data_0 # _entry.id 0 # _struct_asym.id A _struct_asym.entity_id 0 # _entity_poly.entity_id 0 _entity_poly.type polypeptide(L) _entity_poly.pdbx_strand_id A # _entity.id 0 _entity.type polymer # loop_ _entity_poly_seq.entity_id _entity_poly_seq.num _entity_poly_seq.mon_id 0 1 MET 0 2 ILE 0 3 VAL 0 4 ASP 0 5 ILE 0 6 ASN 0 7 CYS 0 8 LYS 0 9 SER 0 10 LYS 0 11 ARG 0 12 GLU 0 13 VAL 0 14 ALA 0 15 ASP 0 16 THR 0 17 ALA 0 18 LEU 0 19 LEU 0 20 SER 0 21 MET 0 22 SER 0 23 ALA 0 24 PHE 0 25 MET 0 26 ASN 0 27 HIS 0 28 VAL 0 29 GLU 0 30 LEU 0 31 MET 0 32 LYS 0 33 ALA 0 34 GLU 0 35 TYR 0 36 PRO 0 37 THR 0 38 ILE 0 39 HIS 0 40 LEU 0 41 ASN 0 42 PHE 0 43 THR 0 44 GLN 0 45 LEU 0 46 ASN 0 47 THR 0 48 CYS 0 49 PHE 0 50 ASN 0 51 GLU 0 52 GLN 0 53 ALA 0 54 GLU 0 55 HIS 0 56 TYR 0 57 LYS 0 58 LYS 0 59 MET 0 60 LYS 0 61 SER 0 62 ASP 0 63 HIS 0 64 SER 0 65 GLU 0 66 GLU 0 67 ILE 0 68 CYS 0 69 GLN 0 70 MET 0 71 LEU 0 72 THR 0 73 GLN 0 74 TYR 0 75 ASN 0 76 SER 0 77 SER 0 78 ASP 0 79 LEU 0 80 GLU 0 81 GLU 0 82 ILE 0 83 ASP 0 84 VAL 0 85 TYR 0 86 ILE 0 87 ASN 0 88 MET 0 89 LYS 0 90 TYR 0 91 TYR 0 92 ASN 0 93 ILE 0 94 TYR 0 95 GLN 0 96 PHE 0 97 ASN 0 98 PHE 0 99 LYS 0 100 LEU 0 101 TYR 0 102 GLU 0 103 HIS 0 104 ASP 0 105 LEU 0 106 ILE 0 107 SER 0 108 ARG 0 109 ILE 0 110 ILE 0 111 ASP 0 112 MET 0 113 LEU 0 114 ARG 0 115 ASN 0 116 ASN 0 117 SER 0 118 ASN 0 119 ASP 0 120 ASP 0 121 ARG 0 122 TYR 0 123 TYR 0 124 ASP 0 125 PRO 0 126 TYR 0 127 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 . -22.027 -0.303 18.973 1.00 62.96 1 A 1 ATOM 2 C CA . MET A 0 1 . -20.809 0.520 18.809 1.00 62.96 1 A 1 ATOM 3 C C . MET A 0 1 . -19.653 -0.266 18.188 1.00 62.96 1 A 1 ATOM 4 C CB . MET A 0 1 . -20.418 1.240 20.103 1.00 62.96 1 A 1 ATOM 5 O O . MET A 0 1 . -19.314 0.027 17.057 1.00 62.96 1 A 1 ATOM 6 C CG . MET A 0 1 . -19.626 2.507 19.777 1.00 62.96 1 A 1 ATOM 7 S SD . MET A 0 1 . -18.904 3.303 21.225 1.00 62.96 1 A 1 ATOM 8 C CE . MET A 0 1 . -20.386 3.768 22.161 1.00 62.96 1 A 1 ATOM 9 N N . ILE A 0 2 . -19.094 -1.300 18.839 1.00 71.01 2 A 1 ATOM 10 C CA . ILE A 0 2 . -17.909 -2.032 18.318 1.00 71.01 2 A 1 ATOM 11 C C . ILE A 0 2 . -18.123 -2.605 16.903 1.00 71.01 2 A 1 ATOM 12 C CB . ILE A 0 2 . -17.487 -3.153 19.306 1.00 71.01 2 A 1 ATOM 13 O O . ILE A 0 2 . -17.233 -2.523 16.060 1.00 71.01 2 A 1 ATOM 14 C CG1 . ILE A 0 2 . -17.091 -2.551 20.676 1.00 71.01 2 A 1 ATOM 15 C CG2 . ILE A 0 2 . -16.329 -3.999 18.737 1.00 71.01 2 A 1 ATOM 16 C CD1 . ILE A 0 2 . -16.804 -3.594 21.764 1.00 71.01 2 A 1 ATOM 17 N N . VAL A 0 3 . -19.308 -3.167 16.636 1.00 72.99 3 A 1 ATOM 18 C CA . VAL A 0 3 . -19.642 -3.771 15.334 1.00 72.99 3 A 1 ATOM 19 C C . VAL A 0 3 . -19.663 -2.729 14.206 1.00 72.99 3 A 1 ATOM 20 C CB . VAL A 0 3 . -20.978 -4.536 15.432 1.00 72.99 3 A 1 ATOM 21 O O . VAL A 0 3 . -19.145 -3.001 13.127 1.00 72.99 3 A 1 ATOM 22 C CG1 . VAL A 0 3 . -21.414 -5.120 14.092 1.00 72.99 3 A 1 ATOM 23 C CG2 . VAL A 0 3 . -20.879 -5.700 16.431 1.00 72.99 3 A 1 ATOM 24 N N . ASP A 0 4 . -20.181 -1.533 14.484 1.00 81.19 4 A 1 ATOM 25 C CA . ASP A 0 4 . -20.249 -0.414 13.537 1.00 81.19 4 A 1 ATOM 26 C C . ASP A 0 4 . -18.849 0.129 13.203 1.00 81.19 4 A 1 ATOM 27 C CB . ASP A 0 4 . -21.157 0.663 14.152 1.00 81.19 4 A 1 ATOM 28 O O . ASP A 0 4 . -18.442 0.149 12.044 1.00 81.19 4 A 1 ATOM 29 C CG . ASP A 0 4 . -21.337 1.884 13.254 1.00 81.19 4 A 1 ATOM 30 O OD1 . ASP A 0 4 . -21.069 1.776 12.046 1.00 81.19 4 A 1 ATOM 31 O OD2 . ASP A 0 4 . -21.770 2.921 13.799 1.00 81.19 4 A 1 ATOM 32 N N . ILE A 0 5 . -18.041 0.417 14.231 1.00 84.85 5 A 1 ATOM 33 C CA . ILE A 0 5 . -16.655 0.895 14.073 1.00 84.85 5 A 1 ATOM 34 C C . ILE A 0 5 . -15.833 -0.074 13.211 1.00 84.85 5 A 1 ATOM 35 C CB . ILE A 0 5 . -16.008 1.081 15.466 1.00 84.85 5 A 1 ATOM 36 O O . ILE A 0 5 . -15.078 0.343 12.334 1.00 84.85 5 A 1 ATOM 37 C CG1 . ILE A 0 5 . -16.731 2.203 16.246 1.00 84.85 5 A 1 ATOM 38 C CG2 . ILE A 0 5 . -14.501 1.395 15.364 1.00 84.85 5 A 1 ATOM 39 C CD1 . ILE A 0 5 . -16.326 2.282 17.723 1.00 84.85 5 A 1 ATOM 40 N N . ASN A 0 6 . -15.979 -1.383 13.436 1.00 90.68 6 A 1 ATOM 41 C CA . ASN A 0 6 . -15.290 -2.393 12.637 1.00 90.68 6 A 1 ATOM 42 C C . ASN A 0 6 . -15.792 -2.432 11.185 1.00 90.68 6 A 1 ATOM 43 C CB . ASN A 0 6 . -15.460 -3.747 13.331 1.00 90.68 6 A 1 ATOM 44 O O . ASN A 0 6 . -14.987 -2.633 10.277 1.00 90.68 6 A 1 ATOM 45 C CG . ASN A 0 6 . -14.701 -4.861 12.632 1.00 90.68 6 A 1 ATOM 46 N ND2 . ASN A 0 6 . -15.360 -5.957 12.339 1.00 90.68 6 A 1 ATOM 47 O OD1 . ASN A 0 6 . -13.509 -4.807 12.384 1.00 90.68 6 A 1 ATOM 48 N N . CYS A 0 7 . -17.096 -2.236 10.963 1.00 91.70 7 A 1 ATOM 49 C CA . CYS A 0 7 . -17.671 -2.156 9.623 1.00 91.70 7 A 1 ATOM 50 C C . CYS A 0 7 . -17.084 -0.973 8.850 1.00 91.70 7 A 1 ATOM 51 C CB . CYS A 0 7 . -19.201 -2.082 9.715 1.00 91.70 7 A 1 ATOM 52 O O . CYS A 0 7 . -16.445 -1.173 7.815 1.00 91.70 7 A 1 ATOM 53 S SG . CYS A 0 7 . -20.051 -2.246 8.123 1.00 91.70 7 A 1 ATOM 54 N N . LYS A 0 8 . -17.196 0.235 9.412 1.00 90.39 8 A 1 ATOM 55 C CA . LYS A 0 8 . -16.675 1.465 8.806 1.00 90.39 8 A 1 ATOM 56 C C . LYS A 0 8 . -15.170 1.390 8.572 1.00 90.39 8 A 1 ATOM 57 C CB . LYS A 0 8 . -17.033 2.664 9.690 1.00 90.39 8 A 1 ATOM 58 O O . LYS A 0 8 . -14.706 1.668 7.475 1.00 90.39 8 A 1 ATOM 59 C CG . LYS A 0 8 . -18.549 2.912 9.728 1.00 90.39 8 A 1 ATOM 60 C CD . LYS A 0 8 . -18.815 4.166 10.554 1.00 90.39 8 A 1 ATOM 61 C CE . LYS A 0 8 . -20.293 4.536 10.631 1.00 90.39 8 A 1 ATOM 62 N NZ . LYS A 0 8 . -20.466 5.696 11.531 1.00 90.39 8 A 1 ATOM 63 N N . SER A 0 9 . -14.411 0.897 9.551 1.00 92.52 9 A 1 ATOM 64 C CA . SER A 0 9 . -12.966 0.689 9.415 1.00 92.52 9 A 1 ATOM 65 C C . SER A 0 9 . -12.614 -0.211 8.226 1.00 92.52 9 A 1 ATOM 66 C CB . SER A 0 9 . -12.425 0.105 10.719 1.00 92.52 9 A 1 ATOM 67 O O . SER A 0 9 . -11.755 0.142 7.423 1.00 92.52 9 A 1 ATOM 68 O OG . SER A 0 9 . -11.029 -0.113 10.674 1.00 92.52 9 A 1 ATOM 69 N N . LYS A 0 10 . -13.294 -1.352 8.052 1.00 94.82 10 A 1 ATOM 70 C CA . LYS A 0 10 . -13.047 -2.252 6.912 1.00 94.82 10 A 1 ATOM 71 C C . LYS A 0 10 . -13.446 -1.642 5.573 1.00 94.82 10 A 1 ATOM 72 C CB . LYS A 0 10 . -13.813 -3.554 7.102 1.00 94.82 10 A 1 ATOM 73 O O . LYS A 0 10 . -12.750 -1.866 4.584 1.00 94.82 10 A 1 ATOM 74 C CG . LYS A 0 10 . -13.151 -4.457 8.148 1.00 94.82 10 A 1 ATOM 75 C CD . LYS A 0 10 . -14.044 -5.681 8.250 1.00 94.82 10 A 1 ATOM 76 C CE . LYS A 0 10 . -13.556 -6.757 9.203 1.00 94.82 10 A 1 ATOM 77 N NZ . LYS A 0 10 . -14.486 -7.906 9.087 1.00 94.82 10 A 1 ATOM 78 N N . ARG A 0 11 . -14.531 -0.870 5.542 1.00 93.46 11 A 1 ATOM 79 C CA . ARG A 0 11 . -14.917 -0.108 4.354 1.00 93.46 11 A 1 ATOM 80 C C . ARG A 0 11 . -13.816 0.877 3.960 1.00 93.46 11 A 1 ATOM 81 C CB . ARG A 0 11 . -16.235 0.610 4.632 1.00 93.46 11 A 1 ATOM 82 O O . ARG A 0 11 . -13.360 0.839 2.823 1.00 93.46 11 A 1 ATOM 83 C CG . ARG A 0 11 . -16.809 1.189 3.334 1.00 93.46 11 A 1 ATOM 84 C CD . ARG A 0 11 . -17.946 2.153 3.644 1.00 93.46 11 A 1 ATOM 85 N NE . ARG A 0 11 . -17.430 3.380 4.285 1.00 93.46 11 A 1 ATOM 86 N NH1 . ARG A 0 11 . -18.950 4.839 3.437 1.00 93.46 11 A 1 ATOM 87 N NH2 . ARG A 0 11 . -17.532 5.546 4.969 1.00 93.46 11 A 1 ATOM 88 C CZ . ARG A 0 11 . -17.966 4.578 4.230 1.00 93.46 11 A 1 ATOM 89 N N . GLU A 0 12 . -13.318 1.660 4.916 1.00 92.79 12 A 1 ATOM 90 C CA . GLU A 0 12 . -12.255 2.645 4.683 1.00 92.79 12 A 1 ATOM 91 C C . GLU A 0 12 . -10.924 2.000 4.273 1.00 92.79 12 A 1 ATOM 92 C CB . GLU A 0 12 . -12.059 3.520 5.933 1.00 92.79 12 A 1 ATOM 93 O O . GLU A 0 12 . -10.234 2.525 3.398 1.00 92.79 12 A 1 ATOM 94 C CG . GLU A 0 12 . -13.250 4.448 6.224 1.00 92.79 12 A 1 ATOM 95 C CD . GLU A 0 12 . -13.605 5.369 5.057 1.00 92.79 12 A 1 ATOM 96 O OE1 . GLU A 0 12 . -14.828 5.599 4.895 1.00 92.79 12 A 1 ATOM 97 O OE2 . GLU A 0 12 . -12.681 5.742 4.297 1.00 92.79 12 A 1 ATOM 98 N N . VAL A 0 13 . -10.577 0.824 4.823 1.00 94.25 13 A 1 ATOM 99 C CA . VAL A 0 13 . -9.445 0.011 4.327 1.00 94.25 13 A 1 ATOM 100 C C . VAL A 0 13 . -9.614 -0.275 2.839 1.00 94.25 13 A 1 ATOM 101 C CB . VAL A 0 13 . -9.323 -1.354 5.044 1.00 94.25 13 A 1 ATOM 102 O O . VAL A 0 13 . -8.681 -0.071 2.062 1.00 94.25 13 A 1 ATOM 103 C CG1 . VAL A 0 13 . -8.263 -2.272 4.414 1.00 94.25 13 A 1 ATOM 104 C CG2 . VAL A 0 13 . -8.928 -1.248 6.510 1.00 94.25 13 A 1 ATOM 105 N N . ALA A 0 14 . -10.783 -0.789 2.454 1.00 95.68 14 A 1 ATOM 106 C CA . ALA A 0 14 . -11.047 -1.211 1.090 1.00 95.68 14 A 1 ATOM 107 C C . ALA A 0 14 . -11.047 -0.027 0.118 1.00 95.68 14 A 1 ATOM 108 C CB . ALA A 0 14 . -12.370 -1.976 1.073 1.00 95.68 14 A 1 ATOM 109 O O . ALA A 0 14 . -10.403 -0.097 -0.929 1.00 95.68 14 A 1 ATOM 110 N N . ASP A 0 15 . -11.701 1.071 0.489 1.00 94.07 15 A 1 ATOM 111 C CA . ASP A 0 15 . -11.734 2.300 -0.300 1.00 94.07 15 A 1 ATOM 112 C C . ASP A 0 15 . -10.344 2.885 -0.508 1.00 94.07 15 A 1 ATOM 113 C CB . ASP A 0 15 . -12.674 3.319 0.379 1.00 94.07 15 A 1 ATOM 114 O O . ASP A 0 15 . -9.924 3.140 -1.639 1.00 94.07 15 A 1 ATOM 115 C CG . ASP A 0 15 . -14.119 3.093 -0.054 1.00 94.07 15 A 1 ATOM 116 O OD1 . ASP A 0 15 . -14.286 2.726 -1.238 1.00 94.07 15 A 1 ATOM 117 O OD2 . ASP A 0 15 . -15.081 3.296 0.712 1.00 94.07 15 A 1 ATOM 118 N N . THR A 0 16 . -9.584 3.008 0.574 1.00 92.85 16 A 1 ATOM 119 C CA . THR A 0 16 . -8.222 3.537 0.539 1.00 92.85 16 A 1 ATOM 120 C C . THR