O . ALA A 0 69 . -1.639 6.250 -2.557 1.00 98.93 69 A 1 ATOM 546 N N . PHE A 0 70 . -1.567 4.067 -3.109 1.00 98.93 70 A 1 ATOM 547 C CA . PHE A 0 70 . -0.113 3.929 -3.189 1.00 98.93 70 A 1 ATOM 548 C C . PHE A 0 70 . 0.328 3.734 -4.644 1.00 98.93 70 A 1 ATOM 549 C CB . PHE A 0 70 . 0.325 2.747 -2.322 1.00 98.93 70 A 1 ATOM 550 O O . PHE A 0 70 . 0.140 2.640 -5.193 1.00 98.93 70 A 1 ATOM 551 C CG . PHE A 0 70 . 0.186 2.999 -0.838 1.00 98.93 70 A 1 ATOM 552 C CD1 . PHE A 0 70 . 1.258 3.562 -0.121 1.00 98.93 70 A 1 ATOM 553 C CD2 . PHE A 0 70 . -1.017 2.692 -0.175 1.00 98.93 70 A 1 ATOM 554 C CE1 . PHE A 0 70 . 1.130 3.808 1.255 1.00 98.93 70 A 1 ATOM 555 C CE2 . PHE A 0 70 . -1.137 2.930 1.205 1.00 98.93 70 A 1 ATOM 556 C CZ . PHE A 0 70 . -0.067 3.492 1.919 1.00 98.93 70 A 1 ATOM 557 N N . PRO A 0 71 . 0.896 4.758 -5.299 1.00 98.86 71 A 1 ATOM 558 C CA . PRO A 0 71 . 1.424 4.628 -6.651 1.00 98.86 71 A 1 ATOM 559 C C . PRO A 0 71 . 2.486 3.525 -6.735 1.00 98.86 71 A 1 ATOM 560 C CB . PRO A 0 71 . 1.964 6.016 -7.011 1.00 98.86 71 A 1 ATOM 561 O O . PRO A 0 71 . 3.344 3.400 -5.859 1.00 98.86 71 A 1 ATOM 562 C CG . PRO A 0 71 . 1.196 6.966 -6.097 1.00 98.86 71 A 1 ATOM 563 C CD . PRO A 0 71 . 1.013 6.133 -4.838 1.00 98.86 71 A 1 ATOM 564 N N . CYS A 0 72 . 2.446 2.704 -7.786 1.00 98.81 72 A 1 ATOM 565 C CA . CYS A 0 72 . 3.405 1.617 -7.968 1.00 98.81 72 A 1 ATOM 566 C C . CYS A 0 72 . 3.749 1.394 -9.442 1.00 98.81 72 A 1 ATOM 567 C CB . CYS A 0 72 . 2.840 0.338 -7.346 1.00 98.81 72 A 1 ATOM 568 O O . CYS A 0 72 . 2.885 1.108 -10.265 1.00 98.81 72 A 1 ATOM 569 S SG . CYS A 0 72 . 4.133 -0.936 -7.376 1.00 98.81 72 A 1 ATOM 570 N N . ASN A 0 73 . 5.043 1.436 -9.768 1.00 98.67 73 A 1 ATOM 571 C CA . ASN A 0 73 . 5.513 1.302 -11.149 1.00 98.67 73 A 1 ATOM 572 C C . ASN A 0 73 . 5.955 -0.127 -11.534 1.00 98.67 73 A 1 ATOM 573 C CB . ASN A 0 73 . 6.595 2.365 -11.403 1.00 98.67 73 A 1 ATOM 574 O O . ASN A 0 73 . 6.567 -0.325 -12.580 1.00 98.67 73 A 1 ATOM 575 C CG . ASN A 0 73 . 6.756 2.669 -12.880 1.00 98.67 73 A 1 ATOM 576 N ND2 . ASN A 0 73 . 7.942 2.994 -13.337 1.00 98.67 73 A 1 ATOM 577 O OD1 . ASN A 0 73 . 5.809 2.641 -13.643 1.00 98.67 73 A 1 ATOM 578 N N . GLN A 0 74 . 5.685 -1.139 -10.698 1.00 98.65 74 A 1 ATOM 579 C CA . GLN A 0 74 . 6.155 -2.518 -10.930 1.00 98.65 74 A 1 ATOM 580 C C . GLN A 0 74 . 5.387 -3.265 -12.032 1.00 98.65 74 A 1 ATOM 581 C CB . GLN A 0 74 . 6.114 -3.324 -9.620 1.00 98.65 74 A 1 ATOM 582 O O . GLN A 0 74 . 5.811 -4.340 -12.451 1.00 98.65 74 A 1 ATOM 583 C CG . GLN A 0 74 . 7.146 -2.825 -8.601 1.00 98.65 74 A 1 ATOM 584 C CD . GLN A 0 74 . 7.215 -3.731 -7.379 1.00 98.65 74 A 1 ATOM 585 N NE2 . GLN A 0 74 . 8.277 -4.486 -7.196 1.00 98.65 74 A 1 ATOM 586 O OE1 . GLN A 0 74 . 6.319 -3.777 -6.556 1.00 98.65 74 A 1 ATOM 587 N N . PHE A 0 75 . 4.262 -2.723 -12.499 1.00 98.48 75 A 1 ATOM 588 C CA . PHE A 0 75 . 3.341 -3.408 -13.402 1.00 98.48 75 A 1 ATOM 589 C C . PHE A 0 75 . 3.269 -2.668 -14.738 1.00 98.48 75 A 1 ATOM 590 C CB . PHE A 0 75 . 1.977 -3.515 -12.719 1.00 98.48 75 A 1 ATOM 591 O O . PHE A 0 75 . 2.581 -1.654 -14.869 1.00 98.48 75 A 1 ATOM 592 C CG . PHE A 0 75 . 2.027 -4.090 -11.321 1.00 98.48 75 A 1 ATOM 593 C CD1 . PHE A 0 75 . 2.267 -5.461 -11.127 1.00 98.48 75 A 1 ATOM 594 C CD2 . PHE A 0 75 . 1.895 -3.236 -10.210 1.00 98.48 75 A 1 ATOM 595 C CE1 . PHE A 0 75 . 2.361 -5.976 -9.825 1.00 98.48 75 A 1 ATOM 596 C CE2 . PHE A 0 75 . 1.981 -3.751 -8.910 1.00 98.48 75 A 1 ATOM 597 C CZ . PHE A 0 75 . 2.221 -5.120 -8.720 1.00 98.48 75 A 1 ATOM 598 N N . GLY A 0 76 . 4.040 -3.147 -15.716 1.00 97.46 76 A 1 ATOM 599 C CA . GLY A 0 76 . 4.083 -2.584 -17.069 1.00 97.46 76 A 1 ATOM 600 C C . GLY A 0 76 . 4.621 -1.152 -17.163 1.00 97.46 76 A 1 ATOM 601 O O . GLY A 0 76 . 4.358 -0.489 -18.159 1.00 97.46 76 A 1 ATOM 602 N N . GLY A 0 77 . 5.312 -0.644 -16.134 1.00 97.84 77 A 1 ATOM 603 C CA . GLY A 0 77 . 5.817 0.734 -16.133 1.00 97.84 77 A 1 ATOM 604 C C . GLY A 0 77 . 4.707 1.797 -16.180 1.00 97.84 77 A 1 ATOM 605 O O . GLY A 0 77 . 4.912 2.879 -16.727 1.00 97.84 77 A 1 ATOM 606 N N . GLN A 0 78 . 3.514 1.474 -15.663 1.00 98.05 78 A 1 ATOM 607 C CA . GLN A 0 78 . 2.300 2.288 -15.812 1.00 98.05 78 A 1 ATOM 608 C C . GLN A 0 78 . 2.161 3.428 -14.786 1.00 98.05 78 A 1 ATOM 609 C CB . GLN A 0 78 . 1.064 1.371 -15.831 1.00 98.05 78 A 1 ATOM 610 O O . GLN A 0 78 . 1.146 4.123 -14.791 1.00 98.05 78 A 1 ATOM 611 C CG . GLN A 0 78 . 1.054 0.471 -17.077 1.00 98.05 78 A 1 ATOM 612 C CD . GLN A 0 78 . -0.183 -0.412 -17.211 1.00 98.05 78 A 1 ATOM 613 N NE2 . GLN A 0 78 . -0.503 -0.836 -18.413 1.00 98.05 78 A 1 ATOM 614 O OE1 . GLN A 0 78 . -0.885 -0.763 -16.271 1.00 98.05 78 A 1 ATOM 615 N N . GLU A 0 79 . 3.170 3.656 -13.943 1.00 98.38 79 A 1 ATOM 616 C CA . GLU A 0 79 . 3.240 4.780 -13.001 1.00 98.38 79 A 1 ATOM 617 C C . GLU A 0 79 . 4.628 5.461 -13.036 1.00 98.38 79 A 1 ATOM 618 C CB . GLU A 0 79 . 2.823 4.278 -11.606 1.00 98.38 79 A 1 ATOM 619 O O . GLU A 0 79 . 5.361 5.483 -12.037 1.00 98.38 79 A 1 ATOM 620 C CG . GLU A 0 79 . 2.423 5.371 -10.607 1.00 98.38 79 A 1 ATOM 621 C CD . GLU A 0 79 . 1.093 6.038 -10.978 1.00 98.38 79 A 1 ATOM 622 O OE1 . GLU A 0 79 . 1.059 6.662 -12.059 1.00 98.38 79 A 1 ATOM 623 O OE2 . GLU A 0 79 . 0.083 5.828 -10.271 1.00 98.38 79 A 1 ATOM 624 N N . PRO A 0 80 . 5.068 5.966 -14.209 1.00 98.29 80 A 1 ATOM 625 C CA . PRO A 0 80 . 6.450 6.402 -14.408 1.00 98.29 80 A 1 ATOM 626 C C . PRO A 0 80 . 6.746 7.775 -13.795 1.00 98.29 80 A 1 ATOM 627 C CB . PRO A 0 80 . 6.632 6.421 -15.928 1.00 98.29 80 A 1 ATOM 628 O O . PRO A 0 80 . 7.894 8.061 -13.476 1.00 98.29 80 A 1 ATOM 629 C CG . PRO A 0 80 . 5.242 6.796 -16.440 1.00 98.29 80 A 1 ATOM 630 C CD . PRO A 0 80 . 4.316 6.084 -15.456 1.00 98.29 80 A 1 ATOM 631 N N . TRP A 0 81 . 5.726 8.613 -13.623 1.00 98.56 81 A 1 ATOM 632 C CA . TRP A 0 81 . 5.861 10.013 -13.223 1.00 98.56 81 A 1 ATOM 633 C C . TRP A 0 81 . 6.299 10.195 -11.770 1.00 98.56 81 A 1 ATOM 634 C CB . TRP A 0 81 . 4.515 10.687 -13.453 1.00 98.56 81 A 1 ATOM 635 O O . TRP A 0 81 . 6.085 9.297 -10.958 1.00 98.56 81 A 1 ATOM 636 C CG . TRP A 0 81 . 4.011 10.712 -14.858 1.00 98.56 81 A 1 ATOM 637 C CD1 . TRP A 0 81 . 4.757 10.938 -15.962 1.00 98.56 81 A 1 ATOM 638 C CD2 . TRP A 0 81 . 2.628 10.656 -15.310 1.00 98.56 81 A 1 ATOM 639 C CE2 . TRP A 0 81 . 2.610 10.864 -16.722 1.00 98.56 81 A 1 ATOM 640 C CE3 . TRP A 0 81 . 1.383 10.524 -14.661 1.00 98.56 81 A 1 ATOM 641 N NE1 . TRP A 0 81 . 3.936 11.031 -17.068 1.00 98.56 81 A 1 ATOM 642 C CH2 . TRP A 0 81 . 0.194 10.781 -16.782 1.00 98.56 81 A 1 ATOM 643 C CZ2 . TRP A 0 81 . 1.417 10.926 -17.457 1.00 98.56 81 A 1 ATOM 644 C CZ3 . TRP A 0 81 . 0.183 10.598 -15.389 1.00 98.56 81 A 1 ATOM 645 N N . ALA A 0 82 . 6.899 11.336 -11.431 1.00 98.35 82 A 1 ATOM 646 C CA . ALA A 0 82 . 7.162 11.669 -10.035 1.00 98.35 82 A 1 ATOM 647 C C . ALA A 0 82 . 5.855 12.031 -9.301 1.00 98.35 82 A 1 ATOM 648 C CB . ALA A 0 82 . 8.254 12.745 -9.959 1.00 98.35 82 A 1 ATOM 649 O O . ALA A 0 82 . 4.788 12.191 -9.901 1.00 98.35 82 A 1 ATOM 650 N N . GLU A 0 83 . 5.925 12.085 -7.975 1.00 98.67 83 A 1 ATOM 651 C CA . GLU A 0 83 . 4.780 12.257 -7.081 1.00 98.67 83 A 1 ATOM 652 C C . GLU A 0 83 . 