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 ASN 0 3 ASP 0 4 ASP 0 5 ASP 0 6 HIS 0 7 ASP 0 8 THR 0 9 MET 0 10 MET 0 11 ILE 0 12 ASP 0 13 LEU 0 14 LEU 0 15 PHE 0 16 ILE 0 17 LEU 0 18 TYR 0 19 TYR 0 20 ILE 0 21 PHE 0 22 LEU 0 23 PRO 0 24 ILE 0 25 ILE 0 26 TYR 0 27 GLU 0 28 TYR 0 29 GLU 0 30 PRO 0 31 ASP 0 32 LEU 0 33 ILE 0 34 TYR 0 35 LEU 0 36 TRP 0 37 ASN 0 38 GLY 0 39 SER 0 40 ASN 0 41 TYR 0 42 GLN 0 43 MET 0 44 LYS 0 45 ASN 0 46 GLU 0 47 SER 0 48 ILE 0 49 SER 0 50 SER 0 51 ASP 0 52 ILE 0 53 LEU 0 54 ALA 0 55 ARG 0 56 ILE 0 57 ILE 0 58 TYR 0 59 LEU 0 60 LEU 0 61 ASN 0 62 GLY 0 63 LEU 0 64 GLY 0 65 LYS 0 66 PRO 0 67 VAL 0 68 LEU 0 69 ILE 0 70 ASN 0 71 GLY 0 72 SER 0 73 SER 0 74 ILE 0 75 ASN 0 76 GLU 0 77 LEU 0 78 SER 0 79 SER 0 80 ILE 0 81 SER 0 82 PHE 0 83 ILE 0 84 GLN 0 85 SER 0 86 LEU 0 87 GLN 0 88 GLY 0 89 LYS 0 90 PRO 0 91 ILE 0 92 SER 0 93 ILE 0 94 GLY 0 95 PHE 0 96 ASN 0 97 GLU 0 98 LEU 0 99 ILE 0 100 GLN 0 101 THR 0 102 SER 0 103 PRO 0 104 SER 0 105 SER 0 106 LYS 0 107 MET 0 108 LYS 0 109 HIS 0 110 ILE 0 111 ILE 0 112 GLN 0 113 LEU 0 114 ILE 0 115 ILE 0 116 GLN 0 117 GLN 0 118 ASN 0 119 HIS 0 120 GLN 0 121 ARG 0 122 TRP 0 123 LYS 0 124 CYS 0 125 LEU 0 126 GLY 0 127 GLN 0 128 PHE # 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 . 18.452 0.196 -13.509 1.00 48.70 1 A 1 ATOM 2 C CA . MET A 0 1 . 17.121 -0.432 -13.473 1.00 48.70 1 A 1 ATOM 3 C C . MET A 0 1 . 16.505 -0.171 -14.826 1.00 48.70 1 A 1 ATOM 4 C CB . MET A 0 1 . 16.274 0.158 -12.334 1.00 48.70 1 A 1 ATOM 5 O O . MET A 0 1 . 16.619 0.961 -15.283 1.00 48.70 1 A 1 ATOM 6 C CG . MET A 0 1 . 15.903 -0.911 -11.305 1.00 48.70 1 A 1 ATOM 7 S SD . MET A 0 1 . 16.060 -0.351 -9.591 1.00 48.70 1 A 1 ATOM 8 C CE . MET A 0 1 . 14.639 -1.214 -8.866 1.00 48.70 1 A 1 ATOM 9 N N . ASN A 0 2 . 15.998 -1.200 -15.500 1.00 55.38 2 A 1 ATOM 10 C CA . ASN A 0 2 . 15.287 -0.992 -16.762 1.00 55.38 2 A 1 ATOM 11 C C . ASN A 0 2 . 13.931 -0.342 -16.444 1.00 55.38 2 A 1 ATOM 12 C CB . ASN A 0 2 . 15.163 -2.342 -17.490 1.00 55.38 2 A 1 ATOM 13 O O . ASN A 0 2 . 13.416 -0.556 -15.346 1.00 55.38 2 A 1 ATOM 14 C CG . ASN A 0 2 . 16.495 -2.898 -17.977 1.00 55.38 2 A 1 ATOM 15 N ND2 . ASN A 0 2 . 16.540 -4.170 -18.297 1.00 55.38 2 A 1 ATOM 16 O OD1 . ASN A 0 2 . 17.509 -2.222 -18.076 1.00 55.38 2 A 1 ATOM 17 N N . ASP A 0 3 . 13.363 0.445 -17.361 1.00 57.80 3 A 1 ATOM 18 C CA . ASP A 0 3 . 12.068 1.118 -17.135 1.00 57.80 3 A 1 ATOM 19 C C . ASP A 0 3 . 10.972 0.114 -16.709 1.00 57.80 3 A 1 ATOM 20 C CB . ASP A 0 3 . 11.666 1.909 -18.396 1.00 57.80 3 A 1 ATOM 21 O O . ASP A 0 3 . 10.210 0.380 -15.778 1.00 57.80 3 A 1 ATOM 22 C CG . ASP A 0 3 . 12.555 3.135 -18.667 1.00 57.80 3 A 1 ATOM 23 O OD1 . ASP A 0 3 . 13.088 3.713 -17.692 1.00 57.80 3 A 1 ATOM 24 O OD2 . ASP A 0 3 . 12.735 3.472 -19.859 1.00 57.80 3 A 1 ATOM 25 N N . ASP A 0 4 . 11.012 -1.105 -17.260 1.00 63.05 4 A 1 ATOM 26 C CA . ASP A 0 4 . 10.122 -2.219 -16.901 1.00 63.05 4 A 1 ATOM 27 C C . ASP A 0 4 . 10.177 -2.614 -15.409 1.00 63.05 4 A 1 ATOM 28 C CB . ASP A 0 4 . 10.496 -3.454 -17.743 1.00 63.05 4 A 1 ATOM 29 O O . ASP A 0 4 . 9.155 -2.984 -14.820 1.00 63.05 4 A 1 ATOM 30 C CG . ASP A 0 4 . 10.238 -3.318 -19.249 1.00 63.05 4 A 1 ATOM 31 O OD1 . ASP A 0 4 . 9.376 -2.506 -19.644 1.00 63.05 4 A 1 ATOM 32 O OD2 . ASP A 0 4 . 10.923 -4.048 -20.004 1.00 63.05 4 A 1 ATOM 33 N N . ASP A 0 5 . 11.349 -2.532 -14.763 1.00 68.55 5 A 1 ATOM 34 C CA . ASP A 0 5 . 11.500 -2.878 -13.341 1.00 68.55 5 A 1 ATOM 35 C C . ASP A 0 5 . 10.806 -1.838 -12.450 1.00 68.55 5 A 1 ATOM 36 C CB . ASP A 0 5 . 12.981 -2.955 -12.926 1.00 68.55 5 A 1 ATOM 37 O O . ASP A 0 5 . 10.161 -2.185 -11.456 1.00 68.55 5 A 1 ATOM 38 C CG . ASP A 0 5 . 13.789 -4.113 -13.514 1.00 68.55 5 A 1 ATOM 39 O OD1 . ASP A 0 5 . 13.226 -5.214 -13.697 1.00 68.55 5 A 1 ATOM 40 O OD2 . ASP A 0 5 . 15.013 -3.887 -13.712 1.00 68.55 5 A 1 ATOM 41 N N . HIS A 0 6 . 10.922 -0.553 -12.807 1.00 69.54 6 A 1 ATOM 42 C CA . HIS A 0 6 . 10.267 0.536 -12.081 1.00 69.54 6 A 1 ATOM 43 C C . HIS A 0 6 . 8.749 0.465 -12.216 1.00 69.54 6 A 1 ATOM 44 C CB . HIS A 0 6 . 10.786 1.895 -12.573 1.00 69.54 6 A 1 ATOM 45 O O . HIS A 0 6 . 8.036 0.636 -11.224 1.00 69.54 6 A 1 ATOM 46 C CG . HIS A 0 6 . 12.038 2.326 -11.861 1.00 69.54 6 A 1 ATOM 47 C CD2 . HIS A 0 6 . 13.269 2.549 -12.415 1.00 69.54 6 A 1 ATOM 48 N ND1 . HIS A 0 6 . 12.147 2.564 -10.510 1.00 69.54 6 A 1 ATOM 49 C CE1 . HIS A 0 6 . 13.418 2.908 -10.250 1.00 69.54 6 A 1 ATOM 50 N NE2 . HIS A 0 6 . 14.144 2.913 -11.379 1.00 69.54 6 A 1 ATOM 51 N N . ASP A 0 7 . 8.267 0.158 -13.415 1.00 72.97 7 A 1 ATOM 52 C CA . ASP A 0 7 . 6.846 0.008 -13.691 1.00 72.97 7 A 1 ATOM 53 C C . ASP A 0 7 . 6.247 -1.205 -12.966 1.00 72.97 7 A 1 ATOM 54 C CB . ASP A 0 7 . 6.663 -0.068 -15.211 1.00 72.97 7 A 1 ATOM 55 O O . ASP A 0 7 . 5.183 -1.102 -12.347 1.00 72.97 7 A 1 ATOM 56 C CG . ASP A 0 7 . 6.743 1.300 -15.905 1.00 72.97 7 A 1 ATOM 57 O OD1 . ASP A 0 7 . 6.504 2.322 -15.215 1.00 72.97 7 A 1 ATOM 58 O OD2 . ASP A 0 7 . 6.898 1.316 -17.145 1.00 72.97 7 A 1 ATOM 59 N N . THR A 0 8 . 6.966 -2.330 -12.931 1.00 78.19 8 A 1 ATOM 60 C CA . THR A 0 8 . 6.556 -3.513 -12.158 1.00 78.19 8 A 1 ATOM 61 C C . THR A 0 8 . 6.500 -3.206 -10.659 1.00 78.19 8 A 1 ATOM 62 C CB . THR A 0 8 . 7.500 -4.696 -12.414 1.00 78.19 8 A 1 ATOM 63 O O . THR A 0 8 . 5.512 -3.527 -9.994 1.00 78.19 8 A 1 ATOM 64 C CG2 . THR A 0 8 . 7.019 -5.973 -11.718 1.00 78.19 8 A 1 ATOM 65 O OG1 . THR A 0 8 . 7.550 -4.989 -13.789 1.00 78.19 8 A 1 ATOM 66 N N . MET A 0 9 . 7.522 -2.528 -10.120 1.00 80.51 9 A 1 ATOM 67 C CA . MET A 0 9 . 7.552 -2.116 -8.713 1.00 80.51 9 A 1 ATOM 68 C C . MET A 0 9 . 6.394 -1.171 -8.374 1.00 80.51 9 A 1 ATOM 69 C CB . MET A 0 9 . 8.898 -1.445 -8.401 1.00 80.51 9 A 1 ATOM 70 O O . MET A 0 9 . 5.772 -1.298 -7.318 1.00 80.51 9 A 1 ATOM 71 C CG . MET A 0 9 . 9.041 -1.132 -6.906 1.00 80.51 9 A 1 ATOM 72 S SD . MET A 0 9 . 10.606 -0.342 -6.440 1.00 80.51 9 A 1 ATOM 73 C CE . MET A 0 9 . 10.255 1.379 -6.875 1.00 80.51 9 A 1 ATOM 74 N N . MET A 0 10 . 6.081 -0.236 -9.271 1.00 82.05 10 A 1 ATOM 75 C CA . MET A 0 10 . 4.958 0.682 -9.113 1.00 82.05 10 A 1 ATOM 76 C C . MET A 0 10 . 3.627 -0.070 -9.044 1.00 82.05 10 A 1 ATOM 77 C CB . MET A 0 10 . 