A 0 16 . -7.299 2.657 -0.295 1.00 92.85 16 A 1 ATOM 121 C CB . THR A 0 16 . -7.708 3.661 1.970 1.00 92.85 16 A 1 ATOM 122 O O . THR A 0 16 . -6.488 3.176 -1.064 1.00 92.85 16 A 1 ATOM 123 C CG2 . THR A 0 16 . -6.288 4.200 2.085 1.00 92.85 16 A 1 ATOM 124 O OG1 . THR A 0 16 . -8.534 4.589 2.625 1.00 92.85 16 A 1 ATOM 125 N N . ALA A 0 17 . -7.412 1.330 -0.193 1.00 93.39 17 A 1 ATOM 126 C CA . ALA A 0 17 . -6.605 0.410 -0.989 1.00 93.39 17 A 1 ATOM 127 C C . ALA A 0 17 . -6.906 0.535 -2.491 1.00 93.39 17 A 1 ATOM 128 C CB . ALA A 0 17 . -6.835 -1.015 -0.484 1.00 93.39 17 A 1 ATOM 129 O O . ALA A 0 17 . -5.979 0.656 -3.292 1.00 93.39 17 A 1 ATOM 130 N N . LEU A 0 18 . -8.188 0.580 -2.869 1.00 94.73 18 A 1 ATOM 131 C CA . LEU A 0 18 . -8.609 0.747 -4.264 1.00 94.73 18 A 1 ATOM 132 C C . LEU A 0 18 . -8.148 2.095 -4.839 1.00 94.73 18 A 1 ATOM 133 C CB . LEU A 0 18 . -10.140 0.606 -4.350 1.00 94.73 18 A 1 ATOM 134 O O . LEU A 0 18 . -7.613 2.140 -5.950 1.00 94.73 18 A 1 ATOM 135 C CG . LEU A 0 18 . -10.660 -0.823 -4.108 1.00 94.73 18 A 1 ATOM 136 C CD1 . LEU A 0 18 . -12.183 -0.805 -3.960 1.00 94.73 18 A 1 ATOM 137 C CD2 . LEU A 0 18 . -10.302 -1.767 -5.258 1.00 94.73 18 A 1 ATOM 138 N N . LEU A 0 19 . -8.290 3.177 -4.068 1.00 93.22 19 A 1 ATOM 139 C CA . LEU A 0 19 . -7.790 4.505 -4.434 1.00 93.22 19 A 1 ATOM 140 C C . LEU A 0 19 . -6.265 4.511 -4.600 1.00 93.22 19 A 1 ATOM 141 C CB . LEU A 0 19 . -8.224 5.526 -3.367 1.00 93.22 19 A 1 ATOM 142 O O . LEU A 0 19 . -5.767 5.024 -5.601 1.00 93.22 19 A 1 ATOM 143 C CG . LEU A 0 19 . -9.714 5.909 -3.421 1.00 93.22 19 A 1 ATOM 144 C CD1 . LEU A 0 19 . -10.073 6.725 -2.180 1.00 93.22 19 A 1 ATOM 145 C CD2 . LEU A 0 19 . -10.041 6.751 -4.658 1.00 93.22 19 A 1 ATOM 146 N N . SER A 0 20 . -5.531 3.891 -3.669 1.00 91.24 20 A 1 ATOM 147 C CA . SER A 0 20 . -4.065 3.771 -3.725 1.00 91.24 20 A 1 ATOM 148 C C . SER A 0 20 . -3.606 3.086 -5.010 1.00 91.24 20 A 1 ATOM 149 C CB . SER A 0 20 . -3.511 2.955 -2.546 1.00 91.24 20 A 1 ATOM 150 O O . SER A 0 20 . -2.734 3.598 -5.710 1.00 91.24 20 A 1 ATOM 151 O OG . SER A 0 20 . -3.861 3.470 -1.278 1.00 91.24 20 A 1 ATOM 152 N N . MET A 0 21 . -4.212 1.941 -5.339 1.00 91.74 21 A 1 ATOM 153 C CA . MET A 0 21 . -3.865 1.167 -6.532 1.00 91.74 21 A 1 ATOM 154 C C . MET A 0 21 . -4.151 1.951 -7.811 1.00 91.74 21 A 1 ATOM 155 C CB . MET A 0 21 . -4.651 -0.147 -6.548 1.00 91.74 21 A 1 ATOM 156 O O . MET A 0 21 . -3.296 2.019 -8.692 1.00 91.74 21 A 1 ATOM 157 C CG . MET A 0 21 . -4.189 -1.104 -5.453 1.00 91.74 21 A 1 ATOM 158 S SD . MET A 0 21 . -5.265 -2.546 -5.305 1.00 91.74 21 A 1 ATOM 159 C CE . MET A 0 21 . -4.563 -3.216 -3.789 1.00 91.74 21 A 1 ATOM 160 N N . SER A 0 22 . -5.325 2.585 -7.900 1.00 92.69 22 A 1 ATOM 161 C CA . SER A 0 22 . -5.692 3.395 -9.064 1.00 92.69 22 A 1 ATOM 162 C C . SER A 0 22 . -4.764 4.599 -9.238 1.00 92.69 22 A 1 ATOM 163 C CB . SER A 0 22 . -7.136 3.879 -8.932 1.00 92.69 22 A 1 ATOM 164 O O . SER A 0 22 . -4.340 4.882 -10.359 1.00 92.69 22 A 1 ATOM 165 O OG . SER A 0 22 . -7.548 4.502 -10.134 1.00 92.69 22 A 1 ATOM 166 N N . ALA A 0 23 . -4.436 5.303 -8.150 1.00 92.30 23 A 1 ATOM 167 C CA . ALA A 0 23 . -3.541 6.456 -8.183 1.00 92.30 23 A 1 ATOM 168 C C . ALA A 0 23 . -2.136 6.056 -8.642 1.00 92.30 23 A 1 ATOM 169 C CB . ALA A 0 23 . -3.509 7.096 -6.791 1.00 92.30 23 A 1 ATOM 170 O O . ALA A 0 23 . -1.556 6.717 -9.503 1.00 92.30 23 A 1 ATOM 171 N N . PHE A 0 24 . -1.616 4.942 -8.122 1.00 90.63 24 A 1 ATOM 172 C CA . PHE A 0 24 . -0.315 4.424 -8.523 1.00 90.63 24 A 1 ATOM 173 C C . PHE A 0 24 . -0.282 4.019 -10.001 1.00 90.63 24 A 1 ATOM 174 C CB . PHE A 0 24 . 0.060 3.246 -7.624 1.00 90.63 24 A 1 ATOM 175 O O . PHE A 0 24 . 0.633 4.414 -10.718 1.00 90.63 24 A 1 ATOM 176 C CG . PHE A 0 24 . 1.343 2.596 -8.086 1.00 90.63 24 A 1 ATOM 177 C CD1 . PHE A 0 24 . 1.301 1.468 -8.921 1.00 90.63 24 A 1 ATOM 178 C CD2 . PHE A 0 24 . 2.573 3.222 -7.830 1.00 90.63 24 A 1 ATOM 179 C CE1 . PHE A 0 24 . 2.485 0.933 -9.437 1.00 90.63 24 A 1 ATOM 180 C CE2 . PHE A 0 24 . 3.764 2.683 -8.354 1.00 90.63 24 A 1 ATOM 181 C CZ . PHE A 0 24 . 3.725 1.516 -9.127 1.00 90.63 24 A 1 ATOM 182 N N . MET A 0 25 . -1.282 3.276 -10.486 1.00 89.50 25 A 1 ATOM 183 C CA . MET A 0 25 . -1.317 2.858 -11.892 1.00 89.50 25 A 1 ATOM 184 C C . MET A 0 25 . -1.418 4.057 -12.838 1.00 89.50 25 A 1 ATOM 185 C CB . MET A 0 25 . -2.473 1.878 -12.133 1.00 89.50 25 A 1 ATOM 186 O O . MET A 0 25 . -0.724 4.092 -13.849 1.00 89.50 25 A 1 ATOM 187 C CG . MET A 0 25 . -2.218 0.510 -11.485 1.00 89.50 25 A 1 ATOM 188 S SD . MET A 0 25 . -0.714 -0.368 -12.006 1.00 89.50 25 A 1 ATOM 189 C CE . MET A 0 25 . -1.066 -0.610 -13.768 1.00 89.50 25 A 1 ATOM 190 N N . ASN A 0 26 . -2.209 5.073 -12.484 1.00 91.84 26 A 1 ATOM 191 C CA . ASN A 0 26 . -2.257 6.318 -13.248 1.00 91.84 26 A 1 ATOM 192 C C . ASN A 0 26 . -0.892 7.027 -13.267 1.00 91.84 26 A 1 ATOM 193 C CB . ASN A 0 26 . -3.355 7.210 -12.653 1.00 91.84 26 A 1 ATOM 194 O O . ASN A 0 26 . -0.442 7.481 -14.314 1.00 91.84 26 A 1 ATOM 195 C CG . ASN A 0 26 . -3.590 8.446 -13.502 1.00 91.84 26 A 1 ATOM 196 N ND2 . ASN A 0 26 . -3.727 9.602 -12.897 1.00 91.84 26 A 1 ATOM 197 O OD1 . ASN A 0 26 . -3.684 8.392 -14.712 1.00 91.84 26 A 1 ATOM 198 N N . HIS A 0 27 . -0.201 7.077 -12.124 1.00 90.89 27 A 1 ATOM 199 C CA . HIS A 0 27 . 1.134 7.666 -12.036 1.00 90.89 27 A 1 ATOM 200 C C . HIS A 0 27 . 2.164 6.904 -12.886 1.00 90.89 27 A 1 ATOM 201 C CB . HIS A 0 27 . 1.542 7.753 -10.562 1.00 90.89 27 A 1 ATOM 202 O O . HIS A 0 27 . 2.946 7.524 -13.599 1.00 90.89 27 A 1 ATOM 203 C CG . HIS A 0 27 . 2.856 8.454 -10.363 1.00 90.89 27 A 1 ATOM 204 C CD2 . HIS A 0 27 . 4.011 7.883 -9.908 1.00 90.89 27 A 1 ATOM 205 N ND1 . HIS A 0 27 . 3.133 9.780 -10.617 1.00 90.89 27 A 1 ATOM 206 C CE1 . HIS A 0 27 . 4.426 9.999 -10.319 1.00 90.89 27 A 1 ATOM 207 N NE2 . HIS A 0 27 . 5.002 8.863 -9.896 1.00 90.89 27 A 1 ATOM 208 N N . VAL A 0 28 . 2.117 5.569 -12.904 1.00 88.81 28 A 1 ATOM 209 C CA . VAL A 0 28 . 2.953 4.745 -13.792 1.00 88.81 28 A 1 ATOM 210 C C . VAL A 0 28 . 2.731 5.088 -15.267 1.00 88.81 28 A 1 ATOM 211 C CB . VAL A 0 28 . 2.699 3.248 -13.531 1.00 88.81 28 A 1 ATOM 212 O O . VAL A 0 28 . 3.704 5.217 -16.008 1.00 88.81 28 A 1 ATOM 213 C CG1 . VAL A 0 28 . 3.233 2.343 -14.647 1.00 88.81 28 A 1 ATOM 214 C CG2 . VAL A 0 28 . 3.372 2.821 -12.224 1.00 88.81 28 A 1 ATOM 215 N N . GLU A 0 29 . 1.482 5.250 -15.707 1.00 89.78 29 A 1 ATOM 216 C CA . GLU A 0 29 . 1.186 5.613 -17.099 1.00 89.78 29 A 1 ATOM 217 C C . GLU A 0 29 . 1.680 7.025 -17.450 1.00 89.78 29 A 1 ATOM 218 C CB . GLU A 0 29 . -0.315 5.454 -17.395 1.00 89.78 29 A 1 ATOM 219 O O . GLU A 0 29 . 2.237 7.221 -18.531 1.00 89.78 29 A 1 ATOM 220 C CG . GLU A 0 29 . -0.812 3.997 -17.335 1.00 89.78 29 A 1 ATOM 221 C CD . GLU A 0 29 . 0.007 3.034 -18.211 1.00 89.78 29 A 1 ATOM 222 O OE1 . GLU A 0 29 . 0.501 1.995 -17.698 1.00 89.78 29 A 1 ATOM 223 O OE2 . GLU A 0 29 . 0.212 3.323 -19.407 1.00 89.78 29 A 1 ATOM 224 N N . LEU A 0 30 . 1.571 7.987 -16.525 1.00 90.69 30 A 1 ATOM 225 C CA . LEU A 0 30 . 2.160 9.321 -16.696 1.00 90.69 30 A 1 ATOM 226 C C . LEU A 0 30 . 3.684 9.248 -16.858 1.00 90.69 30 A 1 ATOM 227 C CB . LEU A 0 30 . 1.789 10.229 -15.509 1.00 90.69 30 A 1 ATOM 228 O O . LEU A 0 30 . 4.229 9.831 -17.793 1.00 90.69 30 A 1 ATOM 229 C CG . LEU A 0 30 . 0.306 10.630 -15.432 1.00 90.69 30 A 1 ATOM 230 C CD1 . LEU A 0 30 . 0.058 11.405 -14.135 1.00 90.69 30 A 1 ATOM 231 C CD2 . LEU A 0 30 . -0.119 11.516 -16.605 1.00 90.69 30 A 1 ATOM 232 N N . MET A 0 31 . 4.365 8.473 -16.011 1.00 86.66 31 A 1 ATOM 233 C CA . MET A 0 31 . 5.822 8.325 -16.081 1.00 86.66 31 A 1 ATOM 234 C C . MET A 0 31 . 6.276 7.619 -17.366 1.00 86.66 31 A 1 ATOM 235 C CB . MET A 0 31 . 6.335 7.579 -14.841 1.00 86.66 31 A 1 ATOM 236 O O . MET A 0 31 . 7.292 7.994 -17.946 1.00 86.66 31 A 1 ATOM 237 C CG . MET A 0 31 . 6.142 8.382 -13.546 1.00 86.66 31 A 1 ATOM 238 S SD . MET A 0 31 . 6.982 9.978 -13.447 1.00 86.66 31 A 1 ATOM 239 C CE . MET A 0 31 . 8.693 9.434 -13.292 1.00 86.66 31 A 1 ATOM 240 N N . LYS A 0 32 . 5.522 6.631 -17.867 1.00 86.63 32 A 1 ATOM 241 C CA . LYS A 0 32 . 5.795 6.011 -19.179 1.00 86.63 32 A 1 ATOM 242 C C . LYS A 0 32 . 5.669 7.011 -20.328 1.00 86.63 32 A 1 ATOM 243 C CB . LYS A 0 32 . 4.817 4.865 -19.441 1.00 86.63 32 A 1 ATOM 244 O O . LYS A 0 32 . 6.439 6.934 -21.281 1.00 86.63 32 A 1 ATOM 245 C CG . LYS A 0 32 . 5.106 3.597 -18.632 1.00 86.63 32 A 1 ATOM 246 C CD . LYS A 0 32 . 3.956 2.631 -18.917 1.00 86.63 32 A 1 ATOM 247 C CE . LYS A 0 32 . 4.049 1.346 -18.108 1.00 86.63 32 A 1 ATOM 248 N NZ . LYS A 0 32 . 2.767 0.619 -18.251 1.00 86.63 32 A 1 ATOM 249 N N . ALA A 0 33 . 4.697 7.921 -20.253 1.00 89.69 33 A 1 ATOM 250 C CA . ALA A 0 33 . 4.513 8.963 -21.257 1.00 89.69 33 A 1 ATOM 251 C C . ALA A 0 33 . 5.640 10.009 -21.213 1.00 89.69 33 A 1 ATOM 252 C CB . ALA A 0 33 . 3.132 9.597 -21.060 1.00 89.69 33 A 1 ATOM 253 O O . ALA A 0 33 . 6.074 10.477 -22.264 1.00 89.69 33 A 1 ATOM 254 N N . GLU A 0 34 . 6.129 10.348 -20.017 1.00 89.44 34 A 1 ATOM 255 C CA . GLU A 0 34 . 7.243 11.284 -19.826 1.00 89.44 34 A 1 ATOM 256 C C . GLU A 0 34 . 8.594 10.688 -20.258 1.00 89.44 34 A 1 ATOM 257 C CB . GLU A 0 34 . 7.252 11.737 -18.357 1.00 89.44 34 A 1 ATOM 258 O O . GLU A 0 34 . 