3.971 13.526 -7.387 1.00 98.67 83 A 1 ATOM 653 C CB . GLU A 0 83 . 5.282 12.305 -5.629 1.00 98.67 83 A 1 ATOM 654 O O . GLU A 0 83 . 2.740 13.493 -7.348 1.00 98.67 83 A 1 ATOM 655 C CG . GLU A 0 83 . 5.684 10.951 -5.019 1.00 98.67 83 A 1 ATOM 656 C CD . GLU A 0 83 . 7.008 10.342 -5.512 1.00 98.67 83 A 1 ATOM 657 O OE1 . GLU A 0 83 . 7.210 9.146 -5.193 1.00 98.67 83 A 1 ATOM 658 O OE2 . GLU A 0 83 . 7.758 11.004 -6.268 1.00 98.67 83 A 1 ATOM 659 N N . ALA A 0 84 . 4.638 14.627 -7.748 1.00 98.54 84 A 1 ATOM 660 C CA . ALA A 0 84 . 3.986 15.898 -8.057 1.00 98.54 84 A 1 ATOM 661 C C . ALA A 0 84 . 3.077 15.799 -9.295 1.00 98.54 84 A 1 ATOM 662 C CB . ALA A 0 84 . 5.069 16.968 -8.231 1.00 98.54 84 A 1 ATOM 663 O O . ALA A 0 84 . 1.936 16.268 -9.273 1.00 98.54 84 A 1 ATOM 664 N N . GLU A 0 85 . 3.541 15.149 -10.362 1.00 98.65 85 A 1 ATOM 665 C CA . GLU A 0 85 . 2.762 14.920 -11.577 1.00 98.65 85 A 1 ATOM 666 C C . GLU A 0 85 . 1.654 13.886 -11.361 1.00 98.65 85 A 1 ATOM 667 C CB . GLU A 0 85 . 3.663 14.443 -12.719 1.00 98.65 85 A 1 ATOM 668 O O . GLU A 0 85 . 0.558 14.066 -11.892 1.00 98.65 85 A 1 ATOM 669 C CG . GLU A 0 85 . 4.684 15.471 -13.226 1.00 98.65 85 A 1 ATOM 670 C CD . GLU A 0 85 . 5.986 15.526 -12.412 1.00 98.65 85 A 1 ATOM 671 O OE1 . GLU A 0 85 . 6.903 16.239 -12.866 1.00 98.65 85 A 1 ATOM 672 O OE2 . GLU A 0 85 . 6.076 14.835 -11.372 1.00 98.65 85 A 1 ATOM 673 N N . ILE A 0 86 . 1.898 12.839 -10.559 1.00 98.78 86 A 1 ATOM 674 C CA . ILE A 0 86 . 0.851 11.882 -10.160 1.00 98.78 86 A 1 ATOM 675 C C . ILE A 0 86 . -0.265 12.630 -9.431 1.00 98.78 86 A 1 ATOM 676 C CB . ILE A 0 86 . 1.420 10.737 -9.288 1.00 98.78 86 A 1 ATOM 677 O O . ILE A 0 86 . -1.430 12.509 -9.815 1.00 98.78 86 A 1 ATOM 678 C CG1 . ILE A 0 86 . 2.365 9.848 -10.124 1.00 98.78 86 A 1 ATOM 679 C CG2 . ILE A 0 86 . 0.287 9.872 -8.692 1.00 98.78 86 A 1 ATOM 680 C CD1 . ILE A 0 86 . 3.243 8.916 -9.282 1.00 98.78 86 A 1 ATOM 681 N N . LYS A 0 87 . 0.089 13.442 -8.424 1.00 98.72 87 A 1 ATOM 682 C CA . LYS A 0 87 . -0.855 14.261 -7.655 1.00 98.72 87 A 1 ATOM 683 C C . LYS A 0 87 . -1.669 15.148 -8.586 1.00 98.72 87 A 1 ATOM 684 C CB . LYS A 0 87 . -0.097 15.087 -6.602 1.00 98.72 87 A 1 ATOM 685 O O . LYS A 0 87 . -2.892 15.059 -8.569 1.00 98.72 87 A 1 ATOM 686 C CG . LYS A 0 87 . -1.053 15.857 -5.681 1.00 98.72 87 A 1 ATOM 687 C CD . LYS A 0 87 . -0.261 16.650 -4.635 1.00 98.72 87 A 1 ATOM 688 C CE . LYS A 0 87 . -1.216 17.383 -3.689 1.00 98.72 87 A 1 ATOM 689 N NZ . LYS A 0 87 . -0.462 18.168 -2.682 1.00 98.72 87 A 1 ATOM 690 N N . LYS A 0 88 . -0.998 15.928 -9.442 1.00 98.64 88 A 1 ATOM 691 C CA . LYS A 0 88 . -1.639 16.812 -10.425 1.00 98.64 88 A 1 ATOM 692 C C . LYS A 0 88 . -2.615 16.045 -11.319 1.00 98.64 88 A 1 ATOM 693 C CB . LYS A 0 88 . -0.545 17.523 -11.239 1.00 98.64 88 A 1 ATOM 694 O O . LYS A 0 88 . -3.769 16.446 -11.442 1.00 98.64 88 A 1 ATOM 695 C CG . LYS A 0 88 . -1.117 18.511 -12.268 1.00 98.64 88 A 1 ATOM 696 C CD . LYS A 0 88 . 0.011 19.155 -13.087 1.00 98.64 88 A 1 ATOM 697 C CE . LYS A 0 88 . -0.527 19.992 -14.255 1.00 98.64 88 A 1 ATOM 698 N NZ . LYS A 0 88 . -1.124 21.269 -13.811 1.00 98.64 88 A 1 ATOM 699 N N . PHE A 0 89 . -2.185 14.921 -11.894 1.00 98.72 89 A 1 ATOM 700 C CA . PHE A 0 89 . -3.015 14.112 -12.785 1.00 98.72 89 A 1 ATOM 701 C C . PHE A 0 89 . -4.294 13.625 -12.100 1.00 98.72 89 A 1 ATOM 702 C CB . PHE A 0 89 . -2.198 12.922 -13.304 1.00 98.72 89 A 1 ATOM 703 O O . PHE A 0 89 . -5.384 13.775 -12.656 1.00 98.72 89 A 1 ATOM 704 C CG . PHE A 0 89 . -3.004 11.924 -14.116 1.00 98.72 89 A 1 ATOM 705 C CD1 . PHE A 0 89 . -3.550 10.787 -13.495 1.00 98.72 89 A 1 ATOM 706 C CD2 . PHE A 0 89 . -3.189 12.116 -15.496 1.00 98.72 89 A 1 ATOM 707 C CE1 . PHE A 0 89 . -4.227 9.817 -14.254 1.00 98.72 89 A 1 ATOM 708 C CE2 . PHE A 0 89 . -3.886 11.158 -16.255 1.00 98.72 89 A 1 ATOM 709 C CZ . PHE A 0 89 . -4.393 10.001 -15.637 1.00 98.72 89 A 1 ATOM 710 N N . VAL A 0 90 . -4.187 13.042 -10.901 1.00 98.56 90 A 1 ATOM 711 C CA . VAL A 0 90 . -5.358 12.460 -10.231 1.00 98.56 90 A 1 ATOM 712 C C . VAL A 0 90 . -6.311 13.531 -9.700 1.00 98.56 90 A 1 ATOM 713 C CB . VAL A 0 90 . -4.987 11.446 -9.136 1.00 98.56 90 A 1 ATOM 714 O O . VAL A 0 90 . -7.528 13.335 -9.745 1.00 98.56 90 A 1 ATOM 715 C CG1 . VAL A 0 90 . -4.148 10.293 -9.694 1.00 98.56 90 A 1 ATOM 716 C CG2 . VAL A 0 90 . -4.276 12.052 -7.923 1.00 98.56 90 A 1 ATOM 717 N N . THR A 0 91 . -5.789 14.681 -9.261 1.00 98.20 91 A 1 ATOM 718 C CA . THR A 0 91 . -6.620 15.807 -8.822 1.00 98.20 91 A 1 ATOM 719 C C . THR A 0 91 . -7.335 16.465 -9.995 1.00 98.20 91 A 1 ATOM 720 C CB . THR A 0 91 . -5.826 16.863 -8.036 1.00 98.20 91 A 1 ATOM 721 O O . THR A 0 91 . -8.538 16.680 -9.915 1.00 98.20 91 A 1 ATOM 722 C CG2 . THR A 0 91 . -5.334 16.313 -6.696 1.00 98.20 91 A 1 ATOM 723 O OG1 . THR A 0 91 . -4.702 17.343 -8.741 1.00 98.20 91 A 1 ATOM 724 N N . GLU A 0 92 . -6.641 16.738 -11.104 1.00 98.55 92 A 1 ATOM 725 C CA . GLU A 0 92 . -7.237 17.434 -12.254 1.00 98.55 92 A 1 ATOM 726 C C . GLU A 0 92 . -8.231 16.549 -13.011 1.00 98.55 92 A 1 ATOM 727 C CB . GLU A 0 92 . -6.136 17.932 -13.209 1.00 98.55 92 A 1 ATOM 728 O O . GLU A 0 92 . -9.280 17.023 -13.438 1.00 98.55 92 A 1 ATOM 729 C CG . GLU A 0 92 . -5.352 19.110 -12.610 1.00 98.55 92 A 1 ATOM 730 C CD . GLU A 0 92 . -4.218 19.638 -13.505 1.00 98.55 92 A 1 ATOM 731 O OE1 . GLU A 0 92 . -3.615 20.670 -13.126 1.00 98.55 92 A 1 ATOM 732 O OE2 . GLU A 0 92 . -3.864 19.017 -14.532 1.00 98.55 92 A 1 ATOM 733 N N . LYS A 0 93 . -7.930 15.254 -13.167 1.00 98.52 93 A 1 ATOM 734 C CA . LYS A 0 93 . -8.754 14.356 -13.985 1.00 98.52 93 A 1 ATOM 735 C C . LYS A 0 93 . -9.929 13.734 -13.231 1.00 98.52 93 A 1 ATOM 736 C CB . LYS A 0 93 . -7.845 13.297 -14.620 1.00 98.52 93 A 1 ATOM 737 O O . LYS A 0 93 . -10.967 13.479 -13.840 1.00 98.52 93 A 1 ATOM 738 C CG . LYS A 0 93 . -8.586 12.539 -15.725 1.00 98.52 93 A 1 ATOM 739 C CD . LYS A 0 93 . -7.651 11.591 -16.475 1.00 98.52 93 A 1 ATOM 740 C CE . LYS A 0 93 . -8.484 10.847 -17.523 1.00 98.52 93 A 1 ATOM 741 N NZ . LYS A 0 93 . -7.807 9.638 -18.035 1.00 98.52 93 A 1 ATOM 742 N N . TYR A 0 94 . -9.764 13.440 -11.940 1.00 98.64 94 A 1 ATOM 743 C CA . TYR A 0 94 . -10.769 12.711 -11.155 1.00 98.64 94 A 1 ATOM 744 C C . TYR A 0 94 . -11.237 13.456 -9.905 1.00 98.64 94 A 1 ATOM 745 C CB . TYR A 0 94 . -10.246 11.319 -10.773 1.00 98.64 94 A 1 ATOM 746 O O . TYR A 0 94 . -12.139 12.965 -9.234 1.00 98.64 94 A 1 ATOM 747 C CG . TYR A 0 94 . -9.599 10.538 -11.896 1.00 98.64 94 A 1 ATOM 748 C CD1 . TYR A 0 94 . -10.365 10.094 -12.991 1.00 98.64 94 A 1 ATOM 749 C CD2 . TYR A 0 94 . -8.223 10.259 -11.836 1.00 98.64 94 A 1 ATOM 750 C CE1 . TYR A 0 94 . -9.748 9.386 -14.040 1.00 98.64 94 A 1 ATOM 751 C CE2 . TYR A 0 94 . -7.601 9.555 -12.877 1.00 98.64 94 A 1 ATOM 752 O OH . TYR A 0 94 . -7.740 8.508 -15.013 1.00 98.64 94 A 1 ATOM 753 C CZ . TYR A 0 94 . -8.362 9.130 -13.984 1.00 98.64 94 A 1 ATOM 754 N N . GLY A 0 95 . -10.640 14.604 -9.571 1.00 98.56 95 A 1 ATOM 755 C CA . GLY A 0 95 . -10.991 15.349 -8.364 1.00 98.56 95 A 1 ATOM 756 C C . GLY A 0 95 . -10.651 14.608 -7.073 1.00 98.56 95 A 