4.966 1.675 -10.279 1.00 82.05 10 A 1 ATOM 78 O O . MET A 0 10 . 2.804 0.236 -8.182 1.00 82.05 10 A 1 ATOM 79 C CG . MET A 0 10 . 3.804 2.670 -10.190 1.00 82.05 10 A 1 ATOM 80 S SD . MET A 0 10 . 3.746 3.888 -11.526 1.00 82.05 10 A 1 ATOM 81 C CE . MET A 0 10 . 3.708 2.801 -12.980 1.00 82.05 10 A 1 ATOM 82 N N . ILE A 0 11 . 3.406 -1.054 -9.916 1.00 86.39 11 A 1 ATOM 83 C CA . ILE A 0 11 . 2.170 -1.844 -9.908 1.00 86.39 11 A 1 ATOM 84 C C . ILE A 0 11 . 2.058 -2.666 -8.633 1.00 86.39 11 A 1 ATOM 85 C CB . ILE A 0 11 . 2.066 -2.687 -11.191 1.00 86.39 11 A 1 ATOM 86 O O . ILE A 0 11 . 1.013 -2.639 -7.985 1.00 86.39 11 A 1 ATOM 87 C CG1 . ILE A 0 11 . 1.768 -1.672 -12.316 1.00 86.39 11 A 1 ATOM 88 C CG2 . ILE A 0 11 . 0.979 -3.780 -11.099 1.00 86.39 11 A 1 ATOM 89 C CD1 . ILE A 0 11 . 1.492 -2.308 -13.660 1.00 86.39 11 A 1 ATOM 90 N N . ASP A 0 12 . 3.135 -3.320 -8.213 1.00 89.06 12 A 1 ATOM 91 C CA . ASP A 0 12 . 3.163 -4.053 -6.950 1.00 89.06 12 A 1 ATOM 92 C C . ASP A 0 12 . 2.830 -3.144 -5.752 1.00 89.06 12 A 1 ATOM 93 C CB . ASP A 0 12 . 4.539 -4.730 -6.809 1.00 89.06 12 A 1 ATOM 94 O O . ASP A 0 12 . 2.011 -3.510 -4.902 1.00 89.06 12 A 1 ATOM 95 C CG . ASP A 0 12 . 4.626 -6.093 -7.505 1.00 89.06 12 A 1 ATOM 96 O OD1 . ASP A 0 12 . 3.617 -6.558 -8.078 1.00 89.06 12 A 1 ATOM 97 O OD2 . ASP A 0 12 . 5.659 -6.783 -7.349 1.00 89.06 12 A 1 ATOM 98 N N . LEU A 0 13 . 3.390 -1.928 -5.717 1.00 88.19 13 A 1 ATOM 99 C CA . LEU A 0 13 . 3.086 -0.922 -4.696 1.00 88.19 13 A 1 ATOM 100 C C . LEU A 0 13 . 1.627 -0.458 -4.736 1.00 88.19 13 A 1 ATOM 101 C CB . LEU A 0 13 . 4.033 0.281 -4.843 1.00 88.19 13 A 1 ATOM 102 O O . LEU A 0 13 . 0.998 -0.319 -3.689 1.00 88.19 13 A 1 ATOM 103 C CG . LEU A 0 13 . 5.391 0.069 -4.154 1.00 88.19 13 A 1 ATOM 104 C CD1 . LEU A 0 13 . 6.364 1.161 -4.589 1.00 88.19 13 A 1 ATOM 105 C CD2 . LEU A 0 13 . 5.267 0.144 -2.627 1.00 88.19 13 A 1 ATOM 106 N N . LEU A 0 14 . 1.059 -0.239 -5.921 1.00 87.92 14 A 1 ATOM 107 C CA . LEU A 0 14 . -0.346 0.141 -6.049 1.00 87.92 14 A 1 ATOM 108 C C . LEU A 0 14 . -1.267 -0.976 -5.563 1.00 87.92 14 A 1 ATOM 109 C CB . LEU A 0 14 . -0.652 0.514 -7.505 1.00 87.92 14 A 1 ATOM 110 O O . LEU A 0 14 . -2.215 -0.705 -4.832 1.00 87.92 14 A 1 ATOM 111 C CG . LEU A 0 14 . -0.049 1.864 -7.920 1.00 87.92 14 A 1 ATOM 112 C CD1 . LEU A 0 14 . -0.151 2.010 -9.433 1.00 87.92 14 A 1 ATOM 113 C CD2 . LEU A 0 14 . -0.780 3.047 -7.280 1.00 87.92 14 A 1 ATOM 114 N N . PHE A 0 15 . -0.978 -2.232 -5.907 1.00 92.26 15 A 1 ATOM 115 C CA . PHE A 0 15 . -1.788 -3.364 -5.467 1.00 92.26 15 A 1 ATOM 116 C C . PHE A 0 15 . -1.768 -3.524 -3.946 1.00 92.26 15 A 1 ATOM 117 C CB . PHE A 0 15 . -1.352 -4.645 -6.191 1.00 92.26 15 A 1 ATOM 118 O O . PHE A 0 15 . -2.834 -3.641 -3.343 1.00 92.26 15 A 1 ATOM 119 C CG . PHE A 0 15 . -2.157 -4.898 -7.450 1.00 92.26 15 A 1 ATOM 120 C CD1 . PHE A 0 15 . -3.258 -5.774 -7.413 1.00 92.26 15 A 1 ATOM 121 C CD2 . PHE A 0 15 . -1.850 -4.228 -8.648 1.00 92.26 15 A 1 ATOM 122 C CE1 . PHE A 0 15 . -4.047 -5.972 -8.562 1.00 92.26 15 A 1 ATOM 123 C CE2 . PHE A 0 15 . -2.636 -4.421 -9.796 1.00 92.26 15 A 1 ATOM 124 C CZ . PHE A 0 15 . -3.744 -5.283 -9.752 1.00 92.26 15 A 1 ATOM 125 N N . ILE A 0 16 . -0.605 -3.464 -3.291 1.00 92.71 16 A 1 ATOM 126 C CA . ILE A 0 16 . -0.588 -3.521 -1.822 1.00 92.71 16 A 1 ATOM 127 C C . ILE A 0 16 . -1.294 -2.303 -1.204 1.00 92.71 16 A 1 ATOM 128 C CB . ILE A 0 16 . 0.840 -3.748 -1.286 1.00 92.71 16 A 1 ATOM 129 O O . ILE A 0 16 . -1.982 -2.441 -0.192 1.00 92.71 16 A 1 ATOM 130 C CG1 . ILE A 0 16 . 0.791 -4.230 0.176 1.00 92.71 16 A 1 ATOM 131 C CG2 . ILE A 0 16 . 1.736 -2.516 -1.450 1.00 92.71 16 A 1 ATOM 132 C CD1 . ILE A 0 16 . 2.148 -4.707 0.708 1.00 92.71 16 A 1 ATOM 133 N N . LEU A 0 17 . -1.212 -1.126 -1.835 1.00 91.85 17 A 1 ATOM 134 C CA . LEU A 0 17 . -1.926 0.063 -1.374 1.00 91.85 17 A 1 ATOM 135 C C . LEU A 0 17 . -3.447 -0.110 -1.456 1.00 91.85 17 A 1 ATOM 136 C CB . LEU A 0 17 . -1.416 1.307 -2.119 1.00 91.85 17 A 1 ATOM 137 O O . LEU A 0 17 . -4.134 0.188 -0.485 1.00 91.85 17 A 1 ATOM 138 C CG . LEU A 0 17 . -1.641 2.604 -1.313 1.00 91.85 17 A 1 ATOM 139 C CD1 . LEU A 0 17 . -0.305 3.288 -1.018 1.00 91.85 17 A 1 ATOM 140 C CD2 . LEU A 0 17 . -2.516 3.591 -2.077 1.00 91.85 17 A 1 ATOM 141 N N . TYR A 0 18 . -3.968 -0.648 -2.559 1.00 91.92 18 A 1 ATOM 142 C CA . TYR A 0 18 . -5.405 -0.862 -2.749 1.00 91.92 18 A 1 ATOM 143 C C . TYR A 0 18 . -5.982 -2.003 -1.912 1.00 91.92 18 A 1 ATOM 144 C CB . TYR A 0 18 . -5.709 -1.103 -4.233 1.00 91.92 18 A 1 ATOM 145 O O . TYR A 0 18 . -7.084 -1.862 -1.392 1.00 91.92 18 A 1 ATOM 146 C CG . TYR A 0 18 . -5.779 0.167 -5.055 1.00 91.92 18 A 1 ATOM 147 C CD1 . TYR A 0 18 . -6.805 1.098 -4.801 1.00 91.92 18 A 1 ATOM 148 C CD2 . TYR A 0 18 . -4.852 0.408 -6.086 1.00 91.92 18 A 1 ATOM 149 C CE1 . TYR A 0 18 . -6.891 2.277 -5.562 1.00 91.92 18 A 1 ATOM 150 C CE2 . TYR A 0 18 . -4.929 1.588 -6.847 1.00 91.92 18 A 1 ATOM 151 O OH . TYR A 0 18 . -6.059 3.642 -7.344 1.00 91.92 18 A 1 ATOM 152 C CZ . TYR A 0 18 . -5.955 2.522 -6.586 1.00 91.92 18 A 1 ATOM 153 N N . TYR A 0 19 . -5.272 -3.125 -1.784 1.00 94.03 19 A 1 ATOM 154 C CA . TYR A 0 19 . -5.817 -4.314 -1.120 1.00 94.03 19 A 1 ATOM 155 C C . TYR A 0 19 . -5.542 -4.359 0.381 1.00 94.03 19 A 1 ATOM 156 C CB . TYR A 0 19 . -5.302 -5.579 -1.815 1.00 94.03 19 A 1 ATOM 157 O O . TYR A 0 19 . -6.283 -5.013 1.109 1.00 94.03 19 A 1 ATOM 158 C CG . TYR A 0 19 . -6.005 -5.854 -3.130 1.00 94.03 19 A 1 ATOM 159 C CD1 . TYR A 0 19 . -7.239 -6.533 -3.128 1.00 94.03 19 A 1 ATOM 160 C CD2 . TYR A 0 19 . -5.463 -5.398 -4.346 1.00 94.03 19 A 1 ATOM 161 C CE1 . TYR A 0 19 . -7.911 -6.777 -4.341 1.00 94.03 19 A 1 ATOM 162 C CE2 . TYR A 0 19 . -6.146 -5.610 -5.555 1.00 94.03 19 A 1 ATOM 163 O OH . TYR A 0 19 . -8.014 -6.537 -6.727 1.00 94.03 19 A 1 ATOM 164 C CZ . TYR A 0 19 . -7.365 -6.316 -5.555 1.00 94.03 19 A 1 ATOM 165 N N . ILE A 0 20 . -4.488 -3.686 0.852 1.00 95.53 20 A 1 ATOM 166 C CA . ILE A 0 20 . -4.088 -3.724 2.262 1.00 95.53 20 A 1 ATOM 167 C C . ILE A 0 20 . -4.226 -2.346 2.896 1.00 95.53 20 A 1 ATOM 168 C CB . ILE A 0 20 . -2.663 -4.301 2.421 1.00 95.53 20 A 1 ATOM 169 O O . ILE A 0 20 . -5.006 -2.174 3.828 1.00 95.53 20 A 1 ATOM 170 C CG1 . ILE A 0 20 . -2.480 -5.690 1.767 1.00 95.53 20 A 1 ATOM 171 C CG2 . ILE A 0 20 . -2.246 -4.338 3.899 1.00 95.53 20 A 1 ATOM 172 C CD1 . ILE A 0 20 . -3.423 -6.791 2.267 1.00 95.53 20 A 1 ATOM 173 N N . PHE A 0 21 . -3.472 -1.356 2.414 1.00 94.07 21 A 1 ATOM 174 C CA . PHE A 0 21 . -3.331 -0.103 3.154 1.00 94.07 21 A 1 ATOM 175 C C . PHE A 0 21 . -4.598 0.745 3.139 1.00 94.07 21 A 1 ATOM 176 C CB . PHE A 0 21 . -2.117 0.691 2.668 1.00 94.07 21 A 1 ATOM 177 O O . PHE A 0 21 . -5.042 1.151 4.205 1.00 94.07 21 A 1 ATOM 178 C CG . PHE A 0 21 . -0.787 0.046 3.009 1.00 94.07 21 A 1 ATOM 179 C CD1 . PHE A 0 21 . -0.376 -0.010 4.354 1.00 94.07 21 A 1 ATOM 180 C CD2 . PHE A 0 21 . 