9.417 11.382 -20.857 1.00 89.44 34 A 1 ATOM 259 C CG . GLU A 0 34 . 8.238 12.891 -18.114 1.00 89.44 34 A 1 ATOM 260 C CD . GLU A 0 34 . 8.144 13.505 -16.707 1.00 89.44 34 A 1 ATOM 261 O OE1 . GLU A 0 34 . 8.919 14.458 -16.456 1.00 89.44 34 A 1 ATOM 262 O OE2 . GLU A 0 34 . 7.291 13.058 -15.908 1.00 89.44 34 A 1 ATOM 263 N N . TYR A 0 35 . 8.802 9.387 -20.030 1.00 87.10 35 A 1 ATOM 264 C CA . TYR A 0 35 . 10.050 8.684 -20.339 1.00 87.10 35 A 1 ATOM 265 C C . TYR A 0 35 . 9.834 7.489 -21.286 1.00 87.10 35 A 1 ATOM 266 C CB . TYR A 0 35 . 10.738 8.273 -19.035 1.00 87.10 35 A 1 ATOM 267 O O . TYR A 0 35 . 10.050 6.338 -20.897 1.00 87.10 35 A 1 ATOM 268 C CG . TYR A 0 35 . 11.014 9.414 -18.079 1.00 87.10 35 A 1 ATOM 269 C CD1 . TYR A 0 35 . 12.094 10.287 -18.311 1.00 87.10 35 A 1 ATOM 270 C CD2 . TYR A 0 35 . 10.163 9.621 -16.979 1.00 87.10 35 A 1 ATOM 271 C CE1 . TYR A 0 35 . 12.325 11.368 -17.438 1.00 87.10 35 A 1 ATOM 272 C CE2 . TYR A 0 35 . 10.394 10.697 -16.105 1.00 87.10 35 A 1 ATOM 273 O OH . TYR A 0 35 . 11.689 12.595 -15.470 1.00 87.10 35 A 1 ATOM 274 C CZ . TYR A 0 35 . 11.477 11.565 -16.326 1.00 87.10 35 A 1 ATOM 275 N N . PRO A 0 36 . 9.464 7.720 -22.561 1.00 84.87 36 A 1 ATOM 276 C CA . PRO A 0 36 . 9.078 6.651 -23.488 1.00 84.87 36 A 1 ATOM 277 C C . PRO A 0 36 . 10.221 5.687 -23.842 1.00 84.87 36 A 1 ATOM 278 C CB . PRO A 0 36 . 8.556 7.383 -24.730 1.00 84.87 36 A 1 ATOM 279 O O . PRO A 0 36 . 9.973 4.566 -24.285 1.00 84.87 36 A 1 ATOM 280 C CG . PRO A 0 36 . 9.287 8.726 -24.697 1.00 84.87 36 A 1 ATOM 281 C CD . PRO A 0 36 . 9.360 9.022 -23.203 1.00 84.87 36 A 1 ATOM 282 N N . THR A 0 37 . 11.475 6.107 -23.653 1.00 83.16 37 A 1 ATOM 283 C CA . THR A 0 37 . 12.673 5.280 -23.872 1.00 83.16 37 A 1 ATOM 284 C C . THR A 0 37 . 12.963 4.325 -22.714 1.00 83.16 37 A 1 ATOM 285 C CB . THR A 0 37 . 13.904 6.166 -24.108 1.00 83.16 37 A 1 ATOM 286 O O . THR A 0 37 . 13.810 3.442 -22.845 1.00 83.16 37 A 1 ATOM 287 C CG2 . THR A 0 37 . 13.771 7.011 -25.376 1.00 83.16 37 A 1 ATOM 288 O OG1 . THR A 0 37 . 14.070 7.064 -23.032 1.00 83.16 37 A 1 ATOM 289 N N . ILE A 0 38 . 12.277 4.480 -21.578 1.00 80.60 38 A 1 ATOM 290 C CA . ILE A 0 38 . 12.478 3.660 -20.388 1.00 80.60 38 A 1 ATOM 291 C C . ILE A 0 38 . 11.418 2.559 -20.352 1.00 80.60 38 A 1 ATOM 292 C CB . ILE A 0 38 . 12.494 4.524 -19.114 1.00 80.60 38 A 1 ATOM 293 O O . ILE A 0 38 . 10.234 2.785 -20.103 1.00 80.60 38 A 1 ATOM 294 C CG1 . ILE A 0 38 . 13.566 5.631 -19.221 1.00 80.60 38 A 1 ATOM 295 C CG2 . ILE A 0 38 . 12.802 3.641 -17.895 1.00 80.60 38 A 1 ATOM 296 C CD1 . ILE A 0 38 . 13.671 6.461 -17.945 1.00 80.60 38 A 1 ATOM 297 N N . HIS A 0 39 . 11.860 1.322 -20.561 1.00 82.60 39 A 1 ATOM 298 C CA . HIS A 0 39 . 10.986 0.153 -20.565 1.00 82.60 39 A 1 ATOM 299 C C . HIS A 0 39 . 10.882 -0.480 -19.175 1.00 82.60 39 A 1 ATOM 300 C CB . HIS A 0 39 . 11.441 -0.821 -21.653 1.00 82.60 39 A 1 ATOM 301 O O . HIS A 0 39 . 11.530 -1.481 -18.868 1.00 82.60 39 A 1 ATOM 302 C CG . HIS A 0 39 . 11.355 -0.224 -23.034 1.00 82.60 39 A 1 ATOM 303 C CD2 . HIS A 0 39 . 12.351 -0.194 -23.971 1.00 82.60 39 A 1 ATOM 304 N ND1 . HIS A 0 39 . 10.274 0.440 -23.573 1.00 82.60 39 A 1 ATOM 305 C CE1 . HIS A 0 39 . 10.614 0.858 -24.802 1.00 82.60 39 A 1 ATOM 306 N NE2 . HIS A 0 39 . 11.864 0.473 -25.097 1.00 82.60 39 A 1 ATOM 307 N N . LEU A 0 40 . 10.029 0.094 -18.328 1.00 81.84 40 A 1 ATOM 308 C CA . LEU A 0 40 . 9.697 -0.488 -17.029 1.00 81.84 40 A 1 ATOM 309 C C . LEU A 0 40 . 8.636 -1.585 -17.177 1.00 81.84 40 A 1 ATOM 310 C CB . LEU A 0 40 . 9.225 0.606 -16.072 1.00 81.84 40 A 1 ATOM 311 O O . LEU A 0 40 . 7.525 -1.351 -17.660 1.00 81.84 40 A 1 ATOM 312 C CG . LEU A 0 40 . 10.308 1.622 -15.698 1.00 81.84 40 A 1 ATOM 313 C CD1 . LEU A 0 40 . 9.681 2.849 -15.057 1.00 81.84 40 A 1 ATOM 314 C CD2 . LEU A 0 40 . 11.332 1.045 -14.719 1.00 81.84 40 A 1 ATOM 315 N N . ASN A 0 41 . 8.965 -2.793 -16.718 1.00 84.63 41 A 1 ATOM 316 C CA . ASN A 0 41 . 8.030 -3.912 -16.700 1.00 84.63 41 A 1 ATOM 317 C C . ASN A 0 41 . 7.217 -3.925 -15.397 1.00 84.63 41 A 1 ATOM 318 C CB . ASN A 0 41 . 8.792 -5.224 -16.939 1.00 84.63 41 A 1 ATOM 319 O O . ASN A 0 41 . 7.720 -4.315 -14.344 1.00 84.63 41 A 1 ATOM 320 C CG . ASN A 0 41 . 7.866 -6.423 -17.065 1.00 84.63 41 A 1 ATOM 321 N ND2 . ASN A 0 41 . 8.411 -7.580 -17.353 1.00 84.63 41 A 1 ATOM 322 O OD1 . ASN A 0 41 . 6.651 -6.350 -16.925 1.00 84.63 41 A 1 ATOM 323 N N . PHE A 0 42 . 5.937 -3.564 -15.493 1.00 85.67 42 A 1 ATOM 324 C CA . PHE A 0 42 . 4.984 -3.598 -14.377 1.00 85.67 42 A 1 ATOM 325 C C . PHE A 0 42 . 4.017 -4.780 -14.426 1.00 85.67 42 A 1 ATOM 326 C CB . PHE A 0 42 . 4.231 -2.269 -14.290 1.00 85.67 42 A 1 ATOM 327 O O . PHE A 0 42 . 3.034 -4.784 -13.696 1.00 85.67 42 A 1 ATOM 328 C CG . PHE A 0 42 . 5.148 -1.113 -14.003 1.00 85.67 42 A 1 ATOM 329 C CD1 . PHE A 0 42 . 5.712 -0.974 -12.721 1.00 85.67 42 A 1 ATOM 330 C CD2 . PHE A 0 42 . 5.460 -0.200 -15.022 1.00 85.67 42 A 1 ATOM 331 C CE1 . PHE A 0 42 . 6.597 0.080 -12.458 1.00 85.67 42 A 1 ATOM 332 C CE2 . PHE A 0 42 . 6.314 0.874 -14.749 1.00 85.67 42 A 1 ATOM 333 C CZ . PHE A 0 42 . 6.898 0.989 -13.481 1.00 85.67 42 A 1 ATOM 334 N N . THR A 0 43 . 4.264 -5.791 -15.263 1.00 88.40 43 A 1 ATOM 335 C CA . THR A 0 43 . 3.318 -6.905 -15.458 1.00 88.40 43 A 1 ATOM 336 C C . THR A 0 43 . 2.989 -7.604 -14.140 1.00 88.40 43 A 1 ATOM 337 C CB . THR A 0 43 . 3.865 -7.928 -16.461 1.00 88.40 43 A 1 ATOM 338 O O . THR A 0 43 . 1.820 -7.762 -13.809 1.00 88.40 43 A 1 ATOM 339 C CG2 . THR A 0 43 . 2.853 -9.023 -16.792 1.00 88.40 43 A 1 ATOM 340 O OG1 . THR A 0 43 . 4.192 -7.282 -17.667 1.00 88.40 43 A 1 ATOM 341 N N . GLN A 0 44 . 4.007 -7.954 -13.347 1.00 88.74 44 A 1 ATOM 342 C CA . GLN A 0 44 . 3.813 -8.610 -12.047 1.00 88.74 44 A 1 ATOM 343 C C . GLN A 0 44 . 3.038 -7.731 -11.061 1.00 88.74 44 A 1 ATOM 344 C CB . GLN A 0 44 . 5.178 -8.957 -11.438 1.00 88.74 44 A 1 ATOM 345 O O . GLN A 0 44 . 2.170 -8.218 -10.340 1.00 88.74 44 A 1 ATOM 346 C CG . GLN A 0 44 . 5.898 -10.084 -12.191 1.00 88.74 44 A 1 ATOM 347 C CD . GLN A 0 44 . 7.260 -10.409 -11.584 1.00 88.74 44 A 1 ATOM 348 N NE2 . GLN A 0 44 . 7.889 -11.486 -11.998 1.00 88.74 44 A 1 ATOM 349 O OE1 . GLN A 0 44 . 7.799 -9.702 -10.752 1.00 88.74 44 A 1 ATOM 350 N N . LEU A 0 45 . 3.334 -6.430 -11.052 1.00 87.90 45 A 1 ATOM 351 C CA . LEU A 0 45 . 2.669 -5.475 -10.177 1.00 87.90 45 A 1 ATOM 352 C C . LEU A 0 45 . 1.201 -5.296 -10.566 1.00 87.90 45 A 1 ATOM 353 C CB . LEU A 0 45 . 3.455 -4.160 -10.228 1.00 87.90 45 A 1 ATOM 354 O O . LEU A 0 45 . 0.334 -5.336 -9.701 1.00 87.90 45 A 1 ATOM 355 C CG . LEU A 0 45 . 2.969 -3.090 -9.237 1.00 87.90 45 A 1 ATOM 356 C CD1 . LEU A 0 45 . 2.987 -3.575 -7.787 1.00 87.90 45 A 1 ATOM 357 C CD2 . LEU A 0 45 . 3.942 -1.924 -9.336 1.00 87.90 45 A 1 ATOM 358 N N . ASN A 0 46 . 0.921 -5.191 -11.865 1.00 88.77 46 A 1 ATOM 359 C CA . ASN A 0 46 . -0.431 -5.105 -12.401 1.00 88.77 46 A 1 ATOM 360 C C . ASN A 0 46 . -1.241 -6.373 -12.088 1.00 88.77 46 A 1 ATOM 361 C CB . ASN A 0 46 . -0.332 -4.846 -13.912 1.00 88.77 46 A 1 ATOM 362 O O . ASN A 0 46 . -2.388 -6.276 -11.664 1.00 88.77 46 A 1 ATOM 363 C CG . ASN A 0 46 . -1.678 -4.500 -14.520 1.00 88.77 46 A 1 ATOM 364 N ND2 . ASN A 0 46 . -1.971 -4.978 -15.706 1.00 88.77 46 A 1 ATOM 365 O OD1 . ASN A 0 46 . -2.481 -3.781 -13.960 1.00 88.77 46 A 1 ATOM 366 N N . THR A 0 47 . -0.647 -7.563 -12.234 1.00 92.85 47 A 1 ATOM 367 C CA . THR A 0 47 . -1.293 -8.824 -11.837 1.00 92.85 47 A 1 ATOM 368 C C . THR A 0 47 . -1.649 -8.816 -10.352 1.00 92.85 47 A 1 ATOM 369 C CB . THR A 0 47 . -0.409 -10.035 -12.161 1.00 92.85 47 A 1 ATOM 370 O O . THR A 0 47 . -2.808 -9.029 -10.008 1.00 92.85 47 A 1 ATOM 371 C CG2 . THR A 0 47 . -1.058 -11.365 -11.787 1.00 92.85 47 A 1 ATOM 372 O OG1 . THR A 0 47 . -0.179 -10.095 -13.549 1.00 92.85 47 A 1 ATOM 373 N N . CYS A 0 48 . -0.688 -8.482 -9.486 1.00 92.81 48 A 1 ATOM 374 C CA . CYS A 0 48 . -0.916 -8.383 -8.044 1.00 92.81 48 A 1 ATOM 375 C C . CYS A 0 48 . -2.031 -7.379 -7.715 1.00 92.81 48 A 1 ATOM 376 C CB . CYS A 0 48 . 0.418 -7.995 -7.390 1.00 92.81 48 A 1 ATOM 377 O O . CYS A 0 48 . -2.938 -7.680 -6.945 1.00 92.81 48 A 1 ATOM 378 S SG . CYS A 0 48 . 0.236 -7.860 -5.588 1.00 92.81 48 A 1 ATOM 379 N N . PHE A 0 49 . -2.013 -6.198 -8.335 1.00 93.00 49 A 1 ATOM 380 C CA . PHE A 0 49 . -3.015 -5.164 -8.086 1.00 93.00 49 A 1 ATOM 381 C C . PHE A 0 49 . -4.407 -5.596 -8.532 1.00 93.00 49 A 1 ATOM 382 C CB . PHE A 0 49 . -2.590 -3.858 -8.764 1.00 93.00 49 A 1 ATOM 383 O O . PHE A 0 49 . -5.362 -5.366 -7.798 1.00 93.00 49 A 1 ATOM 384 C CG . PHE A 0 49 . -1.605 -3.009 -7.979 1.00 93.00 49 A 1 ATOM 385 C CD1 . PHE A 0 49 . -0.774 -3.550 -6.972 1.00 93.00 49 A 1 ATOM 386 C CD2 . PHE A 0 49 . -1.569 -1.627 -8.228 1.00 93.00 49 A 1 ATOM 387 C CE1 . PHE A 0 49 . 0.072 -2.717 -6.224 1.00 93.00 49 A 1 ATOM 388 C CE2 . PHE A 0 49 . -0.734 -0.796 -7.466 1.00 93.00 49 A 1 ATOM 389 C CZ . PHE A 0 49 . 