1 ATOM 757 O O . GLY A 0 95 . -11.374 14.784 -6.096 1.00 98.56 95 A 1 ATOM 758 N N . VAL A 0 96 . -9.601 13.768 -7.063 1.00 98.67 96 A 1 ATOM 759 C CA . VAL A 0 96 . -9.250 12.923 -5.904 1.00 98.67 96 A 1 ATOM 760 C C . VAL A 0 96 . -9.163 13.737 -4.608 1.00 98.67 96 A 1 ATOM 761 C CB . VAL A 0 96 . -7.954 12.116 -6.131 1.00 98.67 96 A 1 ATOM 762 O O . VAL A 0 96 . -8.376 14.676 -4.518 1.00 98.67 96 A 1 ATOM 763 C CG1 . VAL A 0 96 . -7.449 11.427 -4.856 1.00 98.67 96 A 1 ATOM 764 C CG2 . VAL A 0 96 . -8.208 11.011 -7.163 1.00 98.67 96 A 1 ATOM 765 N N . GLN A 0 97 . -9.960 13.334 -3.614 1.00 98.63 97 A 1 ATOM 766 C CA . GLN A 0 97 . -9.995 13.886 -2.251 1.00 98.63 97 A 1 ATOM 767 C C . GLN A 0 97 . -9.502 12.892 -1.186 1.00 98.63 97 A 1 ATOM 768 C CB . GLN A 0 97 . -11.428 14.320 -1.892 1.00 98.63 97 A 1 ATOM 769 O O . GLN A 0 97 . -9.307 13.269 -0.033 1.00 98.63 97 A 1 ATOM 770 C CG . GLN A 0 97 . -12.049 15.380 -2.806 1.00 98.63 97 A 1 ATOM 771 C CD . GLN A 0 97 . -11.196 16.636 -2.925 1.00 98.63 97 A 1 ATOM 772 N NE2 . GLN A 0 97 . -10.799 17.003 -4.120 1.00 98.63 97 A 1 ATOM 773 O OE1 . GLN A 0 97 . -10.877 17.299 -1.953 1.00 98.63 97 A 1 ATOM 774 N N . PHE A 0 98 . -9.317 11.620 -1.547 1.00 98.80 98 A 1 ATOM 775 C CA . PHE A 0 98 . -8.756 10.618 -0.643 1.00 98.80 98 A 1 ATOM 776 C C . PHE A 0 98 . -7.227 10.708 -0.544 1.00 98.80 98 A 1 ATOM 777 C CB . PHE A 0 98 . -9.248 9.224 -1.035 1.00 98.80 98 A 1 ATOM 778 O O . PHE A 0 98 . -6.570 11.387 -1.334 1.00 98.80 98 A 1 ATOM 779 C CG . PHE A 0 98 . -8.991 8.802 -2.465 1.00 98.80 98 A 1 ATOM 780 C CD1 . PHE A 0 98 . -10.047 8.817 -3.397 1.00 98.80 98 A 1 ATOM 781 C CD2 . PHE A 0 98 . -7.707 8.385 -2.863 1.00 98.80 98 A 1 ATOM 782 C CE1 . PHE A 0 98 . -9.823 8.404 -4.721 1.00 98.80 98 A 1 ATOM 783 C CE2 . PHE A 0 98 . -7.485 7.982 -4.190 1.00 98.80 98 A 1 ATOM 784 C CZ . PHE A 0 98 . -8.544 7.977 -5.112 1.00 98.80 98 A 1 ATOM 785 N N . ASP A 0 99 . -6.655 10.007 0.436 1.00 98.81 99 A 1 ATOM 786 C CA . ASP A 0 99 . -5.241 10.132 0.774 1.00 98.81 99 A 1 ATOM 787 C C . ASP A 0 99 . -4.350 9.432 -0.267 1.00 98.81 99 A 1 ATOM 788 C CB . ASP A 0 99 . -4.980 9.608 2.191 1.00 98.81 99 A 1 ATOM 789 O O . ASP A 0 99 . -4.426 8.217 -0.489 1.00 98.81 99 A 1 ATOM 790 C CG . ASP A 0 99 . -5.608 10.459 3.306 1.00 98.81 99 A 1 ATOM 791 O OD1 . ASP A 0 99 . -5.440 11.693 3.329 1.00 98.81 99 A 1 ATOM 792 O OD2 . ASP A 0 99 . -6.140 9.866 4.272 1.00 98.81 99 A 1 ATOM 793 N N . MET A 0 100 . -3.480 10.224 -0.892 1.00 98.88 100 A 1 ATOM 794 C CA . MET A 0 100 . -2.463 9.774 -1.839 1.00 98.88 100 A 1 ATOM 795 C C . MET A 0 100 . -1.101 9.700 -1.147 1.00 98.88 100 A 1 ATOM 796 C CB . MET A 0 100 . -2.395 10.735 -3.033 1.00 98.88 100 A 1 ATOM 797 O O . MET A 0 100 . -0.714 10.618 -0.419 1.00 98.88 100 A 1 ATOM 798 C CG . MET A 0 100 . -3.658 10.766 -3.901 1.00 98.88 100 A 1 ATOM 799 S SD . MET A 0 100 . -4.043 9.259 -4.842 1.00 98.88 100 A 1 ATOM 800 C CE . MET A 0 100 . -2.568 9.070 -5.880 1.00 98.88 100 A 1 ATOM 801 N N . PHE A 0 101 . -0.353 8.639 -1.428 1.00 98.91 101 A 1 ATOM 802 C CA . PHE A 0 101 . 0.962 8.381 -0.847 1.00 98.91 101 A 1 ATOM 803 C C . PHE A 0 101 . 2.079 8.483 -1.889 1.00 98.91 101 A 1 ATOM 804 C CB . PHE A 0 101 . 0.923 7.040 -0.102 1.00 98.91 101 A 1 ATOM 805 O O . PHE A 0 101 . 1.820 8.540 -3.093 1.00 98.91 101 A 1 ATOM 806 C CG . PHE A 0 101 . 0.011 7.079 1.111 1.00 98.91 101 A 1 ATOM 807 C CD1 . PHE A 0 101 . 0.524 7.414 2.378 1.00 98.91 101 A 1 ATOM 808 C CD2 . PHE A 0 101 . -1.371 6.860 0.963 1.00 98.91 101 A 1 ATOM 809 C CE1 . PHE A 0 101 . -0.332 7.512 3.489 1.00 98.91 101 A 1 ATOM 810 C CE2 . PHE A 0 101 . -2.226 6.980 2.069 1.00 98.91 101 A 1 ATOM 811 C CZ . PHE A 0 101 . -1.705 7.278 3.337 1.00 98.91 101 A 1 ATOM 812 N N . SER A 0 102 . 3.327 8.523 -1.424 1.00 98.80 102 A 1 ATOM 813 C CA . SER A 0 102 . 4.503 8.417 -2.289 1.00 98.80 102 A 1 ATOM 814 C C . SER A 0 102 . 4.556 7.059 -2.983 1.00 98.80 102 A 1 ATOM 815 C CB . SER A 0 102 . 5.795 8.625 -1.502 1.00 98.80 102 A 1 ATOM 816 O O . SER A 0 102 . 3.958 6.072 -2.537 1.00 98.80 102 A 1 ATOM 817 O OG . SER A 0 102 . 5.959 9.981 -1.148 1.00 98.80 102 A 1 ATOM 818 N N . LYS A 0 103 . 5.290 6.999 -4.095 1.00 98.81 103 A 1 ATOM 819 C CA . LYS A 0 103 . 5.434 5.771 -4.869 1.00 98.81 103 A 1 ATOM 820 C C . LYS A 0 103 . 6.220 4.719 -4.089 1.00 98.81 103 A 1 ATOM 821 C CB . LYS A 0 103 . 6.108 6.129 -6.190 1.00 98.81 103 A 1 ATOM 822 O O . LYS A 0 103 . 7.271 5.006 -3.525 1.00 98.81 103 A 1 ATOM 823 C CG . LYS A 0 103 . 6.129 4.962 -7.187 1.00 98.81 103 A 1 ATOM 824 C CD . LYS A 0 103 . 6.943 5.324 -8.430 1.00 98.81 103 A 1 ATOM 825 C CE . LYS A 0 103 . 6.410 6.602 -9.082 1.00 98.81 103 A 1 ATOM 826 N NZ . LYS A 0 103 . 7.102 6.893 -10.350 1.00 98.81 103 A 1 ATOM 827 N N . ILE A 0 104 . 5.755 3.472 -4.133 1.00 98.85 104 A 1 ATOM 828 C CA . ILE A 0 104 . 6.399 2.345 -3.446 1.00 98.85 104 A 1 ATOM 829 C C . ILE A 0 104 . 6.523 1.106 -4.340 1.00 98.85 104 A 1 ATOM 830 C CB . ILE A 0 104 . 5.675 2.013 -2.120 1.00 98.85 104 A 1 ATOM 831 O O . ILE A 0 104 . 5.873 0.969 -5.384 1.00 98.85 104 A 1 ATOM 832 C CG1 . ILE A 0 104 . 4.208 1.610 -2.368 1.00 98.85 104 A 1 ATOM 833 C CG2 . ILE A 0 104 . 5.775 3.181 -1.124 1.00 98.85 104 A 1 ATOM 834 C CD1 . ILE A 0 104 . 3.553 0.959 -1.152 1.00 98.85 104 A 1 ATOM 835 N N . LYS A 0 105 . 7.347 0.151 -3.901 1.00 98.77 105 A 1 ATOM 836 C CA . LYS A 0 105 . 7.282 -1.239 -4.369 1.00 98.77 105 A 1 ATOM 837 C C . LYS A 0 105 . 6.309 -2.014 -3.479 1.00 98.77 105 A 1 ATOM 838 C CB . LYS A 0 105 . 8.680 -1.873 -4.369 1.00 98.77 105 A 1 ATOM 839 O O . LYS A 0 105 . 6.305 -1.864 -2.265 1.00 98.77 105 A 1 ATOM 840 C CG . LYS A 0 105 . 9.627 -1.305 -5.444 1.00 98.77 105 A 1 ATOM 841 C CD . LYS A 0 105 . 11.012 -1.952 -5.287 1.00 98.77 105 A 1 ATOM 842 C CE . LYS A 0 105 . 12.076 -1.438 -6.269 1.00 98.77 105 A 1 ATOM 843 N NZ . LYS A 0 105 . 13.384 -2.136 -6.083 1.00 98.77 105 A 1 ATOM 844 N N . VAL A 0 106 . 5.513 -2.888 -4.083 1.00 98.68 106 A 1 ATOM 845 C CA . VAL A 0 106 . 4.555 -3.771 -3.394 1.00 98.68 106 A 1 ATOM 846 C C . VAL A 0 106 . 4.975 -5.244 -3.447 1.00 98.68 106 A 1 ATOM 847 C CB . VAL A 0 106 . 3.140 -3.575 -3.958 1.00 98.68 106 A 1 ATOM 848 O O . VAL A 0 106 . 4.449 -6.082 -2.714 1.00 98.68 106 A 1 ATOM 849 C CG1 . VAL A 0 106 . 2.681 -2.117 -3.840 1.00 98.68 106 A 1 ATOM 850 C CG2 . VAL A 0 106 . 3.017 -4.013 -5.422 1.00 98.68 106 A 1 ATOM 851 N N . ASN A 0 107 . 5.941 -5.581 -4.305 1.00 98.52 107 A 1 ATOM 852 C CA . ASN A 0 107 . 6.536 -6.906 -4.475 1.00 98.52 107 A 1 ATOM 853 C C . ASN A 0 107 . 8.069 -6.847 -4.375 1.00 98.52 107 A 1 ATOM 854 C CB . ASN A 0 107 . 6.105 -7.477 -5.836 1.00 98.52 107 A 1 ATOM 855 O O . ASN A 0 107 . 8.669 -5.802 -4.624 1.00 98.52 107 A 1 ATOM 856 C CG . ASN A 0 107 . 4.641 -7.861 -5.927 1.00 98.52 107 A 1 ATOM 857 N ND2 . ASN A 0 107 . 4.104 -7.822 -7.124 1.00 98.52 107 A 1 ATOM 858 O OD1 . ASN A 0 107 . 3.995 -8.253 -4.961 1.00 98.52 107 A 1 ATOM 859 N N . GLY A 0 108 . 8.692 -7.993 -4.086 1.00 97.53 108 A 1 ATOM 860 C CA . GLY A 0 108 . 10.144 -8.121 -3.906 1.00 97.53 108 A 1 ATOM 861 C C . GLY A 0 108 . 10.612 -7.856 -2.471 1.00 97.53 108 A 1 ATOM 862 O O . GLY A 0 108 . 