0.049 -0.481 2.006 1.00 94.07 21 A 1 ATOM 181 C CE1 . PHE A 0 21 . 0.860 -0.588 4.692 1.00 94.07 21 A 1 ATOM 182 C CE2 . PHE A 0 21 . 1.288 -1.051 2.343 1.00 94.07 21 A 1 ATOM 183 C CZ . PHE A 0 21 . 1.693 -1.106 3.686 1.00 94.07 21 A 1 ATOM 184 N N . LEU A 0 22 . -5.203 1.001 1.977 1.00 93.04 22 A 1 ATOM 185 C CA . LEU A 0 22 . -6.400 1.838 1.883 1.00 93.04 22 A 1 ATOM 186 C C . LEU A 0 22 . -7.569 1.279 2.712 1.00 93.04 22 A 1 ATOM 187 C CB . LEU A 0 22 . -6.787 2.099 0.412 1.00 93.04 22 A 1 ATOM 188 O O . LEU A 0 22 . -8.097 2.044 3.516 1.00 93.04 22 A 1 ATOM 189 C CG . LEU A 0 22 . -5.912 3.132 -0.317 1.00 93.04 22 A 1 ATOM 190 C CD1 . LEU A 0 22 . -6.332 3.195 -1.787 1.00 93.04 22 A 1 ATOM 191 C CD2 . LEU A 0 22 . -6.054 4.541 0.261 1.00 93.04 22 A 1 ATOM 192 N N . PRO A 0 23 . -7.942 -0.016 2.624 1.00 94.16 23 A 1 ATOM 193 C CA . PRO A 0 23 . -9.003 -0.577 3.461 1.00 94.16 23 A 1 ATOM 194 C C . PRO A 0 23 . -8.731 -0.403 4.958 1.00 94.16 23 A 1 ATOM 195 C CB . PRO A 0 23 . -9.095 -2.057 3.074 1.00 94.16 23 A 1 ATOM 196 O O . PRO A 0 23 . -9.613 0.030 5.697 1.00 94.16 23 A 1 ATOM 197 C CG . PRO A 0 23 . -8.580 -2.084 1.640 1.00 94.16 23 A 1 ATOM 198 C CD . PRO A 0 23 . -7.502 -1.008 1.653 1.00 94.16 23 A 1 ATOM 199 N N . ILE A 0 24 . -7.492 -0.662 5.391 1.00 95.48 24 A 1 ATOM 200 C CA . ILE A 0 24 . -7.091 -0.488 6.790 1.00 95.48 24 A 1 ATOM 201 C C . ILE A 0 24 . -7.141 0.986 7.195 1.00 95.48 24 A 1 ATOM 202 C CB . ILE A 0 24 . -5.690 -1.088 7.027 1.00 95.48 24 A 1 ATOM 203 O O . ILE A 0 24 . -7.608 1.295 8.283 1.00 95.48 24 A 1 ATOM 204 C CG1 . ILE A 0 24 . -5.724 -2.626 6.873 1.00 95.48 24 A 1 ATOM 205 C CG2 . ILE A 0 24 . -5.148 -0.715 8.421 1.00 95.48 24 A 1 ATOM 206 C CD1 . ILE A 0 24 . -4.318 -3.240 6.864 1.00 95.48 24 A 1 ATOM 207 N N . ILE A 0 25 . -6.683 1.908 6.346 1.00 94.83 25 A 1 ATOM 208 C CA . ILE A 0 25 . -6.705 3.347 6.631 1.00 94.83 25 A 1 ATOM 209 C C . ILE A 0 25 . -8.147 3.852 6.748 1.00 94.83 25 A 1 ATOM 210 C CB . ILE A 0 25 . -5.901 4.126 5.565 1.00 94.83 25 A 1 ATOM 211 O O . ILE A 0 25 . -8.432 4.636 7.651 1.00 94.83 25 A 1 ATOM 212 C CG1 . ILE A 0 25 . -4.384 3.846 5.683 1.00 94.83 25 A 1 ATOM 213 C CG2 . ILE A 0 25 . -6.127 5.638 5.724 1.00 94.83 25 A 1 ATOM 214 C CD1 . ILE A 0 25 . -3.595 4.226 4.419 1.00 94.83 25 A 1 ATOM 215 N N . TYR A 0 26 . -9.056 3.386 5.889 1.00 93.80 26 A 1 ATOM 216 C CA . TYR A 0 26 . -10.479 3.711 5.994 1.00 93.80 26 A 1 ATOM 217 C C . TYR A 0 26 . -11.124 3.115 7.251 1.00 93.80 26 A 1 ATOM 218 C CB . TYR A 0 26 . -11.233 3.248 4.739 1.00 93.80 26 A 1 ATOM 219 O O . TYR A 0 26 . -11.956 3.776 7.855 1.00 93.80 26 A 1 ATOM 220 C CG . TYR A 0 26 . -11.109 4.177 3.545 1.00 93.80 26 A 1 ATOM 221 C CD1 . TYR A 0 26 . -11.691 5.459 3.597 1.00 93.80 26 A 1 ATOM 222 C CD2 . TYR A 0 26 . -10.468 3.749 2.367 1.00 93.80 26 A 1 ATOM 223 C CE1 . TYR A 0 26 . -11.625 6.314 2.480 1.00 93.80 26 A 1 ATOM 224 C CE2 . TYR A 0 26 . -10.387 4.603 1.252 1.00 93.80 26 A 1 ATOM 225 O OH . TYR A 0 26 . -10.903 6.697 0.217 1.00 93.80 26 A 1 ATOM 226 C CZ . TYR A 0 26 . -10.974 5.883 1.303 1.00 93.80 26 A 1 ATOM 227 N N . GLU A 0 27 . -10.748 1.902 7.667 1.00 95.47 27 A 1 ATOM 228 C CA . GLU A 0 27 . -11.252 1.308 8.916 1.00 95.47 27 A 1 ATOM 229 C C . GLU A 0 27 . -10.660 1.980 10.167 1.00 95.47 27 A 1 ATOM 230 C CB . GLU A 0 27 . -10.992 -0.214 8.904 1.00 95.47 27 A 1 ATOM 231 O O . GLU A 0 27 . -11.342 2.110 11.180 1.00 95.47 27 A 1 ATOM 232 C CG . GLU A 0 27 . -11.592 -0.937 10.129 1.00 95.47 27 A 1 ATOM 233 C CD . GLU A 0 27 . -11.514 -2.476 10.071 1.00 95.47 27 A 1 ATOM 234 O OE1 . GLU A 0 27 . -11.783 -3.144 11.097 1.00 95.47 27 A 1 ATOM 235 O OE2 . GLU A 0 27 . -11.225 -3.057 9.002 1.00 95.47 27 A 1 ATOM 236 N N . TYR A 0 28 . -9.395 2.398 10.109 1.00 95.97 28 A 1 ATOM 237 C CA . TYR A 0 28 . -8.679 3.015 11.225 1.00 95.97 28 A 1 ATOM 238 C C . TYR A 0 28 . -9.005 4.505 11.412 1.00 95.97 28 A 1 ATOM 239 C CB . TYR A 0 28 . -7.170 2.803 11.015 1.00 95.97 28 A 1 ATOM 240 O O . TYR A 0 28 . -8.929 5.000 12.531 1.00 95.97 28 A 1 ATOM 241 C CG . TYR A 0 28 . -6.300 3.371 12.120 1.00 95.97 28 A 1 ATOM 242 C CD1 . TYR A 0 28 . -5.374 4.395 11.838 1.00 95.97 28 A 1 ATOM 243 C CD2 . TYR A 0 28 . -6.451 2.908 13.442 1.00 95.97 28 A 1 ATOM 244 C CE1 . TYR A 0 28 . -4.618 4.970 12.877 1.00 95.97 28 A 1 ATOM 245 C CE2 . TYR A 0 28 . -5.705 3.488 14.485 1.00 95.97 28 A 1 ATOM 246 O OH . TYR A 0 28 . -4.084 5.106 15.206 1.00 95.97 28 A 1 ATOM 247 C CZ . TYR A 0 28 . -4.796 4.529 14.203 1.00 95.97 28 A 1 ATOM 248 N N . GLU A 0 29 . -9.345 5.212 10.331 1.00 95.30 29 A 1 ATOM 249 C CA . GLU A 0 29 . -9.657 6.648 10.298 1.00 95.30 29 A 1 ATOM 250 C C . GLU A 0 29 . -8.603 7.554 10.976 1.00 95.30 29 A 1 ATOM 251 C CB . GLU A 0 29 . -11.078 6.927 10.820 1.00 95.30 29 A 1 ATOM 252 O O . GLU A 0 29 . -8.929 8.326 11.879 1.00 95.30 29 A 1 ATOM 253 C CG . GLU A 0 29 . -12.176 6.245 9.996 1.00 95.30 29 A 1 ATOM 254 C CD . GLU A 0 29 . -13.569 6.800 10.335 1.00 95.30 29 A 1 ATOM 255 O OE1 . GLU A 0 29 . -14.387 6.935 9.396 1.00 95.30 29 A 1 ATOM 256 O OE2 . GLU A 0 29 . -13.811 7.141 11.516 1.00 95.30 29 A 1 ATOM 257 N N . PRO A 0 30 . -7.331 7.539 10.534 1.00 95.44 30 A 1 ATOM 258 C CA . PRO A 0 30 . -6.299 8.367 11.152 1.00 95.44 30 A 1 ATOM 259 C C . PRO A 0 30 . -6.582 9.867 10.985 1.00 95.44 30 A 1 ATOM 260 C CB . PRO A 0 30 . -4.994 7.971 10.457 1.00 95.44 30 A 1 ATOM 261 O O . PRO A 0 30 . -7.078 10.312 9.948 1.00 95.44 30 A 1 ATOM 262 C CG . PRO A 0 30 . -5.453 7.512 9.074 1.00 95.44 30 A 1 ATOM 263 C CD . PRO A 0 30 . -6.819 6.878 9.343 