0.098 -1.336 -6.474 1.00 93.00 49 A 1 ATOM 390 N N . ASN A 0 50 . -4.534 -6.269 -9.674 1.00 92.67 50 A 1 ATOM 391 C CA . ASN A 0 50 . -5.821 -6.788 -10.132 1.00 92.67 50 A 1 ATOM 392 C C . ASN A 0 50 . -6.368 -7.869 -9.188 1.00 92.67 50 A 1 ATOM 393 C CB . ASN A 0 50 . -5.674 -7.290 -11.575 1.00 92.67 50 A 1 ATOM 394 O O . ASN A 0 50 . -7.543 -7.824 -8.833 1.00 92.67 50 A 1 ATOM 395 C CG . ASN A 0 50 . -5.506 -6.144 -12.557 1.00 92.67 50 A 1 ATOM 396 N ND2 . ASN A 0 50 . -4.701 -6.308 -13.577 1.00 92.67 50 A 1 ATOM 397 O OD1 . ASN A 0 50 . -6.097 -5.085 -12.432 1.00 92.67 50 A 1 ATOM 398 N N . GLU A 0 51 . -5.523 -8.793 -8.723 1.00 94.32 51 A 1 ATOM 399 C CA . GLU A 0 51 . -5.920 -9.817 -7.745 1.00 94.32 51 A 1 ATOM 400 C C . GLU A 0 51 . -6.379 -9.194 -6.418 1.00 94.32 51 A 1 ATOM 401 C CB . GLU A 0 51 . -4.743 -10.769 -7.485 1.00 94.32 51 A 1 ATOM 402 O O . GLU A 0 51 . -7.425 -9.557 -5.874 1.00 94.32 51 A 1 ATOM 403 C CG . GLU A 0 51 . -4.456 -11.707 -8.668 1.00 94.32 51 A 1 ATOM 404 C CD . GLU A 0 51 . -3.191 -12.560 -8.467 1.00 94.32 51 A 1 ATOM 405 O OE1 . GLU A 0 51 . -2.843 -13.296 -9.418 1.00 94.32 51 A 1 ATOM 406 O OE2 . GLU A 0 51 . -2.574 -12.483 -7.378 1.00 94.32 51 A 1 ATOM 407 N N . GLN A 0 52 . -5.628 -8.217 -5.905 1.00 95.23 52 A 1 ATOM 408 C CA . GLN A 0 52 . -5.970 -7.535 -4.657 1.00 95.23 52 A 1 ATOM 409 C C . GLN A 0 52 . -7.198 -6.626 -4.808 1.00 95.23 52 A 1 ATOM 410 C CB . GLN A 0 52 . -4.763 -6.736 -4.147 1.00 95.23 52 A 1 ATOM 411 O O . GLN A 0 52 . -8.008 -6.529 -3.884 1.00 95.23 52 A 1 ATOM 412 C CG . GLN A 0 52 . -3.557 -7.598 -3.747 1.00 95.23 52 A 1 ATOM 413 C CD . GLN A 0 52 . -3.886 -8.597 -2.649 1.00 95.23 52 A 1 ATOM 414 N NE2 . GLN A 0 52 . -3.498 -9.844 -2.803 1.00 95.23 52 A 1 ATOM 415 O OE1 . GLN A 0 52 . -4.504 -8.286 -1.643 1.00 95.23 52 A 1 ATOM 416 N N . ALA A 0 53 . -7.382 -5.988 -5.966 1.00 95.62 53 A 1 ATOM 417 C CA . ALA A 0 53 . -8.532 -5.131 -6.231 1.00 95.62 53 A 1 ATOM 418 C C . ALA A 0 53 . -9.850 -5.905 -6.111 1.00 95.62 53 A 1 ATOM 419 C CB . ALA A 0 53 . -8.389 -4.485 -7.614 1.00 95.62 53 A 1 ATOM 420 O O . ALA A 0 53 . -10.800 -5.384 -5.532 1.00 95.62 53 A 1 ATOM 421 N N . GLU A 0 54 . -9.913 -7.155 -6.577 1.00 95.80 54 A 1 ATOM 422 C CA . GLU A 0 54 . -11.108 -7.993 -6.407 1.00 95.80 54 A 1 ATOM 423 C C . GLU A 0 54 . -11.401 -8.292 -4.930 1.00 95.80 54 A 1 ATOM 424 C CB . GLU A 0 54 . -10.968 -9.291 -7.220 1.00 95.80 54 A 1 ATOM 425 O O . GLU A 0 54 . -12.550 -8.203 -4.488 1.00 95.80 54 A 1 ATOM 426 C CG . GLU A 0 54 . -10.950 -9.050 -8.740 1.00 95.80 54 A 1 ATOM 427 C CD . GLU A 0 54 . -12.132 -8.185 -9.204 1.00 95.80 54 A 1 ATOM 428 O OE1 . GLU A 0 54 . -11.900 -7.102 -9.803 1.00 95.80 54 A 1 ATOM 429 O OE2 . GLU A 0 54 . -13.285 -8.535 -8.879 1.00 95.80 54 A 1 ATOM 430 N N . HIS A 0 55 . -10.364 -8.553 -4.129 1.00 96.38 55 A 1 ATOM 431 C CA . HIS A 0 55 . -10.516 -8.740 -2.686 1.00 96.38 55 A 1 ATOM 432 C C . HIS A 0 55 . -11.060 -7.478 -1.996 1.00 96.38 55 A 1 ATOM 433 C CB . HIS A 0 55 . -9.175 -9.184 -2.089 1.00 96.38 55 A 1 ATOM 434 O O . HIS A 0 55 . -11.996 -7.562 -1.196 1.00 96.38 55 A 1 ATOM 435 C CG . HIS A 0 55 . -9.223 -9.325 -0.592 1.00 96.38 55 A 1 ATOM 436 C CD2 . HIS A 0 55 . -9.686 -10.398 0.119 1.00 96.38 55 A 1 ATOM 437 N ND1 . HIS A 0 55 . -8.809 -8.380 0.316 1.00 96.38 55 A 1 ATOM 438 C CE1 . HIS A 0 55 . -9.001 -8.883 1.546 1.00 96.38 55 A 1 ATOM 439 N NE2 . HIS A 0 55 . -9.549 -10.107 1.481 1.00 96.38 55 A 1 ATOM 440 N N . TYR A 0 56 . -10.529 -6.298 -2.326 1.00 96.66 56 A 1 ATOM 441 C CA . TYR A 0 56 . -10.997 -5.043 -1.735 1.00 96.66 56 A 1 ATOM 442 C C . TYR A 0 56 . -12.380 -4.623 -2.237 1.00 96.66 56 A 1 ATOM 443 C CB . TYR A 0 56 . -9.960 -3.938 -1.936 1.00 96.66 56 A 1 ATOM 444 O O . TYR A 0 56 . -13.186 -4.154 -1.438 1.00 96.66 56 A 1 ATOM 445 C CG . TYR A 0 56 . -8.702 -4.141 -1.117 1.00 96.66 56 A 1 ATOM 446 C CD1 . TYR A 0 56 . -8.777 -4.164 0.291 1.00 96.66 56 A 1 ATOM 447 C CD2 . TYR A 0 56 . -7.457 -4.301 -1.755 1.00 96.66 56 A 1 ATOM 448 C CE1 . TYR A 0 56 . -7.609 -4.320 1.060 1.00 96.66 56 A 1 ATOM 449 C CE2 . TYR A 0 56 . -6.292 -4.479 -0.985 1.00 96.66 56 A 1 ATOM 450 O OH . TYR A 0 56 . -5.224 -4.585 1.149 1.00 96.66 56 A 1 ATOM 451 C CZ . TYR A 0 56 . -6.362 -4.465 0.419 1.00 96.66 56 A 1 ATOM 452 N N . LYS A 0 57 . -12.722 -4.860 -3.509 1.00 97.03 57 A 1 ATOM 453 C CA . LYS A 0 57 . -14.091 -4.656 -4.018 1.00 97.03 57 A 1 ATOM 454 C C . LYS A 0 57 . -15.096 -5.494 -3.237 1.00 97.03 57 A 1 ATOM 455 C CB . LYS A 0 57 . -14.173 -5.035 -5.499 1.00 97.03 57 A 1 ATOM 456 O O . LYS A 0 57 . -16.122 -4.969 -2.806 1.00 97.03 57 A 1 ATOM 457 C CG . LYS A 0 57 . -13.555 -3.984 -6.429 1.00 97.03 57 A 1 ATOM 458 C CD . LYS A 0 57 . -13.471 -4.587 -7.833 1.00 97.03 57 A 1 ATOM 459 C CE . LYS A 0 57 . -12.645 -3.731 -8.788 1.00 97.03 57 A 1 ATOM 460 N NZ . LYS A 0 57 . -12.445 -4.473 -10.055 1.00 97.03 57 A 1 ATOM 461 N N . LYS A 0 58 . -14.777 -6.770 -2.998 1.00 96.80 58 A 1 ATOM 462 C CA . LYS A 0 58 . -15.610 -7.643 -2.169 1.00 96.80 58 A 1 ATOM 463 C C . LYS A 0 58 . -15.713 -7.119 -0.737 1.00 96.80 58 A 1 ATOM 464 C CB . LYS A 0 58 . -15.075 -9.076 -2.225 1.00 96.80 58 A 1 ATOM 465 O O . LYS A 0 58 . -16.818 -6.971 -0.233 1.00 96.80 58 A 1 ATOM 466 C CG . LYS A 0 58 . -16.033 -10.002 -1.471 1.00 96.80 58 A 1 ATOM 467 C CD . LYS A 0 58 . -15.541 -11.444 -1.477 1.00 96.80 58 A 1 ATOM 468 C CE . LYS A 0 58 . -16.540 -12.246 -0.644 1.00 96.80 58 A 1 ATOM 469 N NZ . LYS A 0 58 . -16.098 -13.648 -0.483 1.00 96.80 58 A 1 ATOM 470 N N . MET A 0 59 . -14.591 -6.766 -0.107 1.00 96.39 59 A 1 ATOM 471 C CA . MET A 0 59 . -14.587 -6.211 1.251 1.00 96.39 59 A 1 ATOM 472 C C . MET A 0 59 . -15.453 -4.950 1.367 1.00 96.39 59 A 1 ATOM 473 C CB . MET A 0 59 . -13.144 -5.921 1.680 1.00 96.39 59 A 1 ATOM 474 O O . MET A 0 59 . -16.220 -4.842 2.322 1.00 96.39 59 A 1 ATOM 475 C CG . MET A 0 59 . -13.058 -5.387 3.118 1.00 96.39 59 A 1 ATOM 476 S SD . MET A 0 59 . -11.377 -5.019 3.695 1.00 96.39 59 A 1 ATOM 477 C CE . MET A 0 59 . -10.660 -6.679 3.702 1.00 96.39 59 A 1 ATOM 478 N N . LYS A 0 60 . -15.357 -4.033 0.396 1.00 94.94 60 A 1 ATOM 479 C CA . LYS A 0 60 . -16.175 -2.816 0.320 1.00 94.94 60 A 1 ATOM 480 C C . LYS A 0 60 . -17.661 -3.139 0.167 1.00 94.94 60 A 1 ATOM 481 C CB . LYS A 0 60 . -15.680 -1.951 -0.850 1.00 94.94 60 A 1 ATOM 482 O O . LYS A 0 60 . -18.486 -2.483 0.788 1.00 94.94 60 A 1 ATOM 483 C CG . LYS A 0 60 . -16.422 -0.611 -0.906 1.00 94.94 60 A 1 ATOM 484 C CD . LYS A 0 60 . -15.956 0.235 -2.089 1.00 94.94 60 A 1 ATOM 485 C CE . LYS A 0 60 . -16.772 1.533 -2.084 1.00 94.94 60 A 1 ATOM 486 N NZ . LYS A 0 60 . -16.195 2.544 -2.995 1.00 94.94 60 A 1 ATOM 487 N N . SER A 0 61 . -18.001 -4.143 -0.640 1.00 95.50 61 A 1 ATOM 488 C CA . SER A 0 61 . -19.384 -4.606 -0.800 1.00 95.50 61 A 1 ATOM 489 C C . SER A 0 61 . -19.931 -5.241 0.483 1.00 95.50 61 A 1 ATOM 490 C CB . SER A 0 61 . -19.462 -5.607 -1.954 1.00 95.50 61 A 1 ATOM 491 O O . SER A 0 61 . -21.050 -4.935 0.878 1.00 95.50 61 A 1 ATOM 492 O OG . SER A 0 61 . -20.808 -5.924 -2.238 1.00 95.50 61 A 1 ATOM 493 N N . ASP A 0 62 . -19.144 -6.092 1.146 1.00 95.31 62 A 1 ATOM 494 C CA . ASP A 0 62 . -19.524 -6.787 2.386 1.00 95.31 62 A 1 ATOM 495 C C . ASP A 0 62 . -19.673 -5.821 3.582 1.00 95.31 62 A 1 ATOM 496 C CB . ASP A 0 62 . -18.467 -7.867 2.716 1.00 95.31 62 A 1 ATOM 497 O O . ASP A 0 62 . -20.321 -6.151 4.575 1.00 95.31 62 A 1 ATOM 498 C CG . ASP A 0 62 . -18.412 -9.077 1.763 1.00 95.31 62 A 1 ATOM 499 O OD1 . ASP A 0 62 . -19.343 -9.271 0.952 1.00 95.31 62 A 1 ATOM 500 O OD2 . ASP A 0 62 . -17.426 -9.852 1.870 1.00 95.31 62 A 1 ATOM 501 N N . HIS A 0 63 . -19.069 -4.632 3.492 1.00 94.68 63 A 1 ATOM 502 C CA . HIS A 0 63 . -19.114 -3.563 4.495 1.00 94.68 63 A 1 ATOM 503 C C . HIS A 0 63 . -19.569 -2.251 3.845 1.00 94.68 63 A 1 ATOM 504 C CB . HIS A 0 63 . -17.754 -3.427 5.209 1.00 94.68 63 A 1 ATOM 505 O O . HIS A 0 63 . -18.966 -1.198 4.058 1.00 94.68 63 A 1 ATOM 506 C CG . HIS A 0 63 . -17.225 -4.720 5.774 1.00 94.68 63 A 1 ATOM 507 C CD2 . HIS A 0 63 . -17.382 -5.216 7.040 1.00 94.68 63 A 1 ATOM 508 N ND1 . HIS A 0 63 . -16.583 -5.681 5.041 1.00 94.68 63 A 1 ATOM 509 C CE1 . HIS A 0 63 . -16.388 -6.747 5.827 1.00 94.68 63 A 1 ATOM 510 N NE2 . HIS A 0 63 . -16.805 -6.502 7.085 1.00 94.68 63 A 1 ATOM 511 N N . SER A 0 64 . -20.590 -2.320 2.985 1.00 92.67 64 A 1 ATOM 512 C CA . SER A 0 64 . -21.118 -1.134 2.314 1.00 92.67 64 A 1 ATOM 513 C C . SER A 0 64 . -21.621 -0.104 3.329 1.00 92.67 64 A 1 ATOM 514 C CB . SER A 0 64 . -22.222 -1.510 1.317 1.00 92.67 64 A 1 ATOM 515 O O . SER A 0 64 . -21.933 -0.442 4.471 1.00 92.67 64 A 1 ATOM 516 O OG . SER A 0 64 . -23.410 -1.889 1.984 1.00 92.67 64 A 1 ATOM 517 N N . GLU A 0 65 . -21.735 1.159 2.908 1.00 89.04 65 A 1 ATOM 518 C CA . GLU A 0 65 . -22.295 2.219 3.760 1.00 89.04 65 A 1 ATOM 519 C C . GLU A 0 65 . -23.669 1.822 4.315 1.00 89.04 65 A 1 ATOM 520 C CB . GLU A 0 65 . -22.392 3.517 2.942 1.00 89.04 65 A 1 ATOM 521 O O . GLU A 0 65 . -23.911 1.953 5.508 1.00 89.04 65 A 1 ATOM 522 C CG . GLU A 0 65 . -22.976 4.712 3.718 1.00 89.04 65 A 1 ATOM 523 C CD . GLU A 0 65 . -22.158 5.132 4.950 1.00 89.04 65 A 1 ATOM 524 O OE1 . GLU A 0 65 . -22.682 5.891 5.789 1.00 89.04 65 A 1 ATOM 525 O OE2 . GLU A 0 65 . -20.976 4.745 5.026 1.00 89.04 65 A 1 ATOM 526 N N . GLU A 0 66 . -24.531 1.249 3.474 1.00 89.70 66 A 1 ATOM 527 C CA . GLU A 0 66 . -25.857 0.757 3.860 1.00 89.70 66 A 1 ATOM 528 C C . GLU A 0 66 . -25.769 -0.320 4.954 1.00 89.70 66 A 1 ATOM 529 C CB . GLU A 0 66 . -26.544 0.171 2.616 1.00 89.70 66 A 1 ATOM 530 O O . GLU A 0 66 . -26.505 -0.269 5.941 1.00 89.70 66 A 1 ATOM 531 C CG . GLU A 0 66 . -26.809 1.215 1.514 1.00 