9.805 -7.542 -1.595 1.00 97.53 108 A 1 ATOM 863 N N . SER A 0 109 . 11.920 -8.002 -2.240 1.00 96.71 109 A 1 ATOM 864 C CA . SER A 0 109 . 12.587 -7.715 -0.956 1.00 96.71 109 A 1 ATOM 865 C C . SER A 0 109 . 12.398 -6.264 -0.519 1.00 96.71 109 A 1 ATOM 866 C CB . SER A 0 109 . 14.093 -7.985 -1.097 1.00 96.71 109 A 1 ATOM 867 O O . SER A 0 109 . 12.153 -5.987 0.654 1.00 96.71 109 A 1 ATOM 868 O OG . SER A 0 109 . 14.600 -7.344 -2.260 1.00 96.71 109 A 1 ATOM 869 N N . ASP A 0 110 . 12.425 -5.365 -1.498 1.00 97.81 110 A 1 ATOM 870 C CA . ASP A 0 110 . 12.313 -3.918 -1.324 1.00 97.81 110 A 1 ATOM 871 C C . ASP A 0 110 . 10.853 -3.445 -1.267 1.00 97.81 110 A 1 ATOM 872 C CB . ASP A 0 110 . 12.999 -3.206 -2.494 1.00 97.81 110 A 1 ATOM 873 O O . ASP A 0 110 . 10.588 -2.251 -1.389 1.00 97.81 110 A 1 ATOM 874 C CG . ASP A 0 110 . 14.407 -3.651 -2.857 1.00 97.81 110 A 1 ATOM 875 O OD1 . ASP A 0 110 . 15.049 -4.384 -2.073 1.00 97.81 110 A 1 ATOM 876 O OD2 . ASP A 0 110 . 14.742 -3.321 -4.022 1.00 97.81 110 A 1 ATOM 877 N N . ALA A 0 111 . 9.888 -4.369 -1.186 1.00 98.42 111 A 1 ATOM 878 C CA . ALA A 0 111 . 8.499 -3.987 -0.984 1.00 98.42 111 A 1 ATOM 879 C C . ALA A 0 111 . 8.361 -3.204 0.324 1.00 98.42 111 A 1 ATOM 880 C CB . ALA A 0 111 . 7.598 -5.225 -0.985 1.00 98.42 111 A 1 ATOM 881 O O . ALA A 0 111 . 9.016 -3.537 1.314 1.00 98.42 111 A 1 ATOM 882 N N . ASP A 0 112 . 7.468 -2.221 0.329 1.00 98.51 112 A 1 ATOM 883 C CA . ASP A 0 112 . 7.111 -1.513 1.548 1.00 98.51 112 A 1 ATOM 884 C C . ASP A 0 112 . 6.607 -2.508 2.603 1.00 98.51 112 A 1 ATOM 885 C CB . ASP A 0 112 . 6.074 -0.435 1.238 1.00 98.51 112 A 1 ATOM 886 O O . ASP A 0 112 . 5.877 -3.464 2.295 1.00 98.51 112 A 1 ATOM 887 C CG . ASP A 0 112 . 5.927 0.507 2.427 1.00 98.51 112 A 1 ATOM 888 O OD1 . ASP A 0 112 . 5.217 0.103 3.374 1.00 98.51 112 A 1 ATOM 889 O OD2 . ASP A 0 112 . 6.561 1.578 2.385 1.00 98.51 112 A 1 ATOM 890 N N . ASP A 0 113 . 7.023 -2.294 3.846 1.00 97.91 113 A 1 ATOM 891 C CA . ASP A 0 113 . 6.718 -3.171 4.968 1.00 97.91 113 A 1 ATOM 892 C C . ASP A 0 113 . 5.205 -3.283 5.214 1.00 97.91 113 A 1 ATOM 893 C CB . ASP A 0 113 . 7.502 -2.669 6.189 1.00 97.91 113 A 1 ATOM 894 O O . ASP A 0 113 . 4.722 -4.378 5.524 1.00 97.91 113 A 1 ATOM 895 C CG . ASP A 0 113 . 8.972 -3.130 6.215 1.00 97.91 113 A 1 ATOM 896 O OD1 . ASP A 0 113 . 9.394 -3.933 5.334 1.00 97.91 113 A 1 ATOM 897 O OD2 . ASP A 0 113 . 9.664 -2.725 7.172 1.00 97.91 113 A 1 ATOM 898 N N . LEU A 0 114 . 4.431 -2.224 4.931 1.00 98.66 114 A 1 ATOM 899 C CA . LEU A 0 114 . 2.968 -2.279 4.926 1.00 98.66 114 A 1 ATOM 900 C C . LEU A 0 114 . 2.462 -3.336 3.940 1.00 98.66 114 A 1 ATOM 901 C CB . LEU A 0 114 . 2.409 -0.893 4.553 1.00 98.66 114 A 1 ATOM 902 O O . LEU A 0 114 . 1.643 -4.181 4.290 1.00 98.66 114 A 1 ATOM 903 C CG . LEU A 0 114 . 0.877 -0.837 4.403 1.00 98.66 114 A 1 ATOM 904 C CD1 . LEU A 0 114 . 0.159 -1.107 5.726 1.00 98.66 114 A 1 ATOM 905 C CD2 . LEU A 0 114 . 0.476 0.529 3.850 1.00 98.66 114 A 1 ATOM 906 N N . TYR A 0 115 . 2.955 -3.338 2.700 1.00 98.53 115 A 1 ATOM 907 C CA . TYR A 0 115 . 2.514 -4.308 1.695 1.00 98.53 115 A 1 ATOM 908 C C . TYR A 0 115 . 3.012 -5.723 1.989 1.00 98.53 115 A 1 ATOM 909 C CB . TYR A 0 115 . 2.904 -3.858 0.283 1.00 98.53 115 A 1 ATOM 910 O O . TYR A 0 115 . 2.320 -6.687 1.652 1.00 98.53 115 A 1 ATOM 911 C CG . TYR A 0 115 . 1.812 -3.047 -0.379 1.00 98.53 115 A 1 ATOM 912 C CD1 . TYR A 0 115 . 0.912 -3.664 -1.272 1.00 98.53 115 A 1 ATOM 913 C CD2 . TYR A 0 115 . 1.664 -1.686 -0.060 1.00 98.53 115 A 1 ATOM 914 C CE1 . TYR A 0 115 . -0.101 -2.904 -1.890 1.00 98.53 115 A 1 ATOM 915 C CE2 . TYR A 0 115 . 0.635 -0.931 -0.651 1.00 98.53 115 A 1 ATOM 916 O OH . TYR A 0 115 . -1.212 -0.800 -2.163 1.00 98.53 115 A 1 ATOM 917 C CZ . TYR A 0 115 . -0.234 -1.533 -1.581 1.00 98.53 115 A 1 ATOM 918 N N . LYS A 0 116 . 4.177 -5.888 2.631 1.00 97.72 116 A 1 ATOM 919 C CA . LYS A 0 116 . 4.604 -7.199 3.148 1.00 97.72 116 A 1 ATOM 920 C C . LYS A 0 116 . 3.603 -7.722 4.181 1.00 97.72 116 A 1 ATOM 921 C CB . LYS A 0 116 . 6.012 -7.125 3.753 1.00 97.72 116 A 1 ATOM 922 O O . LYS A 0 116 . 3.168 -8.865 4.051 1.00 97.72 116 A 1 ATOM 923 C CG . LYS A 0 116 . 7.113 -6.851 2.718 1.00 97.72 116 A 1 ATOM 924 C CD . LYS A 0 116 . 8.463 -6.744 3.439 1.00 97.72 116 A 1 ATOM 925 C CE . LYS A 0 116 . 9.569 -6.274 2.493 1.00 97.72 116 A 1 ATOM 926 N NZ . LYS A 0 116 . 10.556 -5.432 3.209 1.00 97.72 116 A 1 ATOM 927 N N . PHE A 0 117 . 3.185 -6.878 5.125 1.00 97.90 117 A 1 ATOM 928 C CA . PHE A 0 117 . 2.175 -7.206 6.133 1.00 97.90 117 A 1 ATOM 929 C C . PHE A 0 117 . 0.798 -7.509 5.533 1.00 97.90 117 A 1 ATOM 930 C CB . PHE A 0 117 . 2.093 -6.049 7.126 1.00 97.90 117 A 1 ATOM 931 O O . PHE A 0 117 . 0.213 -8.549 5.819 1.00 97.90 117 A 1 ATOM 932 C CG . PHE A 0 117 . 0.971 -6.170 8.137 1.00 97.90 117 A 1 ATOM 933 C CD1 . PHE A 0 117 . -0.142 -5.311 8.066 1.00 97.90 117 A 1 ATOM 934 C CD2 . PHE A 0 117 . 1.036 -7.146 9.146 1.00 97.90 117 A 1 ATOM 935 C CE1 . PHE A 0 117 . -1.178 -5.421 9.010 1.00 97.90 117 A 1 ATOM 936 C CE2 . PHE A 0 117 . 0.005 -7.248 10.095 1.00 97.90 117 A 1 ATOM 937 C CZ . PHE A 0 117 . -1.102 -6.384 10.028 1.00 97.90 117 A 1 ATOM 938 N N . LEU A 0 118 . 0.290 -6.661 4.636 1.00 98.43 118 A 1 ATOM 939 C CA . LEU A 0 118 . -0.998 -6.892 3.974 1.00 98.43 118 A 1 ATOM 940 C C . LEU A 0 118 . -1.025 -8.247 3.253 1.00 98.43 118 A 1 ATOM 941 C CB . LEU A 0 118 . -1.279 -5.750 2.980 1.00 98.43 118 A 1 ATOM 942 O O . LEU A 0 118 . -1.980 -9.009 3.391 1.00 98.43 118 A 1 ATOM 943 C CG . LEU A 0 118 . -1.566 -4.375 3.610 1.00 98.43 118 A 1 ATOM 944 C CD1 . LEU A 0 118 . -1.690 -3.321 2.514 1.00 98.43 118 A 1 ATOM 945 C CD2 . LEU A 0 118 . -2.846 -4.381 4.433 1.00 98.43 118 A 1 ATOM 946 N N . LYS A 0 119 . 0.051 -8.585 2.531 1.00 97.67 119 A 1 ATOM 947 C CA . LYS A 0 119 . 0.183 -9.868 1.827 1.00 97.67 119 A 1 ATOM 948 C C . LYS A 0 119 . 0.347 -11.069 2.758 1.00 97.67 119 A 1 ATOM 949 C CB . LYS A 0 119 . 1.387 -9.818 0.885 1.00 97.67 119 A 1 ATOM 950 O O . LYS A 0 119 . -0.025 -12.162 2.338 1.00 97.67 119 A 1 ATOM 951 C CG . LYS A 0 119 . 1.173 -8.921 -0.343 1.00 97.67 119 A 1 ATOM 952 C CD . LYS A 0 119 . 2.405 -8.933 -1.260 1.00 97.67 119 A 1 ATOM 953 C CE . LYS A 0 119 . 3.687 -8.512 -0.537 1.00 97.67 119 A 1 ATOM 954 N NZ . LYS A 0 119 . 4.839 -8.494 -1.462 1.00 97.67 119 A 1 ATOM 955 N N . SER A 0 120 . 0.924 -10.900 3.951 1.00 96.15 120 A 1 ATOM 956 C CA . SER A 0 120 . 1.061 -11.987 4.933 1.00 96.15 120 A 1 ATOM 957 C C . SER A 0 120 . -0.229 -12.233 5.713 1.00 96.15 120 A 1 ATOM 958 C CB . SER A 0 120 . 2.222 -11.734 5.901 1.00 96.15 120 A 1 ATOM 959 O O . SER A 0 120 . -0.492 -13.362 6.107 1.00 96.15 120 A 1 ATOM 960 O OG . SER A 0 120 . 