1.00 95.44 30 A 1 ATOM 264 N N . ASP A 0 31 . -6.180 10.669 11.970 1.00 95.72 31 A 1 ATOM 265 C CA . ASP A 0 31 . -6.197 12.139 11.877 1.00 95.72 31 A 1 ATOM 266 C C . ASP A 0 31 . -4.971 12.712 11.154 1.00 95.72 31 A 1 ATOM 267 C CB . ASP A 0 31 . -6.301 12.741 13.282 1.00 95.72 31 A 1 ATOM 268 O O . ASP A 0 31 . -4.992 13.849 10.688 1.00 95.72 31 A 1 ATOM 269 C CG . ASP A 0 31 . -7.646 12.440 13.939 1.00 95.72 31 A 1 ATOM 270 O OD1 . ASP A 0 31 . -8.667 12.516 13.212 1.00 95.72 31 A 1 ATOM 271 O OD2 . ASP A 0 31 . -7.621 12.165 15.158 1.00 95.72 31 A 1 ATOM 272 N N . LEU A 0 32 . -3.899 11.925 11.048 1.00 94.30 32 A 1 ATOM 273 C CA . LEU A 0 32 . -2.654 12.287 10.379 1.00 94.30 32 A 1 ATOM 274 C C . LEU A 0 32 . -2.024 11.039 9.766 1.00 94.30 32 A 1 ATOM 275 C CB . LEU A 0 32 . -1.706 12.935 11.407 1.00 94.30 32 A 1 ATOM 276 O O . LEU A 0 32 . -1.901 10.007 10.426 1.00 94.30 32 A 1 ATOM 277 C CG . LEU A 0 32 . -0.315 13.314 10.861 1.00 94.30 32 A 1 ATOM 278 C CD1 . LEU A 0 32 . -0.378 14.462 9.855 1.00 94.30 32 A 1 ATOM 279 C CD2 . LEU A 0 32 . 0.597 13.751 12.006 1.00 94.30 32 A 1 ATOM 280 N N . ILE A 0 33 . -1.561 11.158 8.526 1.00 92.84 33 A 1 ATOM 281 C CA . ILE A 0 33 . -0.796 10.113 7.849 1.00 92.84 33 A 1 ATOM 282 C C . ILE A 0 33 . 0.666 10.541 7.819 1.00 92.84 33 A 1 ATOM 283 C CB . ILE A 0 33 . -1.371 9.833 6.448 1.00 92.84 33 A 1 ATOM 284 O O . ILE A 0 33 . 1.009 11.558 7.223 1.00 92.84 33 A 1 ATOM 285 C CG1 . ILE A 0 33 . -2.867 9.458 6.565 1.00 92.84 33 A 1 ATOM 286 C CG2 . ILE A 0 33 . -0.559 8.719 5.760 1.00 92.84 33 A 1 ATOM 287 C CD1 . ILE A 0 33 . -3.563 9.193 5.231 1.00 92.84 33 A 1 ATOM 288 N N . TYR A 0 34 . 1.536 9.763 8.457 1.00 91.73 34 A 1 ATOM 289 C CA . TYR A 0 34 . 2.978 9.975 8.395 1.00 91.73 34 A 1 ATOM 290 C C . TYR A 0 34 . 3.611 8.993 7.410 1.00 91.73 34 A 1 ATOM 291 C CB . TYR A 0 34 . 3.588 9.880 9.794 1.00 91.73 34 A 1 ATOM 292 O O . TYR A 0 34 . 3.662 7.790 7.662 1.00 91.73 34 A 1 ATOM 293 C CG . TYR A 0 34 . 5.086 10.110 9.807 1.00 91.73 34 A 1 ATOM 294 C CD1 . TYR A 0 34 . 5.962 9.058 10.131 1.00 91.73 34 A 1 ATOM 295 C CD2 . TYR A 0 34 . 5.605 11.375 9.477 1.00 91.73 34 A 1 ATOM 296 C CE1 . TYR A 0 34 . 7.351 9.284 10.164 1.00 91.73 34 A 1 ATOM 297 C CE2 . TYR A 0 34 . 6.992 11.612 9.516 1.00 91.73 34 A 1 ATOM 298 O OH . TYR A 0 34 . 9.206 10.776 9.942 1.00 91.73 34 A 1 ATOM 299 C CZ . TYR A 0 34 . 7.867 10.562 9.870 1.00 91.73 34 A 1 ATOM 300 N N . LEU A 0 35 . 4.094 9.513 6.284 1.00 87.27 35 A 1 ATOM 301 C CA . LEU A 0 35 . 4.844 8.761 5.288 1.00 87.27 35 A 1 ATOM 302 C C . LEU A 0 35 . 6.339 8.950 5.515 1.00 87.27 35 A 1 ATOM 303 C CB . LEU A 0 35 . 4.451 9.217 3.877 1.00 87.27 35 A 1 ATOM 304 O O . LEU A 0 35 . 6.898 10.015 5.251 1.00 87.27 35 A 1 ATOM 305 C CG . LEU A 0 35 . 3.200 8.549 3.290 1.00 87.27 35 A 1 ATOM 306 C CD1 . LEU A 0 35 . 2.954 9.205 1.932 1.00 87.27 35 A 1 ATOM 307 C CD2 . LEU A 0 35 . 3.388 7.044 3.064 1.00 87.27 35 A 1 ATOM 308 N N . TRP A 0 36 . 7.006 7.887 5.948 1.00 83.84 36 A 1 ATOM 309 C CA . TRP A 0 36 . 8.459 7.848 5.982 1.00 83.84 36 A 1 ATOM 310 C C . TRP A 0 36 . 8.987 7.244 4.677 1.00 83.84 36 A 1 ATOM 311 C CB . TRP A 0 36 . 8.923 7.104 7.238 1.00 83.84 36 A 1 ATOM 312 O O . TRP A 0 36 . 8.938 6.034 4.479 1.00 83.84 36 A 1 ATOM 313 C CG . TRP A 0 36 . 10.395 7.136 7.526 1.00 83.84 36 A 1 ATOM 314 C CD1 . TRP A 0 36 . 11.385 7.464 6.665 1.00 83.84 36 A 1 ATOM 315 C CD2 . TRP A 0 36 . 11.071 6.908 8.798 1.00 83.84 36 A 1 ATOM 316 C CE2 . TRP A 0 36 . 12.480 7.017 8.593 1.00 83.84 36 A 1 ATOM 317 C CE3 . TRP A 0 36 . 10.635 6.669 10.117 1.00 83.84 36 A 1 ATOM 318 N NE1 . TRP A 0 36 . 12.613 7.332 7.266 1.00 83.84 36 A 1 ATOM 319 C CH2 . TRP A 0 36 . 12.942 6.634 10.928 1.00 83.84 36 A 1 ATOM 320 C CZ2 . TRP A 0 36 . 13.411 6.868 9.626 1.00 83.84 36 A 1 ATOM 321 C CZ3 . TRP A 0 36 . 11.559 6.545 11.172 1.00 83.84 36 A 1 ATOM 322 N N . ASN A 0 37 . 9.548 8.089 3.810 1.00 74.77 37 A 1 ATOM 323 C CA . ASN A 0 37 . 10.377 7.659 2.690 1.00 74.77 37 A 1 ATOM 324 C C . ASN A 0 37 . 11.854 7.633 3.112 1.00 74.77 37 A 1 ATOM 325 C CB . ASN A 0 37 . 10.123 8.561 1.478 1.00 74.77 37 A 1 ATOM 326 O O . ASN A 0 37 . 12.595 8.602 2.942 1.00 74.77 37 A 1 ATOM 327 C CG . ASN A 0 37 . 10.921 8.047 0.294 1.00 74.77 37 A 1 ATOM 328 N ND2 . ASN A 0 37 . 11.607 8.897 -0.425 1.00 74.77 37 A 1 ATOM 329 O OD1 . ASN A 0 37 . 10.951 6.859 0.024 1.00 74.77 37 A 1 ATOM 330 N N . GLY A 0 38 . 12.254 6.547 3.771 1.00 61.21 38 A 1 ATOM 331 C CA . GLY A 0 38 . 13.620 6.358 4.239 1.00 61.21 38 A 1 ATOM 332 C C . GLY A 0 38 . 14.386 5.514 3.243 1.00 61.21 38 A 1 ATOM 333 O O . GLY A 0 38 . 14.083 4.332 3.096 1.00 61.21 38 A 1 ATOM 334 N N . SER A 0 39 . 15.407 6.081 2.602 1.00 52.82 39 A 1 ATOM 335 C CA . SER A 0 39 . 16.415 5.265 1.936 1.00 52.82 39 A 1 ATOM 336 C C . SER A 0 39 . 17.131 4.438 3.004 1.00 52.82 39 A 1 ATOM 337 C CB . SER A 0 39 . 17.360 6.117 1.078 1.00 52.82 39 A 1 ATOM 338 O O . SER A 0 39 . 17.959 4.928 3.774 1.00 52.82 39 A 1 ATOM 339 O OG . SER A 0 39 . 17.987 7.158 1.799 1.00 52.82 39 A 1 ATOM 340 N N . ASN A 0 40 . 16.772 3.158 3.111 1.00 46.60 40 A 1 ATOM 341 C CA . ASN A 0 40 . 17.559 2.233 3.909 1.00 46.60 40 A 1 ATOM 342 C C . ASN A 0 40 . 18.969 2.241 3.312 1.00 46.60 40 A 1 ATOM 343 C CB . ASN A 0 40 . 16.914 0.830 3.922 1.00 46.60 40 A 1 ATOM 344 O O . ASN A 0 40 . 19.176 1.778 2.193 1.00 46.60 40 A 1 ATOM 345 C CG . ASN A 0 40 . 16.099 0.544 5.174 1.00 46.60 40 A 1 ATOM 346 N ND2 . ASN A 0 40 . 15.319 -0.510 5.168 1.00 46.60 40 A 1 ATOM 347 O OD1 . ASN A 0 40 . 16.196 1.212 6.189 1.00 46.60 40 A 1 ATOM 348 N N . TYR A 0 41 . 19.946 2.754 4.065 1.00 39.63 41 A 1 ATOM 349 C CA . TYR A 0 41 . 21.358 2.840 3.666 1.00 39.63 41 A 1 ATOM 350 C C . TYR A 0 41 . 21.943 1.505 3.157 1.00 39.63 41 A 1 ATOM 351 C CB . TYR A 0 41 . 22.175 3.345 4.869 1.00 39.63 41 A 1 ATOM 352 O O . TYR A 0 41 . 22.980 1.500 2.494 1.00 39.63 41 A 1 ATOM 353 C CG . TYR A 0 41 . 22.199 4.853 5.035 1.00 39.63 41 A 1 ATOM 354 C CD1 . TYR A 0 41 . 23.197 5.601 4.379 1.00 39.63 41 A 1 ATOM 355 C CD2 . TYR A 0 41 . 21.253 5.510 5.847 1.00 39.63 41 A 1 ATOM 356 C CE1 . TYR A 0 41 . 23.258 7.000 4.534 1.00 39.63 41 A 1 ATOM 357 C CE2 . TYR A 0 41 . 