89.70 66 A 1 ATOM 532 C CD . GLU A 0 66 . -27.206 0.592 0.164 1.00 89.70 66 A 1 ATOM 533 O OE1 . GLU A 0 66 . -27.463 1.380 -0.773 1.00 89.70 66 A 1 ATOM 534 O OE2 . GLU A 0 66 . -27.198 -0.656 0.051 1.00 89.70 66 A 1 ATOM 535 N N . ILE A 0 67 . -24.840 -1.277 4.820 1.00 91.00 67 A 1 ATOM 536 C CA . ILE A 0 67 . -24.615 -2.324 5.825 1.00 91.00 67 A 1 ATOM 537 C C . ILE A 0 67 . -24.104 -1.718 7.131 1.00 91.00 67 A 1 ATOM 538 C CB . ILE A 0 67 . -23.677 -3.429 5.283 1.00 91.00 67 A 1 ATOM 539 O O . ILE A 0 67 . -24.601 -2.077 8.198 1.00 91.00 67 A 1 ATOM 540 C CG1 . ILE A 0 67 . -24.408 -4.235 4.186 1.00 91.00 67 A 1 ATOM 541 C CG2 . ILE A 0 67 . -23.206 -4.379 6.405 1.00 91.00 67 A 1 ATOM 542 C CD1 . ILE A 0 67 . -23.497 -5.200 3.416 1.00 91.00 67 A 1 ATOM 543 N N . CYS A 0 68 . -23.142 -0.799 7.069 1.00 88.95 68 A 1 ATOM 544 C CA . CYS A 0 68 . -22.593 -0.179 8.270 1.00 88.95 68 A 1 ATOM 545 C C . CYS A 0 68 . -23.636 0.688 8.988 1.00 88.95 68 A 1 ATOM 546 C CB . CYS A 0 68 . -21.308 0.585 7.936 1.00 88.95 68 A 1 ATOM 547 O O . CYS A 0 68 . -23.803 0.543 10.196 1.00 88.95 68 A 1 ATOM 548 S SG . CYS A 0 68 . -19.959 -0.409 7.222 1.00 88.95 68 A 1 ATOM 549 N N . GLN A 0 69 . -24.425 1.480 8.255 1.00 84.39 69 A 1 ATOM 550 C CA . GLN A 0 69 . -25.513 2.288 8.815 1.00 84.39 69 A 1 ATOM 551 C C . GLN A 0 69 . -26.576 1.438 9.521 1.00 84.39 69 A 1 ATOM 552 C CB . GLN A 0 69 . -26.180 3.102 7.700 1.00 84.39 69 A 1 ATOM 553 O O . GLN A 0 69 . -27.055 1.820 10.586 1.00 84.39 69 A 1 ATOM 554 C CG . GLN A 0 69 . -25.332 4.297 7.243 1.00 84.39 69 A 1 ATOM 555 C CD . GLN A 0 69 . -25.990 5.076 6.107 1.00 84.39 69 A 1 ATOM 556 N NE2 . GLN A 0 69 . -25.382 6.146 5.657 1.00 84.39 69 A 1 ATOM 557 O OE1 . GLN A 0 69 . -27.063 4.766 5.611 1.00 84.39 69 A 1 ATOM 558 N N . MET A 0 70 . -26.917 0.256 8.992 1.00 86.03 70 A 1 ATOM 559 C CA . MET A 0 70 . -27.838 -0.671 9.671 1.00 86.03 70 A 1 ATOM 560 C C . MET A 0 70 . -27.296 -1.183 11.017 1.00 86.03 70 A 1 ATOM 561 C CB . MET A 0 70 . -28.153 -1.867 8.760 1.00 86.03 70 A 1 ATOM 562 O O . MET A 0 70 . -28.070 -1.596 11.883 1.00 86.03 70 A 1 ATOM 563 C CG . MET A 0 70 . -29.129 -1.507 7.637 1.00 86.03 70 A 1 ATOM 564 S SD . MET A 0 70 . -29.702 -2.925 6.655 1.00 86.03 70 A 1 ATOM 565 C CE . MET A 0 70 . -28.202 -3.313 5.717 1.00 86.03 70 A 1 ATOM 566 N N . LEU A 0 71 . -25.975 -1.170 11.207 1.00 84.20 71 A 1 ATOM 567 C CA . LEU A 0 71 . -25.307 -1.577 12.446 1.00 84.20 71 A 1 ATOM 568 C C . LEU A 0 71 . -25.141 -0.404 13.430 1.00 84.20 71 A 1 ATOM 569 C CB . LEU A 0 71 . -23.960 -2.237 12.091 1.00 84.20 71 A 1 ATOM 570 O O . LEU A 0 71 . -24.904 -0.632 14.626 1.00 84.20 71 A 1 ATOM 571 C CG . LEU A 0 71 . -24.098 -3.486 11.197 1.00 84.20 71 A 1 ATOM 572 C CD1 . LEU A 0 71 . -22.749 -3.885 10.596 1.00 84.20 71 A 1 ATOM 573 C CD2 . LEU A 0 71 . -24.680 -4.675 11.966 1.00 84.20 71 A 1 ATOM 574 N N . THR A 0 72 . -25.298 0.835 12.959 1.00 77.50 72 A 1 ATOM 575 C CA . THR A 0 72 . -25.310 2.049 13.777 1.00 77.50 72 A 1 ATOM 576 C C . THR A 0 72 . -26.641 2.158 14.523 1.00 77.50 72 A 1 ATOM 577 C CB . THR A 0 72 . -25.061 3.307 12.927 1.00 77.50 72 A 1 ATOM 578 O O . THR A 0 72 . -27.658 2.586 13.990 1.00 77.50 72 A 1 ATOM 579 C CG2 . THR A 0 72 . -24.841 4.531 13.813 1.00 77.50 72 A 1 ATOM 580 O OG1 . THR A 0 72 . -23.915 3.167 12.123 1.00 77.50 72 A 1 ATOM 581 N N . GLN A 0 73 . -26.653 1.762 15.798 1.00 70.92 73 A 1 ATOM 582 C CA . GLN A 0 73 . -27.877 1.811 16.612 1.00 70.92 73 A 1 ATOM 583 C C . GLN A 0 73 . -28.227 3.222 17.106 1.00 70.92 73 A 1 ATOM 584 C CB . GLN A 0 73 . -27.773 0.814 17.774 1.00 70.92 73 A 1 ATOM 585 O O . GLN A 0 73 . -29.384 3.471 17.427 1.00 70.92 73 A 1 ATOM 586 C CG . GLN A 0 73 . -27.838 -0.632 17.258 1.00 70.92 73 A 1 ATOM 587 C CD . GLN A 0 73 . -27.783 -1.678 18.365 1.00 70.92 73 A 1 ATOM 588 N NE2 . GLN A 0 73 . -28.094 -2.916 18.053 1.00 70.92 73 A 1 ATOM 589 O OE1 . GLN A 0 73 . -27.428 -1.428 19.507 1.00 70.92 73 A 1 ATOM 590 N N . TYR A 0 74 . -27.253 4.135 17.168 1.00 67.69 74 A 1 ATOM 591 C CA . TYR A 0 74 . -27.438 5.522 17.601 1.00 67.69 74 A 1 ATOM 592 C C . TYR A 0 74 . -26.349 6.396 16.979 1.00 67.69 74 A 1 ATOM 593 C CB . TYR A 0 74 . -27.347 5.615 19.138 1.00 67.69 74 A 1 ATOM 594 O O . TYR A 0 74 . -25.183 6.017 17.048 1.00 67.69 74 A 1 ATOM 595 C CG . TYR A 0 74 . -28.384 4.790 19.878 1.00 67.69 74 A 1 ATOM 596 C CD1 . TYR A 0 74 . -29.698 5.277 20.012 1.00 67.69 74 A 1 ATOM 597 C CD2 . TYR A 0 74 . -28.061 3.499 20.346 1.00 67.69 74 A 1 ATOM 598 C CE1 . TYR A 0 74 . -30.694 4.470 20.593 1.00 67.69 74 A 1 ATOM 599 C CE2 . TYR A 0 74 . -29.057 2.683 20.917 1.00 67.69 74 A 1 ATOM 600 O OH . TYR A 0 74 . -31.347 2.385 21.576 1.00 67.69 74 A 1 ATOM 601 C CZ . TYR A 0 74 . -30.378 3.169 21.033 1.00 67.69 74 A 1 ATOM 602 N N . ASN A 0 75 . -26.705 7.564 16.441 1.00 67.67 75 A 1 ATOM 603 C CA . ASN A 0 75 . -25.727 8.594 16.084 1.00 67.67 75 A 1 ATOM 604 C C . ASN A 0 75 . -25.300 9.315 17.367 1.00 67.67 75 A 1 ATOM 605 C CB . ASN A 0 75 . -26.327 9.573 15.055 1.00 67.67 75 A 1 ATOM 606 O O . ASN A 0 75 . -26.095 10.046 17.958 1.00 67.67 75 A 1 ATOM 607 C CG . ASN A 0 75 . -26.482 8.979 13.667 1.00 67.67 75 A 1 ATOM 608 N ND2 . ASN A 0 75 . -27.125 9.684 12.767 1.00 67.67 75 A 1 ATOM 609 O OD1 . ASN A 0 75 . -26.042 7.886 13.366 1.00 67.67 75 A 1 ATOM 610 N N . SER A 0 76 . -24.068 9.085 17.817 1.00 73.40 76 A 1 ATOM 611 C CA . SER A 0 76 . -23.440 9.866 18.885 1.00 73.40 76 A 1 ATOM 612 C C . SER A 0 76 . -22.280 10.681 18.323 1.00 73.40 76 A 1 ATOM 613 C CB . SER A 0 76 . -22.995 8.977 20.055 1.00 73.40 76 A 1 ATOM 614 O O . SER A 0 76 . -21.641 10.266 17.357 1.00 73.40 76 A 1 ATOM 615 O OG . SER A 0 76 . -21.969 8.074 19.692 1.00 73.40 76 A 1 ATOM 616 N N . SER A 0 77 . -21.972 11.810 18.963 1.00 80.45 77 A 1 ATOM 617 C CA . SER A 0 77 . -20.775 12.610 18.664 1.00 80.45 77 A 1 ATOM 618 C C . SER A 0 77 . -19.495 11.769 18.674 1.00 80.45 77 A 1 ATOM 619 C CB . SER A 0 77 . -20.642 13.724 19.708 1.00 80.45 77 A 1 ATOM 620 O O . SER A 0 77 . -18.605 11.982 17.860 1.00 80.45 77 A 1 ATOM 621 O OG . SER A 0 77 . -20.740 13.202 21.029 1.00 80.45 77 A 1 ATOM 622 N N . ASP A 0 78 . -19.429 10.767 19.555 1.00 79.19 78 A 1 ATOM 623 C CA . ASP A 0 78 . -18.279 9.866 19.657 1.00 79.19 78 A 1 ATOM 624 C C . ASP A 0 78 . -18.083 9.033 18.381 1.00 79.19 78 A 1 ATOM 625 C CB . ASP A 0 78 . -18.460 8.910 20.849 1.00 79.19 78 A 1 ATOM 626 O O . ASP A 0 78 . -16.951 8.746 18.000 1.00 79.19 78 A 1 ATOM 627 C CG . ASP A 0 78 . -18.744 9.590 22.192 1.00 79.19 78 A 1 ATOM 628 O OD1 . ASP A 0 78 . -18.421 10.786 22.353 1.00 79.19 78 A 1 ATOM 629 O OD2 . ASP A 0 78 . -19.377 8.905 23.028 1.00 79.19 78 A 1 ATOM 630 N N . LEU A 0 79 . -19.169 8.641 17.699 1.00 80.52 79 A 1 ATOM 631 C CA . LEU A 0 79 . -19.064 7.921 16.428 1.00 80.52 79 A 1 ATOM 632 C C . LEU A 0 79 . -18.549 8.830 15.314 1.00 80.52 79 A 1 ATOM 633 C CB . LEU A 0 79 . -20.413 7.311 16.024 1.00 80.52 79 A 1 ATOM 634 O O . LEU A 0 79 . -17.725 8.387 14.523 1.00 80.52 79 A 1 ATOM 635 C CG . LEU A 0 79 . -20.853 6.110 16.872 1.00 80.52 79 A 1 ATOM 636 C CD1 . LEU A 0 79 . -22.209 5.641 16.364 1.00 80.52 79 A 1 ATOM 637 C CD2 . LEU A 0 79 . -19.894 4.920 16.765 1.00 80.52 79 A 1 ATOM 638 N N . GLU A 0 80 . -18.983 10.090 15.280 1.00 83.64 80 A 1 ATOM 639 C CA . GLU A 0 80 . -18.479 11.067 14.309 1.00 83.64 80 A 1 ATOM 640 C C . GLU A 0 80 . -16.978 11.320 14.507 1.00 83.64 80 A 1 ATOM 641 C CB . GLU A 0 80 . -19.255 12.390 14.424 1.00 83.64 80 A 1 ATOM 642 O O . GLU A 0 80 . -16.217 11.334 13.539 1.00 83.64 80 A 1 ATOM 643 C CG . GLU A 0 80 . -20.743 12.253 14.061 1.00 83.64 80 A 1 ATOM 644 C CD . GLU A 0 80 . -21.532 13.568 14.201 1.00 83.64 80 A 1 ATOM 645 O OE1 . GLU A 0 80 . -22.741 13.545 13.872 1.00 83.64 80 A 1 ATOM 646 O OE2 . GLU A 0 80 . -20.954 14.585 14.651 1.00 83.64 80 A 1 ATOM 647 N N . GLU A 0 81 . -16.524 11.453 15.758 1.00 88.06 81 A 1 ATOM 648 C CA . GLU A 0 81 . -15.100 11.625 16.066 1.00 88.06 81 A 1 ATOM 649 C C . GLU A 0 81 . -14.280 10.389 15.653 1.00 88.06 81 A 1 ATOM 650 C CB . GLU A 0 81 . -14.926 11.950 17.562 1.00 88.06 81 A 1 ATOM 651 O O . GLU A 0 81 . -13.219 10.507 15.032 1.00 88.06 81 A 1 ATOM 652 C CG . GLU A 0 81 . -13.516 12.506 17.819 1.00 88.06 81 A 1 ATOM 653 C CD . GLU A 0 81 . -13.142 12.708 19.299 1.00 88.06 81 A 1 ATOM 654 O OE1 . GLU A 0 81 . -11.931 12.947 19.548 1.00 88.06 81 A 1 ATOM 655 O OE2 . GLU A 0 81 . -14.032 12.618 20.171 1.00 88.06 81 A 1 ATOM 656 N N . ILE A 0 82 . -14.789 9.185 15.935 1.00 87.08 82 A 1 ATOM 657 C CA . ILE A 0 82 . -14.141 7.933 15.530 1.00 87.08 82 A 1 ATOM 658 C C . ILE A 0 82 . -14.072 7.812 14.004 1.00 87.08 82 A 1 ATOM 659 C CB . ILE A 0 82 . -14.835 6.726 16.196 1.00 87.08 82 A 1 ATOM 660 O O . ILE A 0 82 . -13.026 7.418 13.485 1.00 87.08 82 A 1 ATOM 661 C CG1 . ILE A 0 82 . -14.511 6.729 17.708 1.00 87.08 82 A 1 ATOM 662 C CG2 . ILE A 0 82 . -14.377 5.396 15.565 1.00 87.08 82 A 1 ATOM 663 C CD1 . ILE A 0 82 . -15.386 5.776 18.531 1.00 87.08 82 A 1 ATOM 664 N N . ASP A 0 83 . -15.126 8.188 13.282 1.00 85.92 83 A 1 ATOM 665 C CA . ASP A 0 83 . -15.142 8.172 11.817 1.00 85.92 83 A 1 ATOM 666 C C . ASP A 0 83 . -14.070 9.105 11.239 1.00 85.92 83 A 1 ATOM 667 C CB . ASP A 0 83 . -16.534 8.563 11.295 1.00 85.92 83 A 1 ATOM 668 O O . ASP