1.934 -10.694 6.812 1.00 96.15 120 A 1 ATOM 961 N N . ARG A 0 121 . -1.064 -11.204 5.903 1.00 96.82 121 A 1 ATOM 962 C CA . ARG A 0 121 . -2.388 -11.338 6.533 1.00 96.82 121 A 1 ATOM 963 C C . ARG A 0 121 . -3.463 -11.791 5.551 1.00 96.82 121 A 1 ATOM 964 C CB . ARG A 0 121 . -2.774 -10.011 7.205 1.00 96.82 121 A 1 ATOM 965 O O . ARG A 0 121 . -4.367 -12.519 5.939 1.00 96.82 121 A 1 ATOM 966 C CG . ARG A 0 121 . -1.820 -9.584 8.336 1.00 96.82 121 A 1 ATOM 967 C CD . ARG A 0 121 . -1.733 -10.571 9.509 1.00 96.82 121 A 1 ATOM 968 N NE . ARG A 0 121 . -3.009 -10.666 10.244 1.00 96.82 121 A 1 ATOM 969 N NH1 . ARG A 0 121 . -2.665 -8.951 11.751 1.00 96.82 121 A 1 ATOM 970 N NH2 . ARG A 0 121 . -4.604 -10.011 11.717 1.00 96.82 121 A 1 ATOM 971 C CZ . ARG A 0 121 . -3.410 -9.884 11.232 1.00 96.82 121 A 1 ATOM 972 N N . GLN A 0 122 . -3.369 -11.369 4.291 1.00 96.40 122 A 1 ATOM 973 C CA . GLN A 0 122 . -4.334 -11.682 3.239 1.00 96.40 122 A 1 ATOM 974 C C . GLN A 0 122 . -3.614 -12.259 2.012 1.00 96.40 122 A 1 ATOM 975 C CB . GLN A 0 122 . -5.169 -10.436 2.921 1.00 96.40 122 A 1 ATOM 976 O O . GLN A 0 122 . -3.113 -11.548 1.125 1.00 96.40 122 A 1 ATOM 977 C CG . GLN A 0 122 . -6.067 -9.987 4.086 1.00 96.40 122 A 1 ATOM 978 C CD . GLN A 0 122 . -7.167 -10.993 4.398 1.00 96.40 122 A 1 ATOM 979 N NE2 . GLN A 0 122 . -7.581 -11.121 5.634 1.00 96.40 122 A 1 ATOM 980 O OE1 . GLN A 0 122 . -7.688 -11.654 3.515 1.00 96.40 122 A 1 ATOM 981 N N . HIS A 0 123 . -3.546 -13.589 1.987 1.00 94.86 123 A 1 ATOM 982 C CA . HIS A 0 123 . -2.832 -14.351 0.968 1.00 94.86 123 A 1 ATOM 983 C C . HIS A 0 123 . -3.445 -14.177 -0.428 1.00 94.86 123 A 1 ATOM 984 C CB . HIS A 0 123 . -2.755 -15.827 1.383 1.00 94.86 123 A 1 ATOM 985 O O . HIS A 0 123 . -4.622 -13.869 -0.600 1.00 94.86 123 A 1 ATOM 986 C CG . HIS A 0 123 . -1.842 -16.108 2.555 1.00 94.86 123 A 1 ATOM 987 C CD2 . HIS A 0 123 . -1.132 -15.210 3.310 1.00 94.86 123 A 1 ATOM 988 N ND1 . HIS A 0 123 . -1.546 -17.359 3.049 1.00 94.86 123 A 1 ATOM 989 C CE1 . HIS A 0 123 . -0.684 -17.218 4.068 1.00 94.86 123 A 1 ATOM 990 N NE2 . HIS A 0 123 . -0.372 -15.928 4.232 1.00 94.86 123 A 1 ATOM 991 N N . GLY A 0 124 . -2.606 -14.333 -1.449 1.00 90.37 124 A 1 ATOM 992 C CA . GLY A 0 124 . -3.041 -14.345 -2.843 1.00 90.37 124 A 1 ATOM 993 C C . GLY A 0 124 . -3.298 -15.766 -3.339 1.00 90.37 124 A 1 ATOM 994 O O . GLY A 0 124 . -2.925 -16.743 -2.698 1.00 90.37 124 A 1 ATOM 995 N N . THR A 0 125 . -3.875 -15.892 -4.531 1.00 87.59 125 A 1 ATOM 996 C CA . THR A 0 125 . -3.971 -17.179 -5.230 1.00 87.59 125 A 1 ATOM 997 C C . THR A 0 125 . -2.624 -17.546 -5.860 1.00 87.59 125 A 1 ATOM 998 C CB . THR A 0 125 . -5.080 -17.142 -6.291 1.00 87.59 125 A 1 ATOM 999 O O . THR A 0 125 . -1.978 -16.686 -6.475 1.00 87.59 125 A 1 ATOM 1000 C CG2 . THR A 0 125 . -6.460 -16.973 -5.654 1.00 87.59 125 A 1 ATOM 1001 O OG1 . THR A 0 125 . -4.901 -16.046 -7.164 1.00 87.59 125 A 1 ATOM 1002 N N . LEU A 0 126 . -2.200 -18.809 -5.698 1.00 90.13 126 A 1 ATOM 1003 C CA . LEU A 0 126 . -0.928 -19.422 -6.148 1.00 90.13 126 A 1 ATOM 1004 C C . LEU A 0 126 . 0.360 -18.820 -5.549 1.00 90.13 126 A 1 ATOM 1005 C CB . LEU A 0 126 . -0.860 -19.429 -7.691 1.00 90.13 126 A 1 ATOM 1006 O O . LEU A 0 126 . 1.294 -19.535 -5.212 1.00 90.13 126 A 1 ATOM 1007 C CG . LEU A 0 126 . -2.017 -20.153 -8.404 1.00 90.13 126 A 1 ATOM 1008 C CD1 . LEU A 0 126 . -1.929 -19.896 -9.907 1.00 90.13 126 A 1 ATOM 1009 C CD2 . LEU A 0 126 . -1.974 -21.661 -8.161 1.00 90.13 126 A 1 ATOM 1010 N N . THR A 0 127 . 0.415 -17.500 -5.409 1.00 93.43 127 A 1 ATOM 1011 C CA . THR A 0 127 . 1.497 -16.727 -4.801 1.00 93.43 127 A 1 ATOM 1012 C C . THR A 0 127 . 0.917 -15.504 -4.099 1.00 93.43 127 A 1 ATOM 1013 C CB . THR A 0 127 . 2.552 -16.313 -5.846 1.00 93.43 127 A 1 ATOM 1014 O O . THR A 0 127 . -0.094 -14.940 -4.533 1.00 93.43 127 A 1 ATOM 1015 C CG2 . THR A 0 127 . 1.994 -15.542 -7.044 1.00 93.43 127 A 1 ATOM 1016 O OG1 . THR A 0 127 . 3.508 -15.452 -5.264 1.00 93.43 127 A 1 ATOM 1017 N N . ASN A 0 128 . 1.593 -15.025 -3.058 1.00 95.20 128 A 1 ATOM 1018 C CA . ASN A 0 128 . 1.175 -13.834 -2.325 1.00 95.20 128 A 1 ATOM 1019 C C . ASN A 0 128 . 1.458 -12.520 -3.064 1.00 95.20 128 A 1 ATOM 1020 C CB . ASN A 0 128 . 1.762 -13.892 -0.901 1.00 95.20 128 A 1 ATOM 1021 O O . ASN A 0 128 . 0.896 -11.491 -2.681 1.00 95.20 128 A 1 ATOM 1022 C CG . ASN A 0 128 . 1.017 -14.895 -0.032 1.00 95.20 128 A 1 ATOM 1023 N ND2 . ASN A 0 128 . 1.550 -15.269 1.104 1.00 95.20 128 A 1 ATOM 1024 O OD1 . ASN A 0 128 . -0.071 -15.325 -0.373 1.00 95.20 128 A 1 ATOM 1025 N N . ASN A 0 129 . 2.235 -12.533 -4.154 1.00 97.36 129 A 1 ATOM 1026 C CA . ASN A 0 129 . 2.539 -11.332 -4.937 1.00 97.36 129 A 1 ATOM 1027 C C . ASN A 0 129 . 1.272 -10.592 -5.390 1.00 97.36 129 A 1 ATOM 1028 C CB . ASN A 0 129 . 3.427 -11.697 -6.142 1.00 97.36 129 A 1 ATOM 1029 O O . ASN A 0 129 . 0.287 -11.215 -5.810 1.00 97.36 129 A 1 ATOM 1030 C CG . ASN A 0 129 . 4.859 -12.010 -5.747 1.00 97.36 129 A 1 ATOM 1031 N ND2 . ASN A 0 129 . 5.659 -12.492 -6.667 1.00 97.36 129 A 1 ATOM 1032 O OD1 . ASN A 0 129 . 5.279 -11.801 -4.620 1.00 97.36 129 A 1 ATOM 1033 N N . ILE A 0 130 . 1.308 -9.257 -5.317 1.00 98.34 130 A 1 ATOM 1034 C CA . ILE A 0 130 . 0.340 -8.382 -5.987 1.00 98.34 130 A 1 ATOM 1035 C C . ILE A 0 130 . 0.439 -8.663 -7.485 1.00 98.34 130 A 1 ATOM 1036 C CB . ILE A 0 130 . 0.632 -6.897 -5.680 1.00 98.34 130 A 1 ATOM 1037 O O . ILE A 0 130 . 1.543 -8.683 -8.026 1.00 98.34 130 A 1 ATOM 1038 C CG1 . ILE A 0 130 . 0.640 -6.549 -4.179 1.00 98.34 130 A 1 ATOM 1039 C CG2 . ILE A 0 130 . -0.359 -5.976 -6.403 1.00 98.34 130 A 1 ATOM 1040 C CD1 . ILE A 0 130 . -0.552 -7.051 -3.361 1.00 98.34 130 A 1 ATOM 1041 N N . LYS A 0 131 . -0.691 -8.953 -8.134 1.00 97.16 131 A 1 ATOM 1042 C CA . LYS A 0 131 . -0.698 -9.455 -9.516 1.00 97.16 131 A 1 ATOM 1043 C C . LYS A 0 131 . -0.647 -8.334 -10.550 1.00 97.16 131 A 1 ATOM 1044 C CB . LYS A 0 131 . -1.911 -10.375 -9.746 1.00 97.16 131 A 1 ATOM 1045 O O . LYS A 0 131 . -0.057 -8.526 -11.604 1.00 97.16 131 A 1 ATOM 1046 C CG . LYS A 0 131 . -1.955 -11.621 -8.840 1.00 97.16 131 A 1 ATOM 1047 C CD . LYS A 0 131 . -0.723 -12.528 -9.002 1.00 97.16 131 A 1 ATOM 1048 C CE . LYS A 0 131 . -0.845 -13.853 -8.235 1.00 97.16 131 A 1 ATOM 1049 N NZ . LYS A 0 131 . -0.953 -13.647 -6.773 1.00 97.16 131 A 1 ATOM 1050 N N . TRP A 0 132 . -1.258 -7.189 -10.250 1.00 98.20 132 A 1 ATOM 1051 C CA . TRP A 0 132 . -1.304 -6.040 -11.152 1.00 98.20 132 A 1 ATOM 1052 C C . TRP A 0 132 . -1.656 -4.743 -10.409 1.00 98.20 132 A 1 ATOM 1053 C CB . TRP A 0 132 . -2.322 -6.322 -12.271 1.00 98.20 132 A 1 ATOM 1054 O O . TRP A 0 132 . -1.903 -4.748 -9.196 1.00 98.20 132 A 1 ATOM 1055 C CG . TRP A 0 132 . -2.089 -5.535 -13.514 1.00 98.20 132 A 1 ATOM 1056 C CD1 . TRP A 0 132 . -2.911 -4.588 -14.018 1.00 98.20 132 A 1 ATOM 1057 C CD2 . TRP A 0 132 . -0.935 -5.594 -14.403 1.00 98.20 132 A 1 ATOM 1058 C CE2 . TRP A 0 132 . -1.111 -4.615 -15.425 1.00 98.20 132 A 1 ATOM 1059 C CE3 . TRP A 0 132 . 0.249 -6.364 -14.439 1.00 98.20 132 A 1 ATOM 1060 N NE1 . TRP A 0 132 . -2.337 -4.045 -15.151 1.00 98.20 132 A 1 ATOM 1061 C CH2 . TRP A 0 132 . 1.017 -5.176 -16.430 1.00 98.20 132 A 1 ATOM 1062 C CZ2 . TRP A 0 132 . -0.154 -4.399 -16.425 1.00 98.20 132 A 1 ATOM 1063 C CZ3 . TRP A 0 132 . 