21.313 6.909 6.007 1.00 39.63 41 A 1 ATOM 358 O OH . TYR A 0 41 . 22.368 9.004 5.518 1.00 39.63 41 A 1 ATOM 359 C CZ . TYR A 0 41 . 22.313 7.656 5.353 1.00 39.63 41 A 1 ATOM 360 N N . GLN A 0 42 . 21.287 0.379 3.455 1.00 38.99 42 A 1 ATOM 361 C CA . GLN A 0 42 . 21.668 -0.960 3.009 1.00 38.99 42 A 1 ATOM 362 C C . GLN A 0 42 . 21.174 -1.326 1.600 1.00 38.99 42 A 1 ATOM 363 C CB . GLN A 0 42 . 21.189 -1.980 4.049 1.00 38.99 42 A 1 ATOM 364 O O . GLN A 0 42 . 21.775 -2.191 0.970 1.00 38.99 42 A 1 ATOM 365 C CG . GLN A 0 42 . 21.949 -1.808 5.376 1.00 38.99 42 A 1 ATOM 366 C CD . GLN A 0 42 . 21.620 -2.901 6.386 1.00 38.99 42 A 1 ATOM 367 N NE2 . GLN A 0 42 . 22.522 -3.212 7.291 1.00 38.99 42 A 1 ATOM 368 O OE1 . GLN A 0 42 . 20.558 -3.493 6.393 1.00 38.99 42 A 1 ATOM 369 N N . MET A 0 43 . 20.152 -0.654 1.064 1.00 43.91 43 A 1 ATOM 370 C CA . MET A 0 43 . 19.627 -0.896 -0.283 1.00 43.91 43 A 1 ATOM 371 C C . MET A 0 43 . 19.726 0.382 -1.111 1.00 43.91 43 A 1 ATOM 372 C CB . MET A 0 43 . 18.218 -1.509 -0.234 1.00 43.91 43 A 1 ATOM 373 O O . MET A 0 43 . 18.738 1.022 -1.452 1.00 43.91 43 A 1 ATOM 374 C CG . MET A 0 43 . 18.259 -2.847 0.516 1.00 43.91 43 A 1 ATOM 375 S SD . MET A 0 43 . 16.983 -4.035 0.049 1.00 43.91 43 A 1 ATOM 376 C CE . MET A 0 43 . 17.995 -5.338 -0.698 1.00 43.91 43 A 1 ATOM 377 N N . LYS A 0 44 . 20.967 0.753 -1.452 1.00 40.88 44 A 1 ATOM 378 C CA . LYS A 0 44 . 21.308 1.932 -2.273 1.00 40.88 44 A 1 ATOM 379 C C . LYS A 0 44 . 20.616 1.992 -3.648 1.00 40.88 44 A 1 ATOM 380 C CB . LYS A 0 44 . 22.836 2.001 -2.450 1.00 40.88 44 A 1 ATOM 381 O O . LYS A 0 44 . 20.710 3.022 -4.302 1.00 40.88 44 A 1 ATOM 382 C CG . LYS A 0 44 . 23.541 2.575 -1.213 1.00 40.88 44 A 1 ATOM 383 C CD . LYS A 0 44 . 25.054 2.650 -1.449 1.00 40.88 44 A 1 ATOM 384 C CE . LYS A 0 44 . 25.733 3.368 -0.279 1.00 40.88 44 A 1 ATOM 385 N NZ . LYS A 0 44 . 27.201 3.445 -0.477 1.00 40.88 44 A 1 ATOM 386 N N . ASN A 0 45 . 19.929 0.928 -4.068 1.00 44.76 45 A 1 ATOM 387 C CA . ASN A 0 45 . 19.304 0.811 -5.385 1.00 44.76 45 A 1 ATOM 388 C C . ASN A 0 45 . 17.763 0.758 -5.347 1.00 44.76 45 A 1 ATOM 389 C CB . ASN A 0 45 . 19.903 -0.414 -6.099 1.00 44.76 45 A 1 ATOM 390 O O . ASN A 0 45 . 17.159 0.635 -6.403 1.00 44.76 45 A 1 ATOM 391 C CG . ASN A 0 45 . 21.387 -0.305 -6.411 1.00 44.76 45 A 1 ATOM 392 N ND2 . ASN A 0 45 . 21.963 -1.355 -6.946 1.00 44.76 45 A 1 ATOM 393 O OD1 . ASN A 0 45 . 22.065 0.683 -6.187 1.00 44.76 45 A 1 ATOM 394 N N . GLU A 0 46 . 17.122 0.851 -4.176 1.00 51.81 46 A 1 ATOM 395 C CA . GLU A 0 46 . 15.655 0.727 -4.038 1.00 51.81 46 A 1 ATOM 396 C C . GLU A 0 46 . 14.997 2.024 -3.539 1.00 51.81 46 A 1 ATOM 397 C CB . GLU A 0 46 . 15.279 -0.480 -3.163 1.00 51.81 46 A 1 ATOM 398 O O . GLU A 0 46 . 13.992 2.006 -2.831 1.00 51.81 46 A 1 ATOM 399 C CG . GLU A 0 46 . 15.703 -1.828 -3.764 1.00 51.81 46 A 1 ATOM 400 C CD . GLU A 0 46 . 15.187 -3.033 -2.955 1.00 51.81 46 A 1 ATOM 401 O OE1 . GLU A 0 46 . 15.488 -4.174 -3.380 1.00 51.81 46 A 1 ATOM 402 O OE2 . GLU A 0 46 . 14.525 -2.827 -1.912 1.00 51.81 46 A 1 ATOM 403 N N . SER A 0 47 . 15.561 3.187 -3.873 1.00 57.80 47 A 1 ATOM 404 C CA . SER A 0 47 . 14.860 4.448 -3.627 1.00 57.80 47 A 1 ATOM 405 C C . SER A 0 47 . 13.618 4.506 -4.516 1.00 57.80 47 A 1 ATOM 406 C CB . SER A 0 47 . 15.768 5.653 -3.880 1.00 57.80 47 A 1 ATOM 407 O O . SER A 0 47 . 13.730 4.464 -5.745 1.00 57.80 47 A 1 ATOM 408 O OG . SER A 0 47 . 16.291 5.585 -5.191 1.00 57.80 47 A 1 ATOM 409 N N . ILE A 0 48 . 12.442 4.611 -3.897 1.00 66.52 48 A 1 ATOM 410 C CA . ILE A 0 48 . 11.180 4.837 -4.601 1.00 66.52 48 A 1 ATOM 411 C C . ILE A 0 48 . 11.331 6.112 -5.434 1.00 66.52 48 A 1 ATOM 412 C CB . ILE A 0 48 . 10.008 4.929 -3.597 1.00 66.52 48 A 1 ATOM 413 O O . ILE A 0 48 . 11.727 7.156 -4.911 1.00 66.52 48 A 1 ATOM 414 C CG1 . ILE A 0 48 . 9.874 3.614 -2.793 1.00 66.52 48 A 1 ATOM 415 C CG2 . ILE A 0 48 . 8.694 5.210 -4.337 1.00 66.52 48 A 1 ATOM 416 C CD1 . ILE A 0 48 . 8.845 3.681 -1.658 1.00 66.52 48 A 1 ATOM 417 N N . SER A 0 49 . 11.046 6.026 -6.736 1.00 72.92 49 A 1 ATOM 418 C CA . SER A 0 49 . 11.138 7.196 -7.606 1.00 72.92 49 A 1 ATOM 419 C C . SER A 0 49 . 10.149 8.271 -7.156 1.00 72.92 49 A 1 ATOM 420 C CB . SER A 0 49 . 10.948 6.833 -9.084 1.00 72.92 49 A 1 ATOM 421 O O . SER A 0 49 . 9.079 7.984 -6.606 1.00 72.92 49 A 1 ATOM 422 O OG . SER A 0 49 . 9.606 6.489 -9.360 1.00 72.92 49 A 1 ATOM 423 N N . SER A 0 50 . 10.490 9.531 -7.418 1.00 75.84 50 A 1 ATOM 424 C CA . SER A 0 50 . 9.626 10.665 -7.090 1.00 75.84 50 A 1 ATOM 425 C C . SER A 0 50 . 8.230 10.544 -7.708 1.00 75.84 50 A 1 ATOM 426 C CB . SER A 0 50 . 10.297 11.950 -7.559 1.00 75.84 50 A 1 ATOM 427 O O . SER A 0 50 . 7.249 10.974 -7.106 1.00 75.84 50 A 1 ATOM 428 O OG . SER A 0 50 . 10.584 11.923 -8.949 1.00 75.84 50 A 1 ATOM 429 N N . ASP A 0 51 . 8.125 9.899 -8.870 1.00 76.85 51 A 1 ATOM 430 C CA . ASP A 0 51 . 6.857 9.685 -9.565 1.00 76.85 51 A 1 ATOM 431 C C . ASP A 0 51 . 5.976 8.640 -8.877 1.00 76.85 51 A 1 ATOM 432 C CB . ASP A 0 51 . 7.144 9.289 -11.016 1.00 76.85 51 A 1 ATOM 433 O O . ASP A 0 51 . 4.762 8.826 -8.774 1.00 76.85 51 A 1 ATOM 434 C CG . ASP A 0 51 . 7.814 10.426 -11.793 1.00 76.85 51 A 1 ATOM 435 O OD1 . ASP A 0 51 . 7.569 11.611 -11.441 1.00 76.85 51 A 1 ATOM 436 O OD2 . ASP A 0 51 . 8.575 10.096 -12.721 1.00 76.85 51 A 1 ATOM 437 N N . ILE A 0 52 . 6.570 7.570 -8.340 1.00 78.33 52 A 1 ATOM 438 C CA . ILE A 0 52 . 5.829 6.589 -7.539 1.00 78.33 52 A 1 ATOM 439 C C . ILE A 0 52 . 5.334 7.246 -6.247 1.00 78.33 52 A 1 ATOM 440 C CB . ILE A 0 52 . 6.690 5.339 -7.268 1.00 78.33 52 A 1 ATOM 441 O O . ILE A 0 52 . 4.163 7.093 -5.894 1.00 78.33 52 A 1 ATOM 442 C CG1 . ILE A 0 52 . 6.993 4.583 -8.579 1.00 78.33 52 A 1 ATOM 443 C CG2 . ILE A 0 52 . 5.972 4.397 -6.282 1.00 78.33 52 A 1 ATOM 444 C CD1 . ILE A 0 52 . 8.062 3.492 -8.434 1.00 78.33 52 A 1 ATOM 445 N N . LEU A 0 53 . 6.182 8.034 -5.575 1.00 81.69 53 A 1 ATOM 446 C CA . LEU A 0 53 . 5.771 8.800 -4.394 1.00 81.69 53 A 1 ATOM 447 C C . LEU A 0 53 . 4.628 9.763 -4.711 1.00 81.69 53 A 1 ATOM 448 C CB . LEU A 0 53 . 6.961 9.582 -3.821 1.00 81.69 53 A 1 ATOM 449 O O . LEU A 0 53 . 3.647 9.793 -3.971 1.00 81.69 53 A 1 ATOM 450 C CG . LEU A 0 53 . 7.920 8.717 -2.997 1.00 81.69 53 A 1 ATOM 451 C CD1 . LEU A 0 53 . 