A 0 83 . -13.334 8.721 10.325 1.00 85.92 83 A 1 ATOM 669 C CG . ASP A 0 83 . -17.607 7.493 11.520 1.00 85.92 83 A 1 ATOM 670 O OD1 . ASP A 0 83 . -17.276 6.342 11.887 1.00 85.92 83 A 1 ATOM 671 O OD2 . ASP A 0 83 . -18.794 7.780 11.242 1.00 85.92 83 A 1 ATOM 672 N N . VAL A 0 84 . -13.897 10.298 11.821 1.00 90.24 84 A 1 ATOM 673 C CA . VAL A 0 84 . -12.812 11.218 11.449 1.00 90.24 84 A 1 ATOM 674 C C . VAL A 0 84 . -11.443 10.570 11.674 1.00 90.24 84 A 1 ATOM 675 C CB . VAL A 0 84 . -12.936 12.561 12.195 1.00 90.24 84 A 1 ATOM 676 O O . VAL A 0 84 . -10.602 10.606 10.771 1.00 90.24 84 A 1 ATOM 677 C CG1 . VAL A 0 84 . -11.718 13.469 11.970 1.00 90.24 84 A 1 ATOM 678 C CG2 . VAL A 0 84 . -14.168 13.337 11.710 1.00 90.24 84 A 1 ATOM 679 N N . TYR A 0 85 . -11.205 9.924 12.820 1.00 92.66 85 A 1 ATOM 680 C CA . TYR A 0 85 . -9.925 9.252 13.076 1.00 92.66 85 A 1 ATOM 681 C C . TYR A 0 85 . -9.665 8.071 12.135 1.00 92.66 85 A 1 ATOM 682 C CB . TYR A 0 85 . -9.839 8.763 14.524 1.00 92.66 85 A 1 ATOM 683 O O . TYR A 0 85 . -8.524 7.882 11.699 1.00 92.66 85 A 1 ATOM 684 C CG . TYR A 0 85 . -9.680 9.848 15.568 1.00 92.66 85 A 1 ATOM 685 C CD1 . TYR A 0 85 . -8.621 10.779 15.492 1.00 92.66 85 A 1 ATOM 686 C CD2 . TYR A 0 85 . -10.573 9.895 16.650 1.00 92.66 85 A 1 ATOM 687 C CE1 . TYR A 0 85 . -8.504 11.794 16.465 1.00 92.66 85 A 1 ATOM 688 C CE2 . TYR A 0 85 . -10.429 10.878 17.640 1.00 92.66 85 A 1 ATOM 689 O OH . TYR A 0 85 . -9.395 12.881 18.428 1.00 92.66 85 A 1 ATOM 690 C CZ . TYR A 0 85 . -9.433 11.864 17.528 1.00 92.66 85 A 1 ATOM 691 N N . ILE A 0 86 . -10.692 7.282 11.803 1.00 91.03 86 A 1 ATOM 692 C CA . ILE A 0 86 . -10.589 6.189 10.828 1.00 91.03 86 A 1 ATOM 693 C C . ILE A 0 86 . -10.175 6.761 9.468 1.00 91.03 86 A 1 ATOM 694 C CB . ILE A 0 86 . -11.915 5.393 10.762 1.00 91.03 86 A 1 ATOM 695 O O . ILE A 0 86 . -9.179 6.310 8.894 1.00 91.03 86 A 1 ATOM 696 C CG1 . ILE A 0 86 . -12.132 4.584 12.061 1.00 91.03 86 A 1 ATOM 697 C CG2 . ILE A 0 86 . -11.927 4.406 9.586 1.00 91.03 86 A 1 ATOM 698 C CD1 . ILE A 0 86 . -13.521 3.938 12.151 1.00 91.03 86 A 1 ATOM 699 N N . ASN A 0 87 . -10.870 7.796 8.996 1.00 90.24 87 A 1 ATOM 700 C CA . ASN A 0 87 . -10.584 8.437 7.714 1.00 90.24 87 A 1 ATOM 701 C C . ASN A 0 87 . -9.166 9.019 7.680 1.00 90.24 87 A 1 ATOM 702 C CB . ASN A 0 87 . -11.649 9.517 7.457 1.00 90.24 87 A 1 ATOM 703 O O . ASN A 0 87 . -8.410 8.765 6.742 1.00 90.24 87 A 1 ATOM 704 C CG . ASN A 0 87 . -13.020 8.922 7.188 1.00 90.24 87 A 1 ATOM 705 N ND2 . ASN A 0 87 . -14.072 9.695 7.297 1.00 90.24 87 A 1 ATOM 706 O OD1 . ASN A 0 87 . -13.165 7.759 6.875 1.00 90.24 87 A 1 ATOM 707 N N . MET A 0 88 . -8.751 9.735 8.731 1.00 92.87 88 A 1 ATOM 708 C CA . MET A 0 88 . -7.395 10.288 8.837 1.00 92.87 88 A 1 ATOM 709 C C . MET A 0 88 . -6.321 9.198 8.825 1.00 92.87 88 A 1 ATOM 710 C CB . MET A 0 88 . -7.253 11.107 10.124 1.00 92.87 88 A 1 ATOM 711 O O . MET A 0 88 . -5.300 9.339 8.148 1.00 92.87 88 A 1 ATOM 712 C CG . MET A 0 88 . -7.966 12.457 10.048 1.00 92.87 88 A 1 ATOM 713 S SD . MET A 0 88 . -7.826 13.436 11.568 1.00 92.87 88 A 1 ATOM 714 C CE . MET A 0 88 . -6.069 13.873 11.547 1.00 92.87 88 A 1 ATOM 715 N N . LYS A 0 89 . -6.534 8.097 9.556 1.00 94.03 89 A 1 ATOM 716 C CA . LYS A 0 89 . -5.606 6.961 9.588 1.00 94.03 89 A 1 ATOM 717 C C . LYS A 0 89 . -5.395 6.393 8.188 1.00 94.03 89 A 1 ATOM 718 C CB . LYS A 0 89 . -6.155 5.899 10.550 1.00 94.03 89 A 1 ATOM 719 O O . LYS A 0 89 . -4.249 6.209 7.777 1.00 94.03 89 A 1 ATOM 720 C CG . LYS A 0 89 . -5.316 4.612 10.574 1.00 94.03 89 A 1 ATOM 721 C CD . LYS A 0 89 . -6.073 3.525 11.337 1.00 94.03 89 A 1 ATOM 722 C CE . LYS A 0 89 . -5.336 2.191 11.219 1.00 94.03 89 A 1 ATOM 723 N NZ . LYS A 0 89 . -6.212 1.081 11.660 1.00 94.03 89 A 1 ATOM 724 N N . TYR A 0 90 . -6.474 6.105 7.466 1.00 93.53 90 A 1 ATOM 725 C CA . TYR A 0 90 . -6.366 5.482 6.152 1.00 93.53 90 A 1 ATOM 726 C C . TYR A 0 90 . -5.895 6.459 5.072 1.00 93.53 90 A 1 ATOM 727 C CB . TYR A 0 90 . -7.665 4.753 5.810 1.00 93.53 90 A 1 ATOM 728 O O . TYR A 0 90 . -5.053 6.087 4.257 1.00 93.53 90 A 1 ATOM 729 C CG . TYR A 0 90 . -7.856 3.498 6.629 1.00 93.53 90 A 1 ATOM 730 C CD1 . TYR A 0 90 . -6.959 2.428 6.453 1.00 93.53 90 A 1 ATOM 731 C CD2 . TYR A 0 90 . -8.885 3.405 7.581 1.00 93.53 90 A 1 ATOM 732 C CE1 . TYR A 0 90 . -7.037 1.302 7.286 1.00 93.53 90 A 1 ATOM 733 C CE2 . TYR A 0 90 . -8.976 2.272 8.410 1.00 93.53 90 A 1 ATOM 734 O OH . TYR A 0 90 . -8.081 0.164 9.118 1.00 93.53 90 A 1 ATOM 735 C CZ . TYR A 0 90 . -8.037 1.236 8.280 1.00 93.53 90 A 1 ATOM 736 N N . TYR A 0 91 . -6.275 7.734 5.151 1.00 90.68 91 A 1 ATOM 737 C CA . TYR A 0 91 . -5.689 8.784 4.320 1.00 90.68 91 A 1 ATOM 738 C C . TYR A 0 91 . -4.166 8.885 4.495 1.00 90.68 91 A 1 ATOM 739 C CB . TYR A 0 91 . -6.356 10.119 4.656 1.00 90.68 91 A 1 ATOM 740 O O . TYR A 0 91 . -3.428 8.941 3.511 1.00 90.68 91 A 1 ATOM 741 C CG . TYR A 0 91 . -5.794 11.266 3.846 1.00 90.68 91 A 1 ATOM 742 C CD1 . TYR A 0 91 . -4.865 12.154 4.423 1.00 90.68 91 A 1 ATOM 743 C CD2 . TYR A 0 91 . -6.179 11.415 2.501 1.00 90.68 91 A 1 ATOM 744 C CE1 . TYR A 0 91 . -4.348 13.219 3.662 1.00 90.68 91 A 1 ATOM 745 C CE2 . TYR A 0 91 . -5.657 12.471 1.734 1.00 90.68 91 A 1 ATOM 746 O OH . TYR A 0 91 . -4.266 14.406 1.579 1.00 90.68 91 A 1 ATOM 747 C CZ . TYR A 0 91 . -4.758 13.383 2.322 1.00 90.68 91 A 1 ATOM 748 N N . ASN A 0 92 . -3.669 8.838 5.736 1.00 92.60 92 A 1 ATOM 749 C CA . ASN A 0 92 . -2.230 8.831 5.998 1.00 92.60 92 A 1 ATOM 750 C C . ASN A 0 92 . -1.554 7.596 5.387 1.00 92.60 92 A 1 ATOM 751 C CB . ASN A 0 92 . -1.981 8.926 7.513 1.00 92.60 92 A 1 ATOM 752 O O . ASN A 0 92 . -0.510 7.732 4.754 1.00 92.60 92 A 1 ATOM 753 C CG . ASN A 0 92 . -2.262 10.307 8.078 1.00 92.60 92 A 1 ATOM 754 N ND2 . ASN A 0 92 . -2.501 10.403 9.365 1.00 92.60 92 A 1 ATOM 755 O OD1 . ASN A 0 92 . -2.224 11.318 7.399 1.00 92.60 92 A 1 ATOM 756 N N . ILE A 0 93 . -2.155 6.408 5.522 1.00 91.68 93 A 1 ATOM 757 C CA . ILE A 0 93 . -1.646 5.173 4.900 1.00 91.68 93 A 1 ATOM 758 C C . ILE A 0 93 . -1.566 5.319 3.374 1.00 91.68 93 A 1 ATOM 759 C CB . ILE A 0 93 . -2.500 3.953 5.322 1.00 91.68 93 A 1 ATOM 760 O O . ILE A 0 93 . -0.533 4.987 2.794 1.00 91.68 93 A 1 ATOM 761 C CG1 . ILE A 0 93 . -2.260 3.636 6.817 1.00 91.68 93 A 1 ATOM 762 C CG2 . ILE A 0 93 . -2.180 2.712 4.466 1.00 91.68 93 A 1 ATOM 763 C CD1 . ILE A 0 93 . -3.288 2.673 7.427 1.00 91.68 93 A 1 ATOM 764 N N . TYR A 0 94 . -2.609 5.854 2.732 1.00 90.56 94 A 1 ATOM 765 C CA . TYR A 0 94 . -2.602 6.148 1.296 1.00 90.56 94 A 1 ATOM 766 C C . TYR A 0 94 . -1.432 7.059 0.911 1.00 90.56 94 A 1 ATOM 767 C CB . TYR A 0 94 . -3.946 6.771 0.887 1.00 90.56 94 A 1 ATOM 768 O O . TYR A 0 94 . -0.654 6.716 0.024 1.00 90.56 94 A 1 ATOM 769 C CG . TYR A 0 94 . -3.919 7.535 -0.421 1.00 90.56 94 A 1 ATOM 770 C CD1 . TYR A 0 94 . -3.978 8.941 -0.443 1.00 90.56 94 A 1 ATOM 771 C CD2 . TYR A 0 94 . -3.806 6.826 -1.625 1.00 90.56 94 A 1 ATOM 772 C CE1 . TYR A 0 94 . -3.916 9.625 -1.674 1.00 90.56 94 A 1 ATOM 773 C CE2 . TYR A 0 94 . -3.769 7.496 -2.856 1.00 90.56 94 A 1 ATOM 774 O OH . TYR A 0 94 . -3.765 9.536 -4.079 1.00 90.56 94 A 1 ATOM 775 C CZ . TYR A 0 94 . -3.817 8.899 -2.882 1.00 90.56 94 A 1 ATOM 776 N N . GLN A 0 95 . -1.259 8.177 1.620 1.00 91.83 95 A 1 ATOM 777 C CA . GLN A 0 95 . -0.192 9.140 1.346 1.00 91.83 95 A 1 ATOM 778 C C . GLN A 0 95 . 1.208 8.533 1.521 1.00 91.83 95 A 1 ATOM 779 C CB . GLN A 0 95 . -0.369 10.359 2.270 1.00 91.83 95 A 1 ATOM 780 O O . GLN A 0 95 . 2.094 8.775 0.701 1.00 91.83 95 A 1 ATOM 781 C CG . GLN A 0 95 . -1.587 11.227 1.906 1.00 91.83 95 A 1 ATOM 782 C CD . GLN A 0 95 . -1.433 11.959 0.577 1.00 91.83 95 A 1 ATOM 783 N NE2 . GLN A 0 95 . -2.459 12.615 0.089 1.00 91.83 95 A 1 ATOM 784 O OE1 . GLN A 0 95 . -0.378 12.003 -0.032 1.00 91.83 95 A 1 ATOM 785 N N . PHE A 0 96 . 1.422 7.729 2.568 1.00 92.21 96 A 1 ATOM 786 C CA . PHE A 0 96 . 2.695 7.036 2.782 1.00 92.21 96 A 1 ATOM 787 C C . PHE A 0 96 . 2.980 6.016 1.680 1.00 92.21 96 A 1 ATOM 788 C CB . PHE A 0 96 . 2.722 6.361 4.162 1.00 92.21 96 A 1 ATOM 789 O O . PHE A 0 96 . 4.073 6.027 1.115 1.00 92.21 96 A 1 ATOM 790 C CG . PHE A 0 96 . 3.079 7.300 5.297 1.00 92.21 96 A 1 ATOM 791 C CD1 . PHE A 0 96 . 4.362 7.876 5.344 1.00 92.21 96 A 1 ATOM 792 C CD2 . PHE A 0 96 . 2.154 7.583 6.318 1.00 92.21 96 A 1 ATOM 793 C CE1 . PHE A 0 96 . 4.706 8.751 6.389 1.00 92.21 96 A 1 ATOM 794 C CE2 . PHE A 0 96 . 2.488 8.473 7.353 1.00 92.21 96 A 1 ATOM 795 C CZ . PHE A 0 96 . 3.765 9.058 7.388 1.00 92.21 96 A 1 ATOM 796 N N . ASN A 0 97 . 2.000 5.176 1.342 1.00 89.77 97 A 1 ATOM 797 C CA . ASN A 0 97 . 2.151 4.175 0.291 1.00 89.77 97 A 1 ATOM 798 C C . ASN A 0 97 . 2.445 4.835 -1.058 1.00 89.77 97 A 1 ATOM 799 C CB . ASN A 0 97 . 0.885 3.308 0.229 1.00 89.77 97 A 1 ATOM 800 O O . ASN A 0 97 . 3.390 4.436 -1.732 1.00 89.77 97 A 1 ATOM 801 C CG . ASN A 0 97 . 0.758 2.336 1.387 1.00 89.77 97 A 1 ATOM 802 N ND2 . ASN A 0 97 . -0.391 1.718 1.527 1.00 89.77 97 A 1 ATOM 803 O OD1 . ASN A 0 97 . 1.670 2.085 2.157 1.00 89.77 97 A 1 ATOM 804 N N . PHE A 0 98 . 1.695 5.879 -1.427 1.00 89.64 98 A 1 ATOM 805 C CA . PHE A 0 98 . 1.903 6.595 -2.684 1.00 89.64 98 A 1 ATOM 806 C C . PHE A 0 98 . 3.329 7.151 -2.793 1.00 89.64 98 A 1 ATOM 807 C CB . PHE A 0 98 . 