1.216 -6.155 -15.441 1.00 98.20 132 A 1 ATOM 1064 N N . ASN A 0 133 . -1.720 -3.643 -11.159 1.00 98.55 133 A 1 ATOM 1065 C CA . ASN A 0 133 . -2.294 -2.371 -10.723 1.00 98.55 133 A 1 ATOM 1066 C C . ASN A 0 133 . -3.728 -2.553 -10.215 1.00 98.55 133 A 1 ATOM 1067 C CB . ASN A 0 133 . -2.229 -1.369 -11.887 1.00 98.55 133 A 1 ATOM 1068 O O . ASN A 0 133 . -4.483 -3.362 -10.751 1.00 98.55 133 A 1 ATOM 1069 C CG . ASN A 0 133 . -0.790 -1.076 -12.254 1.00 98.55 133 A 1 ATOM 1070 N ND2 . ASN A 0 133 . -0.428 -1.064 -13.513 1.00 98.55 133 A 1 ATOM 1071 O OD1 . ASN A 0 133 . 0.046 -0.902 -11.391 1.00 98.55 133 A 1 ATOM 1072 N N . PHE A 0 134 . -4.104 -1.768 -9.210 1.00 98.64 134 A 1 ATOM 1073 C CA . PHE A 0 134 . -5.421 -1.755 -8.578 1.00 98.64 134 A 1 ATOM 1074 C C . PHE A 0 134 . -5.803 -3.060 -7.877 1.00 98.64 134 A 1 ATOM 1075 C CB . PHE A 0 134 . -6.490 -1.244 -9.556 1.00 98.64 134 A 1 ATOM 1076 O O . PHE A 0 134 . -6.967 -3.442 -7.906 1.00 98.64 134 A 1 ATOM 1077 C CG . PHE A 0 134 . -6.149 0.080 -10.197 1.00 98.64 134 A 1 ATOM 1078 C CD1 . PHE A 0 134 . -6.354 1.270 -9.476 1.00 98.64 134 A 1 ATOM 1079 C CD2 . PHE A 0 134 . -5.608 0.125 -11.494 1.00 98.64 134 A 1 ATOM 1080 C CE1 . PHE A 0 134 . -6.023 2.507 -10.049 1.00 98.64 134 A 1 ATOM 1081 C CE2 . PHE A 0 134 . -5.265 1.363 -12.059 1.00 98.64 134 A 1 ATOM 1082 C CZ . PHE A 0 134 . -5.468 2.550 -11.335 1.00 98.64 134 A 1 ATOM 1083 N N . SER A 0 135 . -4.872 -3.751 -7.216 1.00 98.68 135 A 1 ATOM 1084 C CA . SER A 0 135 . -5.268 -4.711 -6.173 1.00 98.68 135 A 1 ATOM 1085 C C . SER A 0 135 . -5.720 -3.940 -4.932 1.00 98.68 135 A 1 ATOM 1086 C CB . SER A 0 135 . -4.134 -5.668 -5.811 1.00 98.68 135 A 1 ATOM 1087 O O . SER A 0 135 . -5.224 -2.842 -4.675 1.00 98.68 135 A 1 ATOM 1088 O OG . SER A 0 135 . -3.658 -6.328 -6.972 1.00 98.68 135 A 1 ATOM 1089 N N . LYS A 0 136 . -6.665 -4.498 -4.169 1.00 98.80 136 A 1 ATOM 1090 C CA . LYS A 0 136 . -7.235 -3.823 -2.995 1.00 98.80 136 A 1 ATOM 1091 C C . LYS A 0 136 . -7.132 -4.694 -1.753 1.00 98.80 136 A 1 ATOM 1092 C CB . LYS A 0 136 . -8.688 -3.371 -3.229 1.00 98.80 136 A 1 ATOM 1093 O O . LYS A 0 136 . -7.312 -5.908 -1.841 1.00 98.80 136 A 1 ATOM 1094 C CG . LYS A 0 136 . -8.908 -2.447 -4.437 1.00 98.80 136 A 1 ATOM 1095 C CD . LYS A 0 136 . -9.234 -3.190 -5.741 1.00 98.80 136 A 1 ATOM 1096 C CE . LYS A 0 136 . -9.402 -2.169 -6.871 1.00 98.80 136 A 1 ATOM 1097 N NZ . LYS A 0 136 . -9.596 -2.822 -8.186 1.00 98.80 136 A 1 ATOM 1098 N N . PHE A 0 137 . -6.906 -4.068 -0.607 1.00 98.88 137 A 1 ATOM 1099 C CA . PHE A 0 137 . -7.044 -4.679 0.711 1.00 98.88 137 A 1 ATOM 1100 C C . PHE A 0 137 . -8.055 -3.880 1.521 1.00 98.88 137 A 1 ATOM 1101 C CB . PHE A 0 137 . -5.696 -4.742 1.434 1.00 98.88 137 A 1 ATOM 1102 O O . PHE A 0 137 . -7.968 -2.654 1.575 1.00 98.88 137 A 1 ATOM 1103 C CG . PHE A 0 137 . -4.686 -5.653 0.772 1.00 98.88 137 A 1 ATOM 1104 C CD1 . PHE A 0 137 . -4.516 -6.973 1.227 1.00 98.88 137 A 1 ATOM 1105 C CD2 . PHE A 0 137 . -3.898 -5.171 -0.288 1.00 98.88 137 A 1 ATOM 1106 C CE1 . PHE A 0 137 . -3.541 -7.798 0.638 1.00 98.88 137 A 1 ATOM 1107 C CE2 . PHE A 0 137 . -2.944 -6.005 -0.892 1.00 98.88 137 A 1 ATOM 1108 C CZ . PHE A 0 137 . -2.759 -7.318 -0.425 1.00 98.88 137 A 1 ATOM 1109 N N . LEU A 0 138 . -8.997 -4.578 2.143 1.00 98.83 138 A 1 ATOM 1110 C CA . LEU A 0 138 . -9.922 -3.994 3.102 1.00 98.83 138 A 1 ATOM 1111 C C . LEU A 0 138 . -9.398 -4.254 4.511 1.00 98.83 138 A 1 ATOM 1112 C CB . LEU A 0 138 . -11.328 -4.554 2.855 1.00 98.83 138 A 1 ATOM 1113 O O . LEU A 0 138 . -9.003 -5.378 4.839 1.00 98.83 138 A 1 ATOM 1114 C CG . LEU A 0 138 . -12.436 -3.968 3.738 1.00 98.83 138 A 1 ATOM 1115 C CD1 . LEU A 0 138 . -12.624 -2.475 3.475 1.00 98.83 138 A 1 ATOM 1116 C CD2 . LEU A 0 138 . -13.748 -4.676 3.399 1.00 98.83 138 A 1 ATOM 1117 N N . VAL A 0 139 . -9.384 -3.200 5.315 1.00 98.84 139 A 1 ATOM 1118 C CA . VAL A 0 139 . -8.891 -3.186 6.687 1.00 98.84 139 A 1 ATOM 1119 C C . VAL A 0 139 . -10.007 -2.688 7.599 1.00 98.84 139 A 1 ATOM 1120 C CB . VAL A 0 139 . -7.642 -2.299 6.800 1.00 98.84 139 A 1 ATOM 1121 O O . VAL A 0 139 . -10.650 -1.681 7.296 1.00 98.84 139 A 1 ATOM 1122 C CG1 . VAL A 0 139 . -7.059 -2.307 8.209 1.00 98.84 139 A 1 ATOM 1123 C CG2 . VAL A 0 139 . -6.522 -2.711 5.831 1.00 98.84 139 A 1 ATOM 1124 N N . ASP A 0 140 . -10.248 -3.403 8.693 1.00 98.56 140 A 1 ATOM 1125 C CA . ASP A 0 140 . -11.279 -3.055 9.673 1.00 98.56 140 A 1 ATOM 1126 C C . ASP A 0 140 . -10.874 -1.891 10.601 1.00 98.56 140 A 1 ATOM 1127 C CB . ASP A 0 140 . -11.703 -4.318 10.446 1.00 98.56 140 A 1 ATOM 1128 O O . ASP A 0 140 . -9.760 -1.364 10.540 1.00 98.56 140 A 1 ATOM 1129 C CG . ASP A 0 140 . -10.632 -4.903 11.378 1.00 98.56 140 A 1 ATOM 1130 O OD1 . ASP A 0 140 . -9.669 -4.181 11.738 1.00 98.56 140 A 1 ATOM 1131 O OD2 . ASP A 0 140 . -10.776 -6.093 11.719 1.00 98.56 140 A 1 ATOM 1132 N N . ARG A 0 141 . -11.789 -1.497 11.498 1.00 97.98 141 A 1 ATOM 1133 C CA . ARG A 0 141 . -11.586 -0.401 12.463 1.00 97.98 141 A 1 ATOM 1134 C C . ARG A 0 141 . -10.480 -0.690 13.487 1.00 97.98 141 A 1 ATOM 1135 C CB . ARG A 0 141 . -12.913 -0.096 13.181 1.00 97.98 141 A 1 ATOM 1136 O O . ARG A 0 141 . -9.980 0.233 14.135 1.00 97.98 141 A 1 ATOM 1137 C CG . ARG A 0 141 . -14.029 0.389 12.242 1.00 97.98 141 A 1 ATOM 1138 C CD . ARG A 0 141 . -15.242 0.845 13.067 1.00 97.98 141 A 1 ATOM 1139 N NE . ARG A 0 141 . -16.369 1.288 12.223 1.00 97.98 141 A 1 ATOM 1140 N NH1 . ARG A 0 141 . -15.664 3.439 11.777 1.00 97.98 141 A 1 ATOM 1141 N NH2 . ARG A 0 141 . -17.643 2.787 11.055 1.00 97.98 141 A 1 ATOM 1142 C CZ . ARG A 0 141 . -16.548 2.486 11.692 1.00 97.98 141 A 1 ATOM 1143 N N . GLN A 0 142 . -10.052 -1.943 13.618 1.00 97.80 142 A 1 ATOM 1144 C CA . GLN A 0 142 . -8.973 -2.405 14.491 1.00 97.80 142 A 1 ATOM 1145 C C . GLN A 0 142 . -7.636 -2.531 13.737 1.00 97.80 142 A 1 ATOM 1146 C CB . GLN A 0 142 . -9.391 -3.719 15.177 1.00 97.80 142 A 1 ATOM 1147 O O . GLN A 0 142 . -6.642 -3.012 14.291 1.00 97.80 142 A 1 ATOM 1148 C CG . GLN A 0 142 . -10.598 -3.563 16.124 1.00 97.80 142 A 1 ATOM 1149 C CD . GLN A 0 142 . -11.955 -3.381 15.433 1.00 97.80 142 A 1 ATOM 1150 N NE2 . GLN A 0 142 . -12.911 -2.756 16.087 1.00 97.80 142 A 1 ATOM 1151 O OE1 . GLN A 0 142 . -12.183 -3.772 14.302 1.00 97.80 142 A 1 ATOM 1152 N N . GLY A 0 143 . -7.584 -2.059 12.488 1.00 98.36 143 A 1 ATOM 1153 C CA . GLY A 0 143 . -6.373 -2.022 11.680 1.00 98.36 143 A 1 ATOM 1154 C C . GLY A 0 143 . -5.966 -3.396 11.152 1.00 98.36 143 A 1 ATOM 1155 O O . GLY A 0 143 . -4.803 -3.586 10.788 1.00 98.36 143 A 1 ATOM 1156 N N . GLN A 0 144 . -6.886 -4.364 11.131 1.00 98.36 144 A 1 ATOM 1157 C CA . GLN A 0 144 . -6.629 -5.722 10.667 1.00 98.36 144 A 1 ATOM 1158 C C . GLN A 0 144 . -7.008 -5.860 9.192 1.00 98.36 144 A 1 ATOM 1159 C CB . GLN A 0 144 . -7.399 -6.753 11.502 1.00 98.36 144 A 1 ATOM 1160 O O . GLN A 0 144 . -8.131 -5.530 8.812 1.00 98.36 144 A 1 ATOM 1161 C CG . GLN A 0 144 . -7.187 -6.601 13.013 1.00 98.36 144 A 1 ATOM 1162 C CD . GLN A 0 144 . -5.715 -6.706 13.364 1.00 98.36 144 A 1 ATOM 1163 N NE2 . GLN A 0 144 . -5.117 -5.694 13.944 1.00 98.36 144 A 1 ATOM 1164 O OE1 . GLN A 0 144 . -5.061 -7.696 13.062 1.00 98.36 144 A 1 ATOM 1165 N N . PRO A 0 145 . -6.113 -6.366 8.328 1.00 98.47 145 A 1 ATOM 1166 C CA . PRO A 0 145 . -6.479 -6.702 6.958 1.00 98.47 145 A 1 ATOM 1167 C C . PRO A 0 145 . -7.444 -7.890 6.968 1.00 98.47 145 A 1 ATOM 1168 C CB . PRO A 