9.221 9.476 -2.776 1.00 81.69 53 A 1 ATOM 452 C CD2 . LEU A 0 53 . 7.331 8.340 -1.633 1.00 81.69 53 A 1 ATOM 453 N N . ALA A 0 54 . 4.712 10.499 -5.823 1.00 83.66 54 A 1 ATOM 454 C CA . ALA A 0 54 . 3.654 11.407 -6.248 1.00 83.66 54 A 1 ATOM 455 C C . ALA A 0 54 . 2.310 10.674 -6.387 1.00 83.66 54 A 1 ATOM 456 C CB . ALA A 0 54 . 4.072 12.084 -7.559 1.00 83.66 54 A 1 ATOM 457 O O . ALA A 0 54 . 1.295 11.138 -5.868 1.00 83.66 54 A 1 ATOM 458 N N . ARG A 0 55 . 2.298 9.491 -7.015 1.00 83.32 55 A 1 ATOM 459 C CA . ARG A 0 55 . 1.086 8.664 -7.154 1.00 83.32 55 A 1 ATOM 460 C C . ARG A 0 55 . 0.527 8.206 -5.812 1.00 83.32 55 A 1 ATOM 461 C CB . ARG A 0 55 . 1.369 7.450 -8.041 1.00 83.32 55 A 1 ATOM 462 O O . ARG A 0 55 . -0.681 8.293 -5.608 1.00 83.32 55 A 1 ATOM 463 C CG . ARG A 0 55 . 1.598 7.825 -9.510 1.00 83.32 55 A 1 ATOM 464 C CD . ARG A 0 55 . 1.967 6.543 -10.258 1.00 83.32 55 A 1 ATOM 465 N NE . ARG A 0 55 . 2.388 6.784 -11.644 1.00 83.32 55 A 1 ATOM 466 N NH1 . ARG A 0 55 . 0.336 7.012 -12.663 1.00 83.32 55 A 1 ATOM 467 N NH2 . ARG A 0 55 . 2.184 6.869 -13.887 1.00 83.32 55 A 1 ATOM 468 C CZ . ARG A 0 55 . 1.629 6.887 -12.716 1.00 83.32 55 A 1 ATOM 469 N N . ILE A 0 56 . 1.387 7.756 -4.898 1.00 85.90 56 A 1 ATOM 470 C CA . ILE A 0 56 . 0.973 7.361 -3.544 1.00 85.90 56 A 1 ATOM 471 C C . ILE A 0 56 . 0.311 8.548 -2.835 1.00 85.90 56 A 1 ATOM 472 C CB . ILE A 0 56 . 2.177 6.801 -2.750 1.00 85.90 56 A 1 ATOM 473 O O . ILE A 0 56 . -0.786 8.411 -2.301 1.00 85.90 56 A 1 ATOM 474 C CG1 . ILE A 0 56 . 2.629 5.452 -3.357 1.00 85.90 56 A 1 ATOM 475 C CG2 . ILE A 0 56 . 1.824 6.629 -1.260 1.00 85.90 56 A 1 ATOM 476 C CD1 . ILE A 0 56 . 3.975 4.944 -2.822 1.00 85.90 56 A 1 ATOM 477 N N . ILE A 0 57 . 0.929 9.728 -2.883 1.00 87.53 57 A 1 ATOM 478 C CA . ILE A 0 57 . 0.407 10.944 -2.245 1.00 87.53 57 A 1 ATOM 479 C C . ILE A 0 57 . -0.926 11.355 -2.852 1.00 87.53 57 A 1 ATOM 480 C CB . ILE A 0 57 . 1.425 12.084 -2.385 1.00 87.53 57 A 1 ATOM 481 O O . ILE A 0 57 . -1.850 11.690 -2.121 1.00 87.53 57 A 1 ATOM 482 C CG1 . ILE A 0 57 . 2.675 11.729 -1.566 1.00 87.53 57 A 1 ATOM 483 C CG2 . ILE A 0 57 . 0.871 13.447 -1.927 1.00 87.53 57 A 1 ATOM 484 C CD1 . ILE A 0 57 . 3.887 12.498 -2.069 1.00 87.53 57 A 1 ATOM 485 N N . TYR A 0 58 . -1.054 11.299 -4.175 1.00 87.09 58 A 1 ATOM 486 C CA . TYR A 0 58 . -2.310 11.619 -4.842 1.00 87.09 58 A 1 ATOM 487 C C . TYR A 0 58 . -3.454 10.706 -4.392 1.00 87.09 58 A 1 ATOM 488 C CB . TYR A 0 58 . -2.087 11.562 -6.346 1.00 87.09 58 A 1 ATOM 489 O O . TYR A 0 58 . -4.550 11.196 -4.127 1.00 87.09 58 A 1 ATOM 490 C CG . TYR A 0 58 . -3.329 11.792 -7.171 1.00 87.09 58 A 1 ATOM 491 C CD1 . TYR A 0 58 . -4.095 10.701 -7.628 1.00 87.09 58 A 1 ATOM 492 C CD2 . TYR A 0 58 . -3.734 13.111 -7.447 1.00 87.09 58 A 1 ATOM 493 C CE1 . TYR A 0 58 . -5.278 10.935 -8.353 1.00 87.09 58 A 1 ATOM 494 C CE2 . TYR A 0 58 . -4.922 13.347 -8.159 1.00 87.09 58 A 1 ATOM 495 O OH . TYR A 0 58 . -6.852 12.482 -9.286 1.00 87.09 58 A 1 ATOM 496 C CZ . TYR A 0 58 . -5.698 12.257 -8.608 1.00 87.09 58 A 1 ATOM 497 N N . LEU A 0 59 . -3.195 9.405 -4.225 1.00 85.58 59 A 1 ATOM 498 C CA . LEU A 0 59 . -4.185 8.476 -3.674 1.00 85.58 59 A 1 ATOM 499 C C . LEU A 0 59 . -4.520 8.800 -2.215 1.00 85.58 59 A 1 ATOM 500 C CB . LEU A 0 59 . -3.679 7.030 -3.820 1.00 85.58 59 A 1 ATOM 501 O O . LEU A 0 59 . -5.693 8.833 -1.849 1.00 85.58 59 A 1 ATOM 502 C CG . LEU A 0 59 . -3.609 6.547 -5.278 1.00 85.58 59 A 1 ATOM 503 C CD1 . LEU A 0 59 . -2.924 5.185 -5.347 1.00 85.58 59 A 1 ATOM 504 C CD2 . LEU A 0 59 . -4.995 6.412 -5.909 1.00 85.58 59 A 1 ATOM 505 N N . LEU A 0 60 . -3.511 9.096 -1.392 1.00 88.30 60 A 1 ATOM 506 C CA . LEU A 0 60 . -3.718 9.450 0.014 1.00 88.30 60 A 1 ATOM 507 C C . LEU A 0 60 . -4.455 10.780 0.189 1.00 88.30 60 A 1 ATOM 508 C CB . LEU A 0 60 . -2.372 9.492 0.743 1.00 88.30 60 A 1 ATOM 509 O O . LEU A 0 60 . -5.242 10.916 1.120 1.00 88.30 60 A 1 ATOM 510 C CG . LEU A 0 60 . -1.686 8.124 0.879 1.00 88.30 60 A 1 ATOM 511 C CD1 . LEU A 0 60 . -0.317 8.359 1.499 1.00 88.30 60 A 1 ATOM 512 C CD2 . LEU A 0 60 . -2.457 7.137 1.752 1.00 88.30 60 A 1 ATOM 513 N N . ASN A 0 61 . -4.282 11.739 -0.718 1.00 86.95 61 A 1 ATOM 514 C CA . ASN A 0 61 . -5.053 12.981 -0.701 1.00 86.95 61 A 1 ATOM 515 C C . ASN A 0 61 . -6.551 12.738 -0.898 1.00 86.95 61 A 1 ATOM 516 C CB . ASN A 0 61 . -4.532 13.914 -1.791 1.00 86.95 61 A 1 ATOM 517 O O . ASN A 0 61 . -7.362 13.495 -0.365 1.00 86.95 61 A 1 ATOM 518 C CG . ASN A 0 61 . -3.211 14.548 -1.433 1.00 86.95 61 A 1 ATOM 519 N ND2 . ASN A 0 61 . -2.552 15.068 -2.423 1.00 86.95 61 A 1 ATOM 520 O OD1 . ASN A 0 61 . -2.781 14.645 -0.298 1.00 86.95 61 A 1 ATOM 521 N N . GLY A 0 62 . -6.929 11.660 -1.595 1.00 86.77 62 A 1 ATOM 522 C CA . GLY A 0 62 . -8.321 11.226 -1.715 1.00 86.77 62 A 1 ATOM 523 C C . GLY A 0 62 . -8.979 10.886 -0.371 1.00 86.77 62 A 1 ATOM 524 O O . GLY A 0 62 . -10.203 10.886 -0.276 1.00 86.77 62 A 1 ATOM 525 N N . LEU A 0 63 . -8.188 10.654 0.683 1.00 87.93 63 A 1 ATOM 526 C CA . LEU A 0 63 . -8.680 10.409 2.040 1.00 87.93 63 A 1 ATOM 527 C C . LEU A 0 63 . -9.109 11.694 2.764 1.00 87.93 63 A 1 ATOM 528 C CB . LEU A 0 63 . -7.586 9.692 2.853 1.00 87.93 63 A 1 ATOM 529 O O . LEU A 0 63 . -9.765 11.617 3.800 1.00 87.93 63 A 1 ATOM 530 C CG . LEU A 0 63 . -7.082 8.373 2.239 1.00 87.93 63 A 1 ATOM 531 C CD1 . LEU A 0 63 . -5.840 7.916 2.987 1.00 87.93 63 A 1 ATOM 532 C CD2 . LEU A 0 63 . -8.147 7.290 2.354 1.00 87.93 63 A 1 ATOM 533 N N . GLY A 0 64 . -8.709 12.873 2.271 1.00 89.11 64 A 1 ATOM 534 C CA . GLY A 0 64 . -8.990 14.154 2.926 1.00 89.11 64 A 1 ATOM 535 C C . GLY A 0 64 . -8.281 14.341 4.274 1.00 89.11 64 A 1 ATOM 536 O O . GLY A 0 64 . -8.678 15.199 5.062 1.00 89.11 64 A 1 ATOM 537 N N . LYS A 0 65 . -7.247 13.540 4.560 1.00 89.65 65 A 1 ATOM 538 C CA . LYS A 0 65 . -6.456 13.609 5.794 1.00 89.65 65 A 1 ATOM 539 C C . LYS A 0 65 . -5.123 14.330 5.549 1.00 89.65 65 A 1 ATOM 540 C CB . LYS A 0 65 . -6.225 12.201 6.370 1.00 89.65 65 A 1 ATOM 541 O O . LYS A 0 65 . -4.548 14.175 4.472 1.00 89.65 65 A 1 ATOM 542 C CG . LYS A 0 65 . -7.511 11.433 6.726 1.00 89.65 65 A 1 ATOM 543 C CD . LYS A 0 65 . -8.375 12.128 7.794 1.00 89.65 65 A 1 ATOM 544 C CE . LYS A 0 65 . -9.475 11.170 8.281 1.00 89.65 65 A 1 ATOM 545 N NZ . LYS A 0 65 . -9.912 11.468 9.671 1.00 89.65 65 A 1 ATOM 546 N N . PRO A 0 66 . -4.595 15.085 6.529 1.00 91.54 66 A 1 ATOM 547 C CA . PRO A 0 66 . -3.248 15.639 6.454 1.00 91.54 66 A 1 ATOM 548 C C . PRO A 0 66 . -2.196 14.536 6.264 1.00 91.54 66 A 1 ATOM 549 C CB . PRO A 0 66 . -3.033 16.401 7.769 1.00 91.54 66 A 1 ATOM 550 O O . PRO A 0 66 . -2.222 13.520 6.962 1.00 91.54 66 A 1 ATOM 551 C CG . PRO A 0 66 . -4.445 16.678 8.280 1.00 91.54 66 A 1 ATOM 552 C CD . PRO A 0 66 . -5.246 15.488 7.763 1.00 91.54 66 A 1 ATOM 553 N N . VAL A 0 67 . -1.248 14.759 5.351 1.00 89.42 67 A 1 ATOM 554 C CA . VAL A 0 67 . -0.127 13.847 5.086 1.00 89.42 67 A 1 ATOM 555 C C . VAL A 0 67 . 