0.849 7.700 -2.833 1.00 89.64 98 A 1 ATOM 808 O O . PHE A 0 98 . 4.005 6.890 -3.783 1.00 89.64 98 A 1 ATOM 809 C CG . PHE A 0 98 . 0.910 8.376 -4.188 1.00 89.64 98 A 1 ATOM 810 C CD1 . PHE A 0 98 . 1.728 9.507 -4.382 1.00 89.64 98 A 1 ATOM 811 C CD2 . PHE A 0 98 . 0.206 7.829 -5.279 1.00 89.64 98 A 1 ATOM 812 C CE1 . PHE A 0 98 . 1.850 10.078 -5.660 1.00 89.64 98 A 1 ATOM 813 C CE2 . PHE A 0 98 . 0.322 8.407 -6.556 1.00 89.64 98 A 1 ATOM 814 C CZ . PHE A 0 98 . 1.148 9.529 -6.746 1.00 89.64 98 A 1 ATOM 815 N N . LYS A 0 99 . 3.829 7.827 -1.748 1.00 92.21 99 A 1 ATOM 816 C CA . LYS A 0 99 . 5.198 8.374 -1.725 1.00 92.21 99 A 1 ATOM 817 C C . LYS A 0 99 . 6.279 7.298 -1.805 1.00 92.21 99 A 1 ATOM 818 C CB . LYS A 0 99 . 5.404 9.201 -0.454 1.00 92.21 99 A 1 ATOM 819 O O . LYS A 0 99 . 7.297 7.503 -2.459 1.00 92.21 99 A 1 ATOM 820 C CG . LYS A 0 99 . 4.655 10.533 -0.530 1.00 92.21 99 A 1 ATOM 821 C CD . LYS A 0 99 . 4.850 11.308 0.774 1.00 92.21 99 A 1 ATOM 822 C CE . LYS A 0 99 . 4.086 12.626 0.670 1.00 92.21 99 A 1 ATOM 823 N NZ . LYS A 0 99 . 4.289 13.460 1.876 1.00 92.21 99 A 1 ATOM 824 N N . LEU A 0 100 . 6.082 6.157 -1.141 1.00 91.68 100 A 1 ATOM 825 C CA . LEU A 0 100 . 7.020 5.031 -1.220 1.00 91.68 100 A 1 ATOM 826 C C . LEU A 0 100 . 7.093 4.470 -2.641 1.00 91.68 100 A 1 ATOM 827 C CB . LEU A 0 100 . 6.594 3.926 -0.239 1.00 91.68 100 A 1 ATOM 828 O O . LEU A 0 100 . 8.182 4.205 -3.148 1.00 91.68 100 A 1 ATOM 829 C CG . LEU A 0 100 . 6.892 4.237 1.236 1.00 91.68 100 A 1 ATOM 830 C CD1 . LEU A 0 100 . 6.235 3.174 2.118 1.00 91.68 100 A 1 ATOM 831 C CD2 . LEU A 0 100 . 8.395 4.240 1.528 1.00 91.68 100 A 1 ATOM 832 N N . TYR A 0 101 . 5.940 4.319 -3.288 1.00 89.24 101 A 1 ATOM 833 C CA . TYR A 0 101 . 5.869 3.831 -4.655 1.00 89.24 101 A 1 ATOM 834 C C . TYR A 0 101 . 6.432 4.824 -5.677 1.00 89.24 101 A 1 ATOM 835 C CB . TYR A 0 101 . 4.416 3.507 -4.984 1.00 89.24 101 A 1 ATOM 836 O O . TYR A 0 101 . 7.161 4.414 -6.575 1.00 89.24 101 A 1 ATOM 837 C CG . TYR A 0 101 . 3.842 2.260 -4.347 1.00 89.24 101 A 1 ATOM 838 C CD1 . TYR A 0 101 . 4.500 1.025 -4.503 1.00 89.24 101 A 1 ATOM 839 C CD2 . TYR A 0 101 . 2.617 2.320 -3.655 1.00 89.24 101 A 1 ATOM 840 C CE1 . TYR A 0 101 . 3.966 -0.138 -3.919 1.00 89.24 101 A 1 ATOM 841 C CE2 . TYR A 0 101 . 2.082 1.162 -3.064 1.00 89.24 101 A 1 ATOM 842 O OH . TYR A 0 101 . 2.242 -1.181 -2.615 1.00 89.24 101 A 1 ATOM 843 C CZ . TYR A 0 101 . 2.761 -0.065 -3.187 1.00 89.24 101 A 1 ATOM 844 N N . GLU A 0 102 . 6.132 6.115 -5.531 1.00 90.07 102 A 1 ATOM 845 C CA . GLU A 0 102 . 6.716 7.191 -6.341 1.00 90.07 102 A 1 ATOM 846 C C . GLU A 0 102 . 8.248 7.186 -6.223 1.00 90.07 102 A 1 ATOM 847 C CB . GLU A 0 102 . 6.108 8.523 -5.874 1.00 90.07 102 A 1 ATOM 848 O O . GLU A 0 102 . 8.955 7.196 -7.231 1.00 90.07 102 A 1 ATOM 849 C CG . GLU A 0 102 . 6.681 9.752 -6.592 1.00 90.07 102 A 1 ATOM 850 C CD . GLU A 0 102 . 5.996 11.044 -6.122 1.00 90.07 102 A 1 ATOM 851 O OE1 . GLU A 0 102 . 5.526 11.818 -6.986 1.00 90.07 102 A 1 ATOM 852 O OE2 . GLU A 0 102 . 5.946 11.262 -4.885 1.00 90.07 102 A 1 ATOM 853 N N . HIS A 0 103 . 8.774 7.069 -5.000 1.00 92.96 103 A 1 ATOM 854 C CA . HIS A 0 103 . 10.212 6.973 -4.766 1.00 92.96 103 A 1 ATOM 855 C C . HIS A 0 103 . 10.842 5.741 -5.443 1.00 92.96 103 A 1 ATOM 856 C CB . HIS A 0 103 . 10.470 6.978 -3.253 1.00 92.96 103 A 1 ATOM 857 O O . HIS A 0 103 . 11.890 5.867 -6.082 1.00 92.96 103 A 1 ATOM 858 C CG . HIS A 0 103 . 11.929 6.832 -2.907 1.00 92.96 103 A 1 ATOM 859 C CD2 . HIS A 0 103 . 12.799 7.835 -2.579 1.00 92.96 103 A 1 ATOM 860 N ND1 . HIS A 0 103 . 12.652 5.661 -2.939 1.00 92.96 103 A 1 ATOM 861 C CE1 . HIS A 0 103 . 13.931 5.956 -2.657 1.00 92.96 103 A 1 ATOM 862 N NE2 . HIS A 0 103 . 14.065 7.268 -2.402 1.00 92.96 103 A 1 ATOM 863 N N . ASP A 0 104 . 10.238 4.551 -5.316 1.00 90.21 104 A 1 ATOM 864 C CA . ASP A 0 104 . 10.715 3.326 -5.986 1.00 90.21 104 A 1 ATOM 865 C C . ASP A 0 104 . 10.708 3.484 -7.514 1.00 90.21 104 A 1 ATOM 866 C CB . ASP A 0 104 . 9.856 2.121 -5.556 1.00 90.21 104 A 1 ATOM 867 O O . ASP A 0 104 . 11.690 3.161 -8.185 1.00 90.21 104 A 1 ATOM 868 C CG . ASP A 0 104 . 10.271 0.804 -6.240 1.00 90.21 104 A 1 ATOM 869 O OD1 . ASP A 0 104 . 11.444 0.393 -6.149 1.00 90.21 104 A 1 ATOM 870 O OD2 . ASP A 0 104 . 9.429 0.134 -6.878 1.00 90.21 104 A 1 ATOM 871 N N . LEU A 0 105 . 9.632 4.051 -8.063 1.00 89.58 105 A 1 ATOM 872 C CA . LEU A 0 105 . 9.483 4.288 -9.494 1.00 89.58 105 A 1 ATOM 873 C C . LEU A 0 105 . 10.570 5.222 -10.039 1.00 89.58 105 A 1 ATOM 874 C CB . LEU A 0 105 . 8.068 4.841 -9.740 1.00 89.58 105 A 1 ATOM 875 O O . LEU A 0 105 . 11.263 4.871 -10.996 1.00 89.58 105 A 1 ATOM 876 C CG . LEU A 0 105 . 7.746 5.139 -11.212 1.00 89.58 105 A 1 ATOM 877 C CD1 . LEU A 0 105 . 7.951 3.903 -12.065 1.00 89.58 105 A 1 ATOM 878 C CD2 . LEU A 0 105 . 6.281 5.534 -11.345 1.00 89.58 105 A 1 ATOM 879 N N . ILE A 0 106 . 10.754 6.380 -9.403 1.00 89.74 106 A 1 ATOM 880 C CA . ILE A 0 106 . 11.769 7.367 -9.792 1.00 89.74 106 A 1 ATOM 881 C C . ILE A 0 106 . 13.178 6.778 -9.656 1.00 89.74 106 A 1 ATOM 882 C CB . ILE A 0 106 . 11.593 8.657 -8.957 1.00 89.74 106 A 1 ATOM 883 O O . ILE A 0 106 . 14.018 6.983 -10.532 1.00 89.74 106 A 1 ATOM 884 C CG1 . ILE A 0 106 . 10.278 9.365 -9.360 1.00 89.74 106 A 1 ATOM 885 C CG2 . ILE A 0 106 . 12.789 9.612 -9.142 1.00 89.74 106 A 1 ATOM 886 C CD1 . ILE A 0 106 . 9.885 10.517 -8.426 1.00 89.74 106 A 1 ATOM 887 N N . SER A 0 107 . 13.441 5.999 -8.604 1.00 91.97 107 A 1 ATOM 888 C CA . SER A 0 107 . 14.747 5.356 -8.407 1.00 91.97 107 A 1 ATOM 889 C C . SER A 0 107 . 15.085 4.398 -9.555 1.00 91.97 107 A 1 ATOM 890 C CB . SER A 0 107 . 14.794 4.612 -7.071 1.00 91.97 107 A 1 ATOM 891 O O . SER A 0 107 . 16.167 4.488 -10.132 1.00 91.97 107 A 1 ATOM 892 O OG . SER A 0 107 . 14.606 5.512 -5.995 1.00 91.97 107 A 1 ATOM 893 N N . ARG A 0 108 . 14.134 3.547 -9.967 1.00 89.17 108 A 1 ATOM 894 C CA . ARG A 0 108 . 14.311 2.630 -11.110 1.00 89.17 108 A 1 ATOM 895 C C . ARG A 0 108 . 14.554 3.373 -12.421 1.00 89.17 108 A 1 ATOM 896 C CB . ARG A 0 108 . 13.074 1.740 -11.260 1.00 89.17 108 A 1 ATOM 897 O O . ARG A 0 108 . 15.380 2.942 -13.222 1.00 89.17 108 A 1 ATOM 898 C CG . ARG A 0 108 . 12.916 0.746 -10.106 1.00 89.17 108 A 1 ATOM 899 C CD . ARG A 0 108 . 11.550 0.076 -10.231 1.00 89.17 108 A 1 ATOM 900 N NE . ARG A 0 108 . 11.249 -0.733 -9.046 1.00 89.17 108 A 1 ATOM 901 N NH1 . ARG A 0 108 . 10.539 -2.675 -10.058 1.00 89.17 108 A 1 ATOM 902 N NH2 . ARG A 0 108 . 10.310 -2.368 -7.847 1.00 89.17 108 A 1 ATOM 903 C CZ . ARG A 0 108 . 10.710 -1.929 -8.997 1.00 89.17 108 A 1 ATOM 904 N N . ILE A 0 109 . 13.852 4.486 -12.634 1.00 88.06 109 A 1 ATOM 905 C CA . ILE A 0 109 . 14.044 5.374 -13.789 1.00 88.06 109 A 1 ATOM 906 C C . ILE A 0 109 . 15.466 5.939 -13.802 1.00 88.06 109 A 1 ATOM 907 C CB . ILE A 0 109 . 12.961 6.477 -13.761 1.00 88.06 109 A 1 ATOM 908 O O . ILE A 0 109 . 16.151 5.836 -14.817 1.00 88.06 109 A 1 ATOM 909 C CG1 . ILE A 0 109 . 11.637 5.836 -14.212 1.00 88.06 109 A 1 ATOM 910 C CG2 . ILE A 0 109 . 13.287 7.733 -14.591 1.00 88.06 109 A 1 ATOM 911 C CD1 . ILE A 0 109 . 10.421 6.744 -14.084 1.00 88.06 109 A 1 ATOM 912 N N . ILE A 0 110 . 15.936 6.483 -12.675 1.00 89.39 110 A 1 ATOM 913 C CA . ILE A 0 110 . 17.292 7.038 -12.545 1.00 89.39 110 A 1 ATOM 914 C C . ILE A 0 110 . 18.351 5.965 -12.816 1.00 89.39 110 A 1 ATOM 915 C CB . ILE A 0 110 . 17.471 7.686 -11.151 1.00 89.39 110 A 1 ATOM 916 O O . ILE A 0 110 . 19.310 6.226 -13.543 1.00 89.39 110 A 1 ATOM 917 C CG1 . ILE A 0 110 . 16.640 8.987 -11.072 1.00 89.39 110 A 1 ATOM 918 C CG2 . ILE A 0 110 . 18.956 7.983 -10.847 1.00 89.39 110 A 1 ATOM 919 C CD1 . ILE A 0 110 . 16.540 9.575 -9.658 1.00 89.39 110 A 1 ATOM 920 N N . ASP A 0 111 . 18.180 4.761 -12.271 1.00 89.46 111 A 1 ATOM 921 C CA . ASP A 0 111 . 19.121 3.660 -12.482 1.00 89.46 111 A 1 ATOM 922 C C . ASP A 0 111 . 19.156 3.215 -13.949 1.00 89.46 111 A 1 ATOM 923 C CB . ASP A 0 111 . 18.766 2.488 -11.556 1.00 89.46 111 A 1 ATOM 924 O O . ASP A 0 111 . 20.233 3.001 -14.508 1.00 89.46 111 A 1 ATOM 925 C CG . ASP A 0 111 . 19.112 2.742 -10.082 1.00 89.46 111 A 1 ATOM 926 O OD1 . ASP A 0 111 . 19.944 3.644 -9.803 1.00 89.46 111 A 1 ATOM 927 O OD2 . ASP A 0 111 . 18.585 1.974 -9.247 1.00 89.46 111 A 1 ATOM 928 N N . MET A 0 112 . 18.000 3.143 -14.616 1.00 87.03 112 A 1 ATOM 929 C CA . MET A 0 112 . 17.928 2.848 -16.050 1.00 87.03 112 A 1 ATOM 930 C C . MET A 0 112 . 18.591 3.936 -16.900 1.00 87.03 112 A 1 ATOM 931 C CB . MET A 0 112 . 16.469 2.647 -16.476 1.00 87.03 112 A 1 ATOM 932 O O . MET A 0 112 . 19.344 3.614 -17.817 1.00 87.03 112 A 1 ATOM 933 C CG . MET A 0 112 . 15.957 1.271 -16.047 1.00 87.03 112 A 1 ATOM 934 S SD . MET A 0 112 . 14.257 0.944 -16.576 1.00 87.03 112 A 1 ATOM 935 C CE . MET A 0 112 . 14.285 -0.859 -16.674 1.00 87.03 112 A 1 ATOM 936 N N . LEU A 0 113 . 18.375 5.215 -16.578 1.00 86.09 113 A 1 ATOM 937 C CA . LEU A 0 113 . 19.025 6.328 -17.274 1.00 86.09 113 A 1 ATOM 938 C C . LEU A 0 113 . 20.550 6.285 -17.117 1.00 86.09 113 A 1 ATOM 939 C CB . LEU A 0 113 . 18.454 7.662 -16.760 1.00 86.09 113 A 1 ATOM 940 O O . LEU A 0 113 . 21.266 6.453 -18.102 1.00 86.09 113 A 1 ATOM 941 C CG . LEU A 0 113 . 17.022 7.964 -17.236 1.00 86.09 113 A 1 ATOM 942 C CD1 . LEU A 0 113 . 16.505 9.217 -16.530 1.00 86.09 113 A 1 ATOM 943 C CD2 . LEU A 0 113 . 