0 145 . -5.156 -7.000 6.240 1.00 98.47 145 A 1 ATOM 1169 O O . PRO A 0 145 . -7.063 -8.984 7.389 1.00 98.47 145 A 1 ATOM 1170 C CG . PRO A 0 145 . -4.109 -6.342 7.137 1.00 98.47 145 A 1 ATOM 1171 C CD . PRO A 0 145 . -4.685 -6.529 8.528 1.00 98.47 145 A 1 ATOM 1172 N N . VAL A 0 146 . -8.674 -7.690 6.494 1.00 98.31 146 A 1 ATOM 1173 C CA . VAL A 0 146 . -9.753 -8.695 6.556 1.00 98.31 146 A 1 ATOM 1174 C C . VAL A 0 146 . -10.110 -9.300 5.203 1.00 98.31 146 A 1 ATOM 1175 C CB . VAL A 0 146 . -11.020 -8.142 7.231 1.00 98.31 146 A 1 ATOM 1176 O O . VAL A 0 146 . -10.627 -10.413 5.158 1.00 98.31 146 A 1 ATOM 1177 C CG1 . VAL A 0 146 . -10.780 -7.843 8.712 1.00 98.31 146 A 1 ATOM 1178 C CG2 . VAL A 0 146 . -11.566 -6.881 6.557 1.00 98.31 146 A 1 ATOM 1179 N N . LYS A 0 147 . -9.816 -8.609 4.094 1.00 98.41 147 A 1 ATOM 1180 C CA . LYS A 0 147 . -10.095 -9.124 2.745 1.00 98.41 147 A 1 ATOM 1181 C C . LYS A 0 147 . -9.134 -8.551 1.709 1.00 98.41 147 A 1 ATOM 1182 C CB . LYS A 0 147 . -11.577 -8.847 2.415 1.00 98.41 147 A 1 ATOM 1183 O O . LYS A 0 147 . -8.663 -7.420 1.840 1.00 98.41 147 A 1 ATOM 1184 C CG . LYS A 0 147 . -12.184 -9.774 1.344 1.00 98.41 147 A 1 ATOM 1185 C CD . LYS A 0 147 . -13.716 -9.824 1.504 1.00 98.41 147 A 1 ATOM 1186 C CE . LYS A 0 147 . -14.432 -10.583 0.382 1.00 98.41 147 A 1 ATOM 1187 N NZ . LYS A 0 147 . -15.899 -10.350 0.442 1.00 98.41 147 A 1 ATOM 1188 N N . ARG A 0 148 . -8.858 -9.327 0.659 1.00 98.63 148 A 1 ATOM 1189 C CA . ARG A 0 148 . -8.040 -8.935 -0.498 1.00 98.63 148 A 1 ATOM 1190 C C . ARG A 0 148 . -8.810 -9.167 -1.788 1.00 98.63 148 A 1 ATOM 1191 C CB . ARG A 0 148 . -6.719 -9.710 -0.466 1.00 98.63 148 A 1 ATOM 1192 O O . ARG A 0 148 . -9.385 -10.232 -1.985 1.00 98.63 148 A 1 ATOM 1193 C CG . ARG A 0 148 . -5.833 -9.495 -1.698 1.00 98.63 148 A 1 ATOM 1194 C CD . ARG A 0 148 . -4.588 -10.364 -1.544 1.00 98.63 148 A 1 ATOM 1195 N NE . ARG A 0 148 . -3.643 -10.164 -2.652 1.00 98.63 148 A 1 ATOM 1196 N NH1 . ARG A 0 148 . -1.844 -11.163 -1.621 1.00 98.63 148 A 1 ATOM 1197 N NH2 . ARG A 0 148 . -1.646 -10.412 -3.696 1.00 98.63 148 A 1 ATOM 1198 C CZ . ARG A 0 148 . -2.393 -10.578 -2.646 1.00 98.63 148 A 1 ATOM 1199 N N . TYR A 0 149 . -8.745 -8.198 -2.693 1.00 98.54 149 A 1 ATOM 1200 C CA . TYR A 0 149 . -9.456 -8.220 -3.966 1.00 98.54 149 A 1 ATOM 1201 C C . TYR A 0 149 . -8.485 -8.164 -5.134 1.00 98.54 149 A 1 ATOM 1202 C CB . TYR A 0 149 . -10.480 -7.088 -4.053 1.00 98.54 149 A 1 ATOM 1203 O O . TYR A 0 149 . -7.435 -7.509 -5.089 1.00 98.54 149 A 1 ATOM 1204 C CG . TYR A 0 149 . -11.359 -6.982 -2.831 1.00 98.54 149 A 1 ATOM 1205 C CD1 . TYR A 0 149 . -12.602 -7.644 -2.771 1.00 98.54 149 A 1 ATOM 1206 C CD2 . TYR A 0 149 . -10.898 -6.246 -1.727 1.00 98.54 149 A 1 ATOM 1207 C CE1 . TYR A 0 149 . -13.399 -7.529 -1.617 1.00 98.54 149 A 1 ATOM 1208 C CE2 . TYR A 0 149 . -11.676 -6.157 -0.570 1.00 98.54 149 A 1 ATOM 1209 O OH . TYR A 0 149 . -13.686 -6.650 0.600 1.00 98.54 149 A 1 ATOM 1210 C CZ . TYR A 0 149 . -12.936 -6.779 -0.517 1.00 98.54 149 A 1 ATOM 1211 N N . SER A 0 150 . -8.857 -8.871 -6.195 1.00 97.53 150 A 1 ATOM 1212 C CA . SER A 0 150 . -8.081 -8.929 -7.425 1.00 97.53 150 A 1 ATOM 1213 C C . SER A 0 150 . -8.063 -7.571 -8.150 1.00 97.53 150 A 1 ATOM 1214 C CB . SER A 0 150 . -8.646 -10.031 -8.324 1.00 97.53 150 A 1 ATOM 1215 O O . SER A 0 150 . -8.974 -6.760 -7.960 1.00 97.53 150 A 1 ATOM 1216 O OG . SER A 0 150 . -9.853 -9.617 -8.925 1.00 97.53 150 A 1 ATOM 1217 N N . PRO A 0 151 . -7.071 -7.326 -9.027 1.00 97.49 151 A 1 ATOM 1218 C CA . PRO A 0 151 . -7.041 -6.153 -9.903 1.00 97.49 151 A 1 ATOM 1219 C C . PRO A 0 151 . -8.346 -5.867 -10.657 1.00 97.49 151 A 1 ATOM 1220 C CB . PRO A 0 151 . -5.918 -6.452 -10.893 1.00 97.49 151 A 1 ATOM 1221 O O . PRO A 0 151 . -8.708 -4.707 -10.857 1.00 97.49 151 A 1 ATOM 1222 C CG . PRO A 0 151 . -4.929 -7.246 -10.048 1.00 97.49 151 A 1 ATOM 1223 C CD . PRO A 0 151 . -5.851 -8.105 -9.189 1.00 97.49 151 A 1 ATOM 1224 N N . THR A 0 152 . -9.050 -6.924 -11.072 1.00 97.11 152 A 1 ATOM 1225 C CA . THR A 0 152 . -10.257 -6.853 -11.905 1.00 97.11 152 A 1 ATOM 1226 C C . THR A 0 152 . -11.538 -6.622 -11.108 1.00 97.11 152 A 1 ATOM 1227 C CB . THR A 0 152 . -10.400 -8.130 -12.746 1.00 97.11 152 A 1 ATOM 1228 O O . THR A 0 152 . -12.532 -6.207 -11.701 1.00 97.11 152 A 1 ATOM 1229 C CG2 . THR A 0 152 . -9.296 -8.243 -13.798 1.00 97.11 152 A 1 ATOM 1230 O OG1 . THR A 0 152 . -10.279 -9.264 -11.924 1.00 97.11 152 A 1 ATOM 1231 N N . THR A 0 153 . -11.524 -6.827 -9.786 1.00 98.33 153 A 1 ATOM 1232 C CA . THR A 0 153 . -12.656 -6.507 -8.905 1.00 98.33 153 A 1 ATOM 1233 C C . THR A 0 153 . -12.867 -4.994 -8.887 1.00 98.33 153 A 1 ATOM 1234 C CB . THR A 0 153 . -12.405 -7.020 -7.479 1.00 98.33 153 A 1 ATOM 1235 O O . THR A 0 153 . -11.941 -4.244 -8.553 1.00 98.33 153 A 1 ATOM 1236 C CG2 . THR A 0 153 . -13.635 -6.839 -6.594 1.00 98.33 153 A 1 ATOM 1237 O OG1 . THR A 0 153 . -12.087 -8.403 -7.486 1.00 98.33 153 A 1 ATOM 1238 N N . ALA A 0 154 . -14.053 -4.523 -9.276 1.00 98.46 154 A 1 ATOM 1239 C CA . ALA A 0 154 . -14.337 -3.095 -9.302 1.00 98.46 154 A 1 ATOM 1240 C C . ALA A 0 154 . -14.467 -2.553 -7.869 1.00 98.46 154 A 1 ATOM 1241 C CB . ALA A 0 154 . -15.611 -2.854 -10.115 1.00 98.46 154 A 1 ATOM 1242 O O . ALA A 0 154 . -14.937 -3.283 -7.000 1.00 98.46 154 A 1 ATOM 1243 N N . PRO A 0 155 . -14.088 -1.292 -7.595 1.00 98.74 155 A 1 ATOM 1244 C CA . PRO A 0 155 . -14.339 -0.682 -6.290 1.00 98.74 155 A 1 ATOM 1245 C C . PRO A 0 155 . -15.794 -0.813 -5.810 1.00 98.74 155 A 1 ATOM 1246 C CB . PRO A 0 155 . -13.901 0.773 -6.438 1.00 98.74 155 A 1 ATOM 1247 O O . PRO A 0 155 . -16.004 -1.167 -4.655 1.00 98.74 155 A 1 ATOM 1248 C CG . PRO A 0 155 . -12.788 0.691 -7.483 1.00 98.74 155 A 1 ATOM 1249 C CD . PRO A 0 155 . -13.243 -0.433 -8.412 1.00 98.74 155 A 1 ATOM 1250 N N . TYR A 0 156 . -16.785 -0.640 -6.692 1.00 98.61 156 A 1 ATOM 1251 C CA . TYR A 0 156 . -18.199 -0.823 -6.328 1.00 98.61 156 A 1 ATOM 1252 C C . TYR A 0 156 . -18.562 -2.245 -5.896 1.00 98.61 156 A 1 ATOM 1253 C CB . TYR A 0 156 . -19.097 -0.385 -7.492 1.00 98.61 156 A 1 ATOM 1254 O O . TYR A 0 156 . -19.398 -2.412 -5.014 1.00 98.61 156 A 1 ATOM 1255 C CG . TYR A 0 156 . -19.134 1.104 -7.789 1.00 98.61 156 A 1 ATOM 1256 C CD1 . TYR A 0 156 . -18.843 2.051 -6.786 1.00 98.61 156 A 1 ATOM 1257 C CD2 . TYR A 0 156 . -19.573 1.545 -9.055 1.00 98.61 156 A 1 ATOM 1258 C CE1 . TYR A 0 156 . -18.976 3.419 -7.048 1.00 98.61 156 A 1 ATOM 1259 C CE2 . TYR A 0 156 . -19.713 2.923 -9.316 1.00 98.61 156 A 1 ATOM 1260 O OH . TYR A 0 156 . -19.595 5.183 -8.504 1.00 98.61 156 A 1 ATOM 1261 C CZ . TYR A 0 156 . -19.422 3.858 -8.302 1.00 98.61 156 A 1 ATOM 1262 N N . ASP A 0 157 . -17.888 -3.267 -6.426 1.00 98.54 157 A 1 ATOM 1263 C CA . ASP A 0 157 . -18.131 -4.660 -6.026 1.00 98.54 157 A 1 ATOM 1264 C C . ASP A 0 157 . -17.676 -4.929 -4.574 1.00 98.54 157 A 1 ATOM 1265 C CB . ASP A 0 157 . -17.419 -5.635 -6.985 1.00 98.54 157 A 1 ATOM 1266 O O . ASP A 0 157 . -18.006 -5.963 -4.001 1.00 98.54 157 A 1 ATOM 1267 C CG . ASP A 0 157 . -17.691 -5.431 -8.482 1.00 98.54 157 A 1 ATOM 1268 O OD1 . ASP A 0 157 . -18.765 -4.911 -8.853 1.00 98.54 157 A 1 ATOM 1269 O OD2 . ASP A 0 157 . -16.763 -5.751 -9.270 1.00 98.54 157 A 1 ATOM 1270 N N . ILE A 0 158 . -16.907 -4.007 -3.978 1.00 98.48 158 A 1 ATOM 1271 C CA . ILE A 0 158 . -16.378 -4.078 -2.606 1.00 98.48 158 A 1 ATOM 1272 C C . ILE A 0 158 . -17.288 -3.322 -1.619 1.00 98.48 158 A 1 ATOM 1273 C CB . ILE A 0 158 . -14.914 -3.555 -2.582 1.00 98.48 158 A 1 ATOM 1274 O O . ILE A 0 158 . -17.113 -3.420 -0.404 1.00 98.48 158 A 1 ATOM 1275 C CG1 . ILE A 0 158 . -14.037 -4.274 -3.637 1.00 98.48 158 A 1 ATOM 1276 C CG2 . ILE A 0 158 . -14.294 -3.709 -1.181 1.00 98.48 158 A 1 ATOM 1277 C CD1 . ILE A 0 158 . -12.644 -3.668 -3.844 1.00 98.48 158 A 1 ATOM 1278 N N . GLU A 0 159 . -18.271 -2.557 -2.106 1.00 97.84 159 A 1 ATOM 1279 C CA . GLU A 0 159 . -19.084 -1.677 -1.262 1.00 97.84 159 A 1 ATOM 1280 C C . GLU A 0 159 . -19.867 -2.435 -0.185 1.00 97.84 159 A 1 ATOM 1281 C CB . GLU A 0 159 . -20.011 -0.831 -2.141 1.00 97.84 159 A 1 ATOM 1282 O O . GLU A 0 159 . -19.920 -1.970 0.950 1.00 97.84 159 A 1 ATOM 1283 C CG . GLU A 0 159 . -20.789 0.191 -1.295 1.00 97.84 159 A 1 ATOM 1284 C CD . GLU A 0 159 . -21.456 1.285 -2.129 1.00 97.84 159 A 1 ATOM 1285 O OE1 . GLU A 0 159 . -22.363 1.967 -1.603 1.00 97.84 159 A 1 ATOM 1286 O OE2 . GLU A 0 159 . -20.976 1.591 -3.242 1.00 97.84 159 A 1 ATOM 1287 N N . GLY A 0 160 . -20.399 -3.621 -0.498 1.00 98.09 160 A 1 ATOM 1288 C CA . GLY A 0 160 . -21.099 -4.454 0.486 1.00 98.09 160 A 1 ATOM 1289 C C . GLY A 0 160 . -20.215 -4.825 1.682 1.00 98.09 160 A 1 ATOM 1290 O O . GLY A 0 160 . -20.618 -4.632 2.827 1.00 98.09 160 A 1 ATOM 1291 N N . ASP A 0 161 . -18.978 -5.261 1.421 1.00 98.57 161 A 1 ATOM 1292 C CA . ASP A 0 161 . -18.011 -5.596 2.476 1.00 98.57 161 A 1 ATOM 1293 C C . ASP A 0 161 . -17.605 -4.353 3.289 1.00 98.57 161 A 1 ATOM 1294 C CB . ASP A 0 161 . -16.746 -6.209 1.856 1.00 98.57 161 A 1 ATOM 1295 O O . ASP A 0 161 . -17.420 -4.421 4.504 1.00 98.57 161 A 1 ATOM 1296 C CG . ASP A 0 161 . -16.946 -7.534 1.116 1.00 98.57 161 A 1 ATOM 1297 O OD1 . ASP A 0 161 . -17.532 -8.490 1.660 1.00 98.57 161 A 1 ATOM 1298 O OD2 . ASP A 0 161 . -16.351 -7.722 0.031 1.00 98.57 161 A 1 ATOM 1299 N N . ILE A 0 162 . -17.466 -3.194 2.631 1.00 98.66 162 A 1 ATOM 1300 C CA . ILE A 0 162 . -17.186 -1.922 3.312 1.00 98.66 162 A 1 ATOM 1301 C C . ILE A 0 162 . -18.339 -1.550 4.242 1.00 98.66 162 A 1 ATOM 1302 C CB . ILE A 0 162 . -16.886 -0.806 2.286 1.00 98.66 162 A 1 ATOM 1303 O O . ILE A 0 162 . -18.089 -1.199 5.393 1.00 98.66 162 A 1 ATOM 1304 C CG1 . ILE A 0 162 . -15.449 -0.984 1.756 1.00 98.66 162 A 1 ATOM 1305 C CG2 . ILE A 0 162 . -17.044 0.606 2.886 1.00 98.66 162 A 1 ATOM 1306 C CD1 . ILE A 0 162 . -15.191 -0.248 0.440 1.00 98.66 162 A 1 ATOM 1307 N N . MET A 0 163 . -19.582 -1.628 3.768 1.00 97.87 163 A 1 ATOM 1308 C CA . MET A 0 163 . -20.763 -1.285 4.559 1.00 97.87 163 A 1 ATOM 1309 C C . MET A 0 163 . -20.891 -2.183 5.793 1.00 97.87 163 A 1 ATOM 1310 C CB . MET A 0 163 . -22.018 -1.344 3.678 1.00 97.87 163 A 1 ATOM 1311 O O . MET A 0 163 . -21.087 -1.658 6.887 1.00 97.87 163 A 1 ATOM 1312 C CG . MET A 0 163 . -22.077 -0.170 2.686 1.00 97.87 163 A 1 ATOM 1313 S SD . MET A 0 163 . -22.156 1.499 3.413 1.00 97.87 163 A 1 ATOM 1314 C CE . MET A 0 163 . -23.758 1.384 4.255 1.00 97.87 163 A 1 ATOM 1315 N N . GLU A 0 164 . -20.647 -3.490 5.654 1.00 98.18 164 A 1 ATOM 1316 C CA . GLU A 0 164 . -20.635 -4.423 6.789 1.00 98.18 164 A 1 ATOM 1317 C C . GLU A 0 164 . -19.633 -3.993 7.878 1.00 98.18 164 A 1 ATOM 1318 C CB . GLU A 0 164 . -20.292 -5.839 6.287 1.00 98.18 164 A 1 ATOM 1319 O O . GLU A 0 164 . -19.943 -4.012 9.069 1.00 98.18 164 A 1 ATOM 1320 C CG . GLU A 0 164 . -20.536 -6.902 7.373 1.00 98.18 164 A 1 ATOM 1321 C CD . GLU A 0 164 . -19.850 -8.245 7.089 1.00 98.18 164 A 1 ATOM 1322 O OE1 . GLU A 0 164 . -19.352 -8.839 8.084 1.00 98.18 164 A 1 ATOM 1323 O OE2 . GLU A 0 164 . -19.772 -8.658 5.915 1.00 98.18 164 A 1 ATOM 1324 N N . LEU A 0 165 . -18.423 -3.565 7.495 1.00 98.23 165 A 1 ATOM 1325 C CA . LEU A 0 165 . -17.425 -3.087 8.460 1.00 98.23 165 A 1 ATOM 1326 C C . LEU A 0 165 . -17.743 -1.696 9.015 1.00 98.23 165 A 1 ATOM 1327 C CB . LEU A 0 165 . -16.032 -3.070 7.823 1.00 98.23 165 A 1 ATOM 1328 O O . LEU A 0 165 . -17.377 -1.395 10.151 1.00 98.23 165 A 1 ATOM 1329 C CG . LEU A 0 165 . -15.484 -4.435 7.396 1.00 98.23 165 A 1 ATOM 1330 C CD1 . LEU A 0 165 . -14.078 -4.220 6.846 1.00 98.23 165 A 1 ATOM 1331 C CD2 . LEU A 0 165 . -15.410 -5.446 8.542 1.00 98.23 165 A 1 ATOM 1332 N N . LEU A 0 166 . -18.402 -0.836 8.235 1.00 97.49 166 A 1 ATOM 1333 C CA . LEU A 0 166 . -18.813 0.486 8.701 1.00 97.49 166 A 1 ATOM 1334 C C . LEU A 0 166 . -19.921 0.395 9.760 1.00 97.49 166 A 1 ATOM 1335 C CB . LEU A 0 166 . -19.246 1.368 7.516 1.00 97.49 166 A 1 ATOM 1336 O O . LEU A 0 166 . -19.969 1.259 10.636 1.00 97.49 166 A 1 ATOM 1337 C CG . LEU A 0 166 . -18.102 1.843 6.600 1.00 97.49 166 A 1 ATOM 1338 C CD1 . LEU A 0 166 . -18.692 2.596 5.405 1.00 97.49 166 A 1 ATOM 1339 C CD2 . LEU A 0 166 . -17.133 2.797 7.298 1.00 97.49 166 A 1 ATOM 1340 N N . GLU A 0 167 . -20.757 -0.642 9.713 1.00 95.44 167 A 1 ATOM 1341 C CA . GLU A 0 167 . -21.821 -0.913 10.690 1.00 95.44 167 A 1 ATOM 1342 C C . GLU A 0 167 . -21.314 -1.582 11.980 1.00 95.44 167 A 1 ATOM 1343 C CB . GLU A 0 167 . -22.899 -1.773 10.013 1.00 95.44 167 A 1 ATOM 1344 O O . GLU A 0 167 . -21.961 -1.481 13.027 1.00 95.44 167 A 1 ATOM 1345 C CG . GLU A 0 167 . -23.681 -0.957 8.970 1.00 95.44 167 A 1 ATOM 1346 C CD . GLU A 0 167 . -24.662 -1.793 8.135 1.00 95.44 167 A 1 ATOM 1347 O OE1 . GLU A 0 167 . -25.288 -1.175 7.241 1.00 95.44 167 A 1 ATOM 1348 O OE2 . GLU A 0 167 . -24.808 -3.005 8.407 1.00 95.44 167 A 1 ATOM 1349 N N . LYS A 0 168 . -20.134 -2.215 11.943 1.00 88.96 168 A 1 ATOM 1350 C CA . LYS A 0 168 . -19.472 -2.763 13.136 1.00 88.96 168 A 1 ATOM 1351 C C . LYS A 0 168 . -18.922 -1.632 14.013 1.00 88.96 168 A 1 ATOM 1352 C CB . LYS A 0 168 . -18.395 -3.788 12.737 1.00 88.96 168 A 1 ATOM 1353 O O . LYS A 0 168 . -18.260 -0.712 13.519 1.00 88.96 168 A 1 ATOM 1354 C CG . LYS A 0 168 . -19.046 -5.088 12.232 1.00 88.96 168 A 1 ATOM 1355 C CD . LYS A 0 168 . -18.029 -6.091 11.671 1.00 88.96 168 A 1 ATOM 1356 C CE . LYS A 0 168 . -18.806 -7.254 11.038 1.00 88.96 168 A 1 ATOM 1357 N NZ . LYS A 0 168 . -17.947 -8.190 10.275 1.00 88.96 168 A 1 ATOM 1358 N N . LYS A 0 169 . -19.226 -1.711 15.312 1.00 70.11 169 A 1 ATOM 1359 C CA . LYS A 0 169 . -18.716 -0.805 16.352 1.00 70.11 169 A 1 ATOM 1360 C C . LYS A 0 169 . -17.279 -1.147 16.729 1.00 70.11 169 A 1 ATOM 1361 C CB . LYS A 0 169 . -19.624 -0.808 17.592 1.00 70.11 169 A 1 ATOM 1362 O O . LYS A 0 169 . -16.960 -2.354 16.790 1.00 70.11 169 A 1 ATOM 1363 C CG . LYS A 0 169 . -20.980 -0.142 17.324 1.00 70.11 169 A 1 ATOM 1364 C CD . LYS A 0 169 . -21.787 -0.035 18.623 1.00 70.11 169 A 1 ATOM 1365 C CE . LYS A 0 169 . -23.123 0.663 18.352 1.00 70.11 169 A 1 ATOM 1366 N NZ . LYS A 0 169 . -23.936 0.781 19.587 1.00 70.11 169 A 1 ATOM 1367 O OXT . LYS A 0 169 . -16.546 -0.167 16.963 1.00 70.11 169 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 96.18 # loop_ _atom_type.symbol C N O S #