1.188 14.566 5.385 1.00 89.42 67 A 1 ATOM 556 C CB . VAL A 0 67 . -0.153 13.296 3.644 1.00 89.42 67 A 1 ATOM 557 O O . VAL A 0 67 . 1.498 15.588 4.776 1.00 89.42 67 A 1 ATOM 558 C CG1 . VAL A 0 67 . 0.924 12.219 3.453 1.00 89.42 67 A 1 ATOM 559 C CG2 . VAL A 0 67 . -1.503 12.664 3.276 1.00 89.42 67 A 1 ATOM 560 N N . LEU A 0 68 . 1.971 14.031 6.321 1.00 88.41 68 A 1 ATOM 561 C CA . LEU A 0 68 . 3.328 14.479 6.626 1.00 88.41 68 A 1 ATOM 562 C C . LEU A 0 68 . 4.327 13.510 5.996 1.00 88.41 68 A 1 ATOM 563 C CB . LEU A 0 68 . 3.503 14.587 8.152 1.00 88.41 68 A 1 ATOM 564 O O . LEU A 0 68 . 4.282 12.315 6.274 1.00 88.41 68 A 1 ATOM 565 C CG . LEU A 0 68 . 4.913 15.037 8.586 1.00 88.41 68 A 1 ATOM 566 C CD1 . LEU A 0 68 . 5.217 16.467 8.132 1.00 88.41 68 A 1 ATOM 567 C CD2 . LEU A 0 68 . 5.041 14.995 10.109 1.00 88.41 68 A 1 ATOM 568 N N . ILE A 0 69 . 5.245 14.023 5.179 1.00 84.61 69 A 1 ATOM 569 C CA . ILE A 0 69 . 6.213 13.202 4.447 1.00 84.61 69 A 1 ATOM 570 C C . ILE A 0 69 . 7.619 13.503 4.948 1.00 84.61 69 A 1 ATOM 571 C CB . ILE A 0 69 . 6.099 13.392 2.922 1.00 84.61 69 A 1 ATOM 572 O O . ILE A 0 69 . 8.054 14.652 4.945 1.00 84.61 69 A 1 ATOM 573 C CG1 . ILE A 0 69 . 4.630 13.235 2.466 1.00 84.61 69 A 1 ATOM 574 C CG2 . ILE A 0 69 . 7.026 12.377 2.217 1.00 84.61 69 A 1 ATOM 575 C CD1 . ILE A 0 69 . 4.435 13.595 1.002 1.00 84.61 69 A 1 ATOM 576 N N . ASN A 0 70 . 8.337 12.458 5.343 1.00 82.12 70 A 1 ATOM 577 C CA . ASN A 0 70 . 9.758 12.517 5.644 1.00 82.12 70 A 1 ATOM 578 C C . ASN A 0 70 . 10.542 11.922 4.471 1.00 82.12 70 A 1 ATOM 579 C CB . ASN A 0 70 . 10.002 11.782 6.965 1.00 82.12 70 A 1 ATOM 580 O O . ASN A 0 70 . 10.479 10.714 4.250 1.00 82.12 70 A 1 ATOM 581 C CG . ASN A 0 70 . 11.438 11.908 7.429 1.00 82.12 70 A 1 ATOM 582 N ND2 . ASN A 0 70 . 11.905 10.994 8.245 1.00 82.12 70 A 1 ATOM 583 O OD1 . ASN A 0 70 . 12.140 12.848 7.106 1.00 82.12 70 A 1 ATOM 584 N N . GLY A 0 71 . 11.228 12.770 3.705 1.00 72.48 71 A 1 ATOM 585 C CA . GLY A 0 71 . 12.057 12.349 2.574 1.00 72.48 71 A 1 ATOM 586 C C . GLY A 0 71 . 13.531 12.225 2.947 1.00 72.48 71 A 1 ATOM 587 O O . GLY A 0 71 . 14.040 13.006 3.749 1.00 72.48 71 A 1 ATOM 588 N N . SER A 0 72 . 14.230 11.272 2.327 1.00 68.35 72 A 1 ATOM 589 C CA . SER A 0 72 . 15.674 11.090 2.503 1.00 68.35 72 A 1 ATOM 590 C C . SER A 0 72 . 16.525 12.156 1.819 1.00 68.35 72 A 1 ATOM 591 C CB . SER A 0 72 . 16.120 9.710 2.010 1.00 68.35 72 A 1 ATOM 592 O O . SER A 0 72 . 17.653 12.406 2.246 1.00 68.35 72 A 1 ATOM 593 O OG . SER A 0 72 . 15.368 9.156 0.941 1.00 68.35 72 A 1 ATOM 594 N N . SER A 0 73 . 16.016 12.786 0.759 1.00 69.50 73 A 1 ATOM 595 C CA . SER A 0 73 . 16.743 13.827 0.038 1.00 69.50 73 A 1 ATOM 596 C C . SER A 0 73 . 15.818 14.933 -0.463 1.00 69.50 73 A 1 ATOM 597 C CB . SER A 0 73 . 17.564 13.204 -1.100 1.00 69.50 73 A 1 ATOM 598 O O . SER A 0 73 . 14.668 14.700 -0.832 1.00 69.50 73 A 1 ATOM 599 O OG . SER A 0 73 . 16.758 12.793 -2.186 1.00 69.50 73 A 1 ATOM 600 N N . ILE A 0 74 . 16.334 16.165 -0.516 1.00 68.57 74 A 1 ATOM 601 C CA . ILE A 0 74 . 15.587 17.303 -1.070 1.00 68.57 74 A 1 ATOM 602 C C . ILE A 0 74 . 15.266 17.107 -2.558 1.00 68.57 74 A 1 ATOM 603 C CB . ILE A 0 74 . 16.351 18.619 -0.813 1.00 68.57 74 A 1 ATOM 604 O O . ILE A 0 74 . 14.271 17.632 -3.039 1.00 68.57 74 A 1 ATOM 605 C CG1 . ILE A 0 74 . 15.431 19.852 -0.992 1.00 68.57 74 A 1 ATOM 606 C CG2 . ILE A 0 74 . 17.614 18.754 -1.686 1.00 68.57 74 A 1 ATOM 607 C CD1 . ILE A 0 74 . 15.352 20.697 0.283 1.00 68.57 74 A 1 ATOM 608 N N . ASN A 0 75 . 16.083 16.327 -3.272 1.00 68.59 75 A 1 ATOM 609 C CA . ASN A 0 75 . 15.907 16.060 -4.698 1.00 68.59 75 A 1 ATOM 610 C C . ASN A 0 75 . 14.685 15.176 -4.975 1.00 68.59 75 A 1 ATOM 611 C CB . ASN A 0 75 . 17.193 15.432 -5.255 1.00 68.59 75 A 1 ATOM 612 O O . ASN A 0 75 . 13.993 15.387 -5.964 1.00 68.59 75 A 1 ATOM 613 C CG . ASN A 0 75 . 18.366 16.395 -5.316 1.00 68.59 75 A 1 ATOM 614 N ND2 . ASN A 0 75 . 19.532 15.900 -5.653 1.00 68.59 75 A 1 ATOM 615 O OD1 . ASN A 0 75 . 18.271 17.584 -5.065 1.00 68.59 75 A 1 ATOM 616 N N . GLU A 0 76 . 14.383 14.220 -4.093 1.00 66.54 76 A 1 ATOM 617 C CA . GLU A 0 76 . 13.150 13.426 -4.184 1.00 66.54 76 A 1 ATOM 618 C C . GLU A 0 76 . 11.908 14.307 -3.980 1.00 66.54 76 A 1 ATOM 619 C CB . GLU A 0 76 . 13.181 12.325 -3.115 1.00 66.54 76 A 1 ATOM 620 O O . GLU A 0 76 . 10.917 14.185 -4.702 1.00 66.54 76 A 1 ATOM 621 C CG . GLU A 0 76 . 14.152 11.183 -3.450 1.00 66.54 76 A 1 ATOM 622 C CD . GLU A 0 76 . 14.659 10.466 -2.190 1.00 66.54 76 A 1 ATOM 623 O OE1 . GLU A 0 76 . 15.836 10.050 -2.203 1.00 66.54 76 A 1 ATOM 624 O OE2 . GLU A 0 76 . 13.978 10.466 -1.136 1.00 66.54 76 A 1 ATOM 625 N N . LEU A 0 77 . 11.989 15.233 -3.019 1.00 69.64 77 A 1 ATOM 626 C CA . LEU A 0 77 . 10.890 16.118 -2.627 1.00 69.64 77 A 1 ATOM 627 C C . LEU A 0 77 . 10.693 17.312 -3.577 1.00 69.64 77 A 1 ATOM 628 C CB . LEU A 0 77 . 11.147 16.614 -1.191 1.00 69.64 77 A 1 ATOM 629 O O . LEU A 0 77 . 9.659 17.975 -3.517 1.00 69.64 77 A 1 ATOM 630 C CG . LEU A 0 77 . 11.258 15.513 -0.119 1.00 69.64 77 A 1 ATOM 631 C CD1 . LEU A 0 77 . 11.625 16.152 1.220 1.00 69.64 77 A 1 ATOM 632 C CD2 . LEU A 0 77 . 9.952 14.742 0.061 1.00 69.64 77 A 1 ATOM 633 N N . SER A 0 78 . 11.670 17.611 -4.436 1.00 72.35 78 A 1 ATOM 634 C CA . SER A 0 78 . 11.648 18.783 -5.318 1.00 72.35 78 A 1 ATOM 635 C C . SER A 0 78 . 11.097 18.506 -6.716 1.00 72.35 78 A 1 ATOM 636 C CB . SER A 0 78 . 13.034 19.426 -5.390 1.00 72.35 78 A 1 ATOM 637 O O . SER A 0 78 . 