16.961 8.197 -18.749 1.00 86.09 113 A 1 ATOM 944 N N . ARG A 0 114 . 21.049 5.999 -15.907 1.00 87.89 114 A 1 ATOM 945 C CA . ARG A 0 114 . 22.489 5.846 -15.636 1.00 87.89 114 A 1 ATOM 946 C C . ARG A 0 114 . 23.105 4.673 -16.393 1.00 87.89 114 A 1 ATOM 947 C CB . ARG A 0 114 . 22.713 5.651 -14.134 1.00 87.89 114 A 1 ATOM 948 O O . ARG A 0 114 . 24.209 4.793 -16.919 1.00 87.89 114 A 1 ATOM 949 C CG . ARG A 0 114 . 22.557 6.956 -13.351 1.00 87.89 114 A 1 ATOM 950 C CD . ARG A 0 114 . 22.628 6.631 -11.859 1.00 87.89 114 A 1 ATOM 951 N NE . ARG A 0 114 . 22.633 7.852 -11.038 1.00 87.89 114 A 1 ATOM 952 N NH1 . ARG A 0 114 . 22.394 6.786 -9.022 1.00 87.89 114 A 1 ATOM 953 N NH2 . ARG A 0 114 . 22.563 9.016 -9.087 1.00 87.89 114 A 1 ATOM 954 C CZ . ARG A 0 114 . 22.534 7.878 -9.723 1.00 87.89 114 A 1 ATOM 955 N N . ASN A 0 115 . 22.406 3.542 -16.451 1.00 83.12 115 A 1 ATOM 956 C CA . ASN A 0 115 . 22.892 2.365 -17.167 1.00 83.12 115 A 1 ATOM 957 C C . ASN A 0 115 . 22.921 2.599 -18.680 1.00 83.12 115 A 1 ATOM 958 C CB . ASN A 0 115 . 22.044 1.150 -16.772 1.00 83.12 115 A 1 ATOM 959 O O . ASN A 0 115 . 23.904 2.238 -19.318 1.00 83.12 115 A 1 ATOM 960 C CG . ASN A 0 115 . 22.306 0.704 -15.343 1.00 83.12 115 A 1 ATOM 961 N ND2 . ASN A 0 115 . 21.357 0.038 -14.729 1.00 83.12 115 A 1 ATOM 962 O OD1 . ASN A 0 115 . 23.358 0.921 -14.763 1.00 83.12 115 A 1 ATOM 963 N N . ASN A 0 116 . 21.917 3.285 -19.232 1.00 75.80 116 A 1 ATOM 964 C CA . ASN A 0 116 . 21.902 3.657 -20.646 1.00 75.80 116 A 1 ATOM 965 C C . ASN A 0 116 . 23.019 4.655 -20.992 1.00 75.80 116 A 1 ATOM 966 C CB . ASN A 0 116 . 20.515 4.207 -21.011 1.00 75.80 116 A 1 ATOM 967 O O . ASN A 0 116 . 23.655 4.493 -22.023 1.00 75.80 116 A 1 ATOM 968 C CG . ASN A 0 116 . 19.429 3.144 -21.053 1.00 75.80 116 A 1 ATOM 969 N ND2 . ASN A 0 116 . 18.187 3.555 -21.164 1.00 75.80 116 A 1 ATOM 970 O OD1 . ASN A 0 116 . 19.652 1.946 -21.015 1.00 75.80 116 A 1 ATOM 971 N N . SER A 0 117 . 23.323 5.628 -20.121 1.00 68.11 117 A 1 ATOM 972 C CA . SER A 0 117 . 24.454 6.549 -20.343 1.00 68.11 117 A 1 ATOM 973 C C . SER A 0 117 . 25.828 5.878 -20.245 1.00 68.11 117 A 1 ATOM 974 C CB . SER A 0 117 . 24.397 7.737 -19.374 1.00 68.11 117 A 1 ATOM 975 O O . SER A 0 117 . 26.813 6.403 -20.751 1.00 68.11 117 A 1 ATOM 976 O OG . SER A 0 117 . 24.437 7.354 -18.008 1.00 68.11 117 A 1 ATOM 977 N N . ASN A 0 118 . 25.914 4.725 -19.575 1.00 59.77 118 A 1 ATOM 978 C CA . ASN A 0 118 . 27.155 3.959 -19.453 1.00 59.77 118 A 1 ATOM 979 C C . ASN A 0 118 . 27.317 2.903 -20.566 1.00 59.77 118 A 1 ATOM 980 C CB . ASN A 0 118 . 27.213 3.331 -18.051 1.00 59.77 118 A 1 ATOM 981 O O . ASN A 0 118 . 28.426 2.407 -20.751 1.00 59.77 118 A 1 ATOM 982 C CG . ASN A 0 118 . 27.406 4.335 -16.926 1.00 59.77 118 A 1 ATOM 983 N ND2 . ASN A 0 118 . 27.021 3.978 -15.723 1.00 59.77 118 A 1 ATOM 984 O OD1 . ASN A 0 118 . 27.933 5.425 -17.069 1.00 59.77 118 A 1 ATOM 985 N N . ASP A 0 119 . 26.248 2.572 -21.303 1.00 54.85 119 A 1 ATOM 986 C CA . ASP A 0 119 . 26.274 1.698 -22.493 1.00 54.85 119 A 1 ATOM 987 C C . ASP A 0 119 . 26.398 2.499 -23.802 1.00 54.85 119 A 1 ATOM 988 C CB . ASP A 0 119 . 25.085 0.721 -22.491 1.00 54.85 119 A 1 ATOM 989 O O . ASP A 0 119 . 26.178 1.991 -24.905 1.00 54.85 119 A 1 ATOM 990 C CG . ASP A 0 119 . 25.286 -0.537 -23.365 1.00 54.85 119 A 1 ATOM 991 O OD1 . ASP A 0 119 . 26.414 -0.810 -23.851 1.00 54.85 119 A 1 ATOM 992 O OD2 . ASP A 0 119 . 24.304 -1.305 -23.495 1.00 54.85 119 A 1 ATOM 993 N N . ASP A 0 120 . 26.842 3.753 -23.702 1.00 47.23 120 A 1 ATOM 994 C CA . ASP A 0 120 . 27.448 4.425 -24.833 1.00 47.23 120 A 1 ATOM 995 C C . ASP A 0 120 . 28.795 3.744 -25.128 1.00 47.23 120 A 1 ATOM 996 C CB . ASP A 0 120 . 27.583 5.936 -24.609 1.00 47.23 120 A 1 ATOM 997 O O . ASP A 0 120 . 29.883 4.206 -24.766 1.00 47.23 120 A 1 ATOM 998 C CG . ASP A 0 120 . 26.274 6.734 -24.704 1.00 47.23 120 A 1 ATOM 999 O OD1 . ASP A 0 120 . 25.387 6.316 -25.482 1.00 47.23 120 A 1 ATOM 1000 O OD2 . ASP A 0 120 . 26.214 7.816 -24.076 1.00 47.23 120 A 1 ATOM 1001 N N . ARG A 0 121 . 28.736 2.681 -25.940 1.00 43.82 121 A 1 ATOM 1002 C CA . ARG A 0 121 . 29.618 2.604 -27.111 1.00 43.82 121 A 1 ATOM 1003 C C . ARG A 0 121 . 29.422 3.903 -27.890 1.00 43.82 121 A 1 ATOM 1004 C CB . ARG A 0 121 . 29.297 1.367 -27.966 1.00 43.82 121 A 1 ATOM 1005 O O . ARG A 0 121 . 28.678 3.951 -28.865 1.00 43.82 121 A 1 ATOM 1006 C CG . ARG A 0 121 . 30.053 0.135 -27.463 1.00 43.82 121 A 1 ATOM 1007 C CD . ARG A 0 121 . 29.742 -1.094 -28.325 1.00 43.82 121 A 1 ATOM 1008 N NE . ARG A 0 121 . 28.493 -1.743 -27.896 1.00 43.82 121 A 1 ATOM 1009 N NH1 . ARG A 0 121 . 28.400 -3.364 -29.518 1.00 43.82 121 A 1 ATOM 1010 N NH2 . ARG A 0 121 . 26.895 -3.344 -27.854 1.00 43.82 121 A 1 ATOM 1011 C CZ . ARG A 0 121 . 27.936 -2.812 -28.427 1.00 43.82 121 A 1 ATOM 1012 N N . TYR A 0 122 . 30.056 4.960 -27.389 1.00 44.38 122 A 1 ATOM 1013 C CA . TYR A 0 122 . 30.026 6.294 -27.944 1.00 44.38 122 A 1 ATOM 1014 C C . TYR A 0 122 . 30.664 6.168 -29.320 1.00 44.38 122 A 1 ATOM 1015 C CB . TYR A 0 122 . 30.739 7.282 -26.996 1.00 44.38 122 A 1 ATOM 1016 O O . TYR A 0 122 . 31.879 6.016 -29.464 1.00 44.38 122 A 1 ATOM 1017 C CG . TYR A 0 122 . 30.057 8.635 -26.865 1.00 44.38 122 A 1 ATOM 1018 C CD1 . TYR A 0 122 . 30.265 9.643 -27.827 1.00 44.38 122 A 1 ATOM 1019 C CD2 . TYR A 0 122 . 29.210 8.891 -25.768 1.00 44.38 122 A 1 ATOM 1020 C CE1 . TYR A 0 122 . 29.623 10.891 -27.690 1.00 44.38 122 A 1 ATOM 1021 C CE2 . TYR A 0 122 . 28.540 10.119 -25.646 1.00 44.38 122 A 1 ATOM 1022 O OH . TYR A 0 122 . 28.128 12.329 -26.472 1.00 44.38 122 A 1 ATOM 1023 C CZ . TYR A 0 122 . 28.751 11.127 -26.602 1.00 44.38 122 A 1 ATOM 1024 N N . TYR A 0 123 . 29.805 6.131 -30.332 1.00 41.32 123 A 1 ATOM 1025 C CA . TYR A 0 123 . 30.177 6.410 -31.698 1.00 41.32 123 A 1 ATOM 1026 C C . TYR A 0 123 . 30.695 7.844 -31.677 1.00 41.32 123 A 1 ATOM 1027 C CB . TYR A 0 123 . 28.938 6.217 -32.586 1.00 41.32 123 A 1 ATOM 1028 O O . TYR A 0 123 . 29.915 8.789 -31.620 1.00 41.32 123 A 1 ATOM 1029 C CG . TYR A 0 123 . 29.228 6.091 -34.067 1.00 41.32 123 A 1 ATOM 1030 C CD1 . TYR A 0 123 . 29.358 7.238 -34.874 1.00 41.32 123 A 1 ATOM 1031 C CD2 . TYR A 0 123 . 29.343 4.810 -34.639 1.00 41.32 123 A 1 ATOM 1032 C CE1 . TYR A 0 123 . 29.593 7.103 -36.257 1.00 41.32 123 A 1 ATOM 1033 C CE2 . TYR A 0 123 . 29.570 4.670 -36.020 1.00 41.32 123 A 1 ATOM 1034 O OH . TYR A 0 123 . 29.917 5.673 -38.164 1.00 41.32 123 A 1 ATOM 1035 C CZ . TYR A 0 123 . 29.695 5.816 -36.831 1.00 41.32 123 A 1 ATOM 1036 N N . ASP A 0 124 . 32.012 8.000 -31.604 1.00 48.38 124 A 1 ATOM 1037 C CA . ASP A 0 124 . 32.658 9.272 -31.866 1.00 48.38 124 A 1 ATOM 1038 C C . ASP A 0 124 . 32.545 9.500 -33.380 1.00 48.38 124 A 1 ATOM 1039 C CB . ASP A 0 124 . 34.110 9.210 -31.368 1.00 48.38 124 A 1 ATOM 1040 O O . ASP A 0 124 . 33.176 8.772 -34.146 1.00 48.38 124 A 1 ATOM 1041 C CG . ASP A 0 124 . 34.824 10.564 -31.433 1.00 48.38 124 A 1 ATOM 1042 O OD1 . ASP A 0 124 . 34.274 11.486 -32.075 1.00 48.38 124 A 1 ATOM 1043 O OD2 . ASP A 0 124 . 35.886 10.682 -30.777 1.00 48.38 124 A 1 ATOM 1044 N N . PRO A 0 125 . 31.734 10.459 -33.860 1.00 48.91 125 A 1 ATOM 1045 C CA . PRO A 0 125 . 31.709 10.780 -35.281 1.00 48.91 125 A 1 ATOM 1046 C C . PRO A 0 125 . 32.994 11.508 -35.730 1.00 48.91 125 A 1 ATOM 1047 C CB . PRO A 0 125 . 30.437 11.611 -35.498 1.00 48.91 125 A 1 ATOM 1048 O O . PRO A 0 125 . 33.098 11.885 -36.897 1.00 48.91 125 A 1 ATOM 1049 C CG . PRO A 0 125 . 29.883 11.925 -34.104 1.00 48.91 125 A 1 ATOM 1050 C CD . PRO A 0 125 . 30.926 11.409 -33.119 1.00 48.91 125 A 1 ATOM 1051 N N . TYR A 0 126 . 33.947 11.730 -34.816 1.00 54.34 126 A 1 ATOM 1052 C CA . TYR A 0 126 . 35.151 12.538 -34.978 1.00 54.34 126 A 1 ATOM 1053 C C . TYR A 0 126 . 36.454 11.843 -34.513 1.00 54.34 126 A 1 ATOM 1054 C CB . TYR A 0 126 . 34.935 13.885 -34.262 1.00 54.34 126 A 1 ATOM 1055 O O . TYR A 0 126 . 37.480 12.525 -34.415 1.00 54.34 126 A 1 ATOM 1056 C CG . TYR A 0 126 . 33.714 14.661 -34.722 1.00 54.34 126 A 1 ATOM 1057 C CD1 . TYR A 0 126 . 33.740 15.314 -35.969 1.00 54.34 126 A 1 ATOM 1058 C CD2 . TYR A 0 126 . 32.561 14.730 -33.917 1.00 54.34 126 A 1 ATOM 1059 C CE1 . TYR A 0 126 . 32.620 16.040 -36.412 1.00 54.34 126 A 1 ATOM 1060 C CE2 . TYR A 0 126 . 31.434 15.453 -34.357 1.00 54.34 126 A 1 ATOM 1061 O OH . TYR A 0 126 . 30.382 16.810 -36.033 1.00 54.34 126 A 1 ATOM 1062 C CZ . TYR A 0 126 . 31.465 16.109 -35.605 1.00 54.34 126 A 1 ATOM 1063 N N . LYS A 0 127 . 36.460 10.517 -34.289 1.00 41.78 127 A 1 ATOM 1064 C CA . LYS A 0 127 . 37.686 9.698 -34.141 1.00 41.78 127 A 1 ATOM 1065 C C . LYS A 0 127 . 37.870 8.701 -35.273 1.00 41.78 127 A 1 ATOM 1066 C CB . LYS A 0 127 . 37.743 8.953 -32.801 1.00 41.78 127 A 1 ATOM 1067 O O . LYS A 0 127 . 36.861 8.131 -35.736 1.00 41.78 127 A 1 ATOM 1068 C CG . LYS A 0 127 . 38.645 9.663 -31.790 1.00 41.78 127 A 1 ATOM 1069 C CD . LYS A 0 127 . 38.624 8.876 -30.481 1.00 41.78 127 A 1 ATOM 1070 C CE . LYS A 0 127 . 39.461 9.598 -29.432 1.00 41.78 127 A 1 ATOM 1071 N NZ . LYS A 0 127 . 39.332 8.916 -28.127 1.00 41.78 127 A 1 ATOM 1072 O OXT . LYS A 0 127 . 39.060 8.492 -35.590 1.00 41.78 127 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 84.94 # loop_ _atom_type.symbol C N O S #