10.991 19.433 -7.522 1.00 72.35 78 A 1 ATOM 638 O OG . SER A 0 78 . 13.963 18.565 -6.012 1.00 72.35 78 A 1 ATOM 639 N N . SER A 0 79 . 10.711 17.262 -7.021 1.00 77.86 79 A 1 ATOM 640 C CA . SER A 0 79 . 10.098 16.957 -8.314 1.00 77.86 79 A 1 ATOM 641 C C . SER A 0 79 . 8.748 17.672 -8.482 1.00 77.86 79 A 1 ATOM 642 C CB . SER A 0 79 . 9.966 15.453 -8.549 1.00 77.86 79 A 1 ATOM 643 O O . SER A 0 79 . 7.953 17.816 -7.548 1.00 77.86 79 A 1 ATOM 644 O OG . SER A 0 79 . 8.933 14.946 -7.747 1.00 77.86 79 A 1 ATOM 645 N N . ILE A 0 80 . 8.470 18.119 -9.708 1.00 80.79 80 A 1 ATOM 646 C CA . ILE A 0 80 . 7.228 18.830 -10.041 1.00 80.79 80 A 1 ATOM 647 C C . ILE A 0 80 . 6.007 17.939 -9.798 1.00 80.79 80 A 1 ATOM 648 C CB . ILE A 0 80 . 7.299 19.333 -11.500 1.00 80.79 80 A 1 ATOM 649 O O . ILE A 0 80 . 5.011 18.419 -9.259 1.00 80.79 80 A 1 ATOM 650 C CG1 . ILE A 0 80 . 8.299 20.509 -11.590 1.00 80.79 80 A 1 ATOM 651 C CG2 . ILE A 0 80 . 5.921 19.764 -12.041 1.00 80.79 80 A 1 ATOM 652 C CD1 . ILE A 0 80 . 8.848 20.732 -13.003 1.00 80.79 80 A 1 ATOM 653 N N . SER A 0 81 . 6.092 16.653 -10.152 1.00 78.44 81 A 1 ATOM 654 C CA . SER A 0 81 . 5.026 15.669 -9.941 1.00 78.44 81 A 1 ATOM 655 C C . SER A 0 81 . 4.706 15.509 -8.455 1.00 78.44 81 A 1 ATOM 656 C CB . SER A 0 81 . 5.424 14.321 -10.570 1.00 78.44 81 A 1 ATOM 657 O O . SER A 0 81 . 3.537 15.548 -8.069 1.00 78.44 81 A 1 ATOM 658 O OG . SER A 0 81 . 6.727 13.922 -10.178 1.00 78.44 81 A 1 ATOM 659 N N . PHE A 0 82 . 5.729 15.431 -7.603 1.00 81.14 82 A 1 ATOM 660 C CA . PHE A 0 82 . 5.559 15.357 -6.156 1.00 81.14 82 A 1 ATOM 661 C C . PHE A 0 82 . 4.898 16.619 -5.589 1.00 81.14 82 A 1 ATOM 662 C CB . PHE A 0 82 . 6.920 15.093 -5.520 1.00 81.14 82 A 1 ATOM 663 O O . PHE A 0 82 . 3.890 16.520 -4.890 1.00 81.14 82 A 1 ATOM 664 C CG . PHE A 0 82 . 6.884 14.866 -4.035 1.00 81.14 82 A 1 ATOM 665 C CD1 . PHE A 0 82 . 7.013 15.950 -3.150 1.00 81.14 82 A 1 ATOM 666 C CD2 . PHE A 0 82 . 6.805 13.553 -3.542 1.00 81.14 82 A 1 ATOM 667 C CE1 . PHE A 0 82 . 7.047 15.720 -1.767 1.00 81.14 82 A 1 ATOM 668 C CE2 . PHE A 0 82 . 6.879 13.326 -2.160 1.00 81.14 82 A 1 ATOM 669 C CZ . PHE A 0 82 . 6.960 14.410 -1.273 1.00 81.14 82 A 1 ATOM 670 N N . ILE A 0 83 . 5.380 17.813 -5.947 1.00 82.92 83 A 1 ATOM 671 C CA . ILE A 0 83 . 4.783 19.077 -5.483 1.00 82.92 83 A 1 ATOM 672 C C . ILE A 0 83 . 3.333 19.219 -5.967 1.00 82.92 83 A 1 ATOM 673 C CB . ILE A 0 83 . 5.650 20.281 -5.919 1.00 82.92 83 A 1 ATOM 674 O O . ILE A 0 83 . 2.465 19.657 -5.212 1.00 82.92 83 A 1 ATOM 675 C CG1 . ILE A 0 83 . 7.035 20.213 -5.235 1.00 82.92 83 A 1 ATOM 676 C CG2 . ILE A 0 83 . 4.954 21.617 -5.575 1.00 82.92 83 A 1 ATOM 677 C CD1 . ILE A 0 83 . 8.048 21.228 -5.778 1.00 82.92 83 A 1 ATOM 678 N N . GLN A 0 84 . 3.041 18.833 -7.211 1.00 85.34 84 A 1 ATOM 679 C CA . GLN A 0 84 . 1.678 18.833 -7.742 1.00 85.34 84 A 1 ATOM 680 C C . GLN A 0 84 . 0.778 17.866 -6.978 1.00 85.34 84 A 1 ATOM 681 C CB . GLN A 0 84 . 1.699 18.468 -9.229 1.00 85.34 84 A 1 ATOM 682 O O . GLN A 0 84 . -0.333 18.249 -6.609 1.00 85.34 84 A 1 ATOM 683 C CG . GLN A 0 84 . 2.142 19.656 -10.090 1.00 85.34 84 A 1 ATOM 684 C CD . GLN A 0 84 . 2.249 19.293 -11.566 1.00 85.34 84 A 1 ATOM 685 N NE2 . GLN A 0 84 . 2.344 20.268 -12.442 1.00 85.34 84 A 1 ATOM 686 O OE1 . GLN A 0 84 . 2.252 18.148 -11.979 1.00 85.34 84 A 1 ATOM 687 N N . SER A 0 85 . 1.273 16.660 -6.685 1.00 84.53 85 A 1 ATOM 688 C CA . SER A 0 85 . 0.535 15.691 -5.881 1.00 84.53 85 A 1 ATOM 689 C C . SER A 0 85 . 0.227 16.258 -4.498 1.00 84.53 85 A 1 ATOM 690 C CB . SER A 0 85 . 1.248 14.338 -5.822 1.00 84.53 85 A 1 ATOM 691 O O . SER A 0 85 . -0.935 16.272 -4.128 1.00 84.53 85 A 1 ATOM 692 O OG . SER A 0 85 . 2.385 14.344 -4.983 1.00 84.53 85 A 1 ATOM 693 N N . LEU A 0 86 . 1.189 16.868 -3.797 1.00 82.68 86 A 1 ATOM 694 C CA . LEU A 0 86 . 0.963 17.547 -2.513 1.00 82.68 86 A 1 ATOM 695 C C . LEU A 0 86 . -0.091 18.663 -2.575 1.00 82.68 86 A 1 ATOM 696 C CB . LEU A 0 86 . 2.295 18.142 -2.026 1.00 82.68 86 A 1 ATOM 697 O O . LEU A 0 86 . -0.799 18.897 -1.603 1.00 82.68 86 A 1 ATOM 698 C CG . LEU A 0 86 . 3.240 17.138 -1.352 1.00 82.68 86 A 1 ATOM 699 C CD1 . LEU A 0 86 . 4.535 17.867 -0.994 1.00 82.68 86 A 1 ATOM 700 C CD2 . LEU A 0 86 . 2.622 16.600 -0.059 1.00 82.68 86 A 1 ATOM 701 N N . GLN A 0 87 . -0.216 19.345 -3.714 1.00 85.36 87 A 1 ATOM 702 C CA . GLN A 0 87 . -1.231 20.381 -3.940 1.00 85.36 87 A 1 ATOM 703 C C . GLN A 0 87 . -2.607 19.818 -4.333 1.00 85.36 87 A 1 ATOM 704 C CB . GLN A 0 87 . -0.713 21.369 -4.999 1.00 85.36 87 A 1 ATOM 705 O O . GLN A 0 87 . -3.515 20.595 -4.627 1.00 85.36 87 A 1 ATOM 706 C CG . GLN A 0 87 . 0.452 22.213 -4.467 1.00 85.36 87 A 1 ATOM 707 C CD . GLN A 0 87 . 1.062 23.141 -5.513 1.00 85.36 87 A 1 ATOM 708 N NE2 . GLN A 0 87 . 2.017 23.950 -5.112 1.00 85.36 87 A 1 ATOM 709 O OE1 . GLN A 0 87 . 0.697 23.200 -6.686 1.00 85.36 87 A 1 ATOM 710 N N . GLY A 0 88 . -2.766 18.493 -4.402 1.00 82.22 88 A 1 ATOM 711 C CA . GLY A 0 88 . -3.989 17.844 -4.876 1.00 82.22 88 A 1 ATOM 712 C C . GLY A 0 88 . -4.242 18.037 -6.374 1.00 82.22 88 A 1 ATOM 713 O O . GLY A 0 88 . -5.364 17.852 -6.842 1.00 82.22 88 A 1 ATOM 714 N N . LYS A 0 89 . -3.221 18.431 -7.144 1.00 84.57 89 A 1 ATOM 715 C CA . LYS A 0 89 . -3.341 18.576 -8.596 1.00 84.57 89 A 1 ATOM 716 C C . LYS A 0 89 . -3.301 17.201 -9.268 1.00 84.57 89 A 1 ATOM 717 C CB . LYS A 0 89 . -2.260 19.512 -9.148 1.00 84.57 89 A 1 ATOM 718 O O . LYS A 0 89 . -2.631 16.295 -8.767 1.00 84.57 89 A 1 ATOM 719 C CG . LYS A 0 89 . -2.536 20.961 -8.734 1.00 84.57 89 A 1 ATOM 720 C CD . LYS A 0 89 . -1.407 21.875 -9.207 1.00 84.57 89 A 1 ATOM 721 C CE . LYS A 0 89 . -1.751 23.319 -8.845 1.00 84.57 89 A 1 ATOM 722 N NZ . LYS A 0 89 . -0.561 24.190 -8.962 1.00 84.57 89 A 1 ATOM 723 N N . PRO A 0 90 . -3.996 17.035 -10.406 1.00 78.48 90 A 1 ATOM 724 C CA . PRO A 0 90 . -3.913 15.806 -11.180 1.00 78.48 90 A 1 ATOM 725 C C . PRO A 0 90 . -2.466 15.550 -11.613 1.00 78.48 90 A 1 ATOM 726 C CB . PRO A 0 90 . -4.860 15.998 -12.367 1.00 78.48 90 A 1 ATOM 727 O O . PRO A 0 90 . -1.763 16.469 -12.035 1.00 78.48 90 A 1 ATOM 728 C CG . PRO A 0 90 . -4.941 17.516 -12.530 1.00 78.48 90 A 1 ATOM 729 C CD . PRO A 0 90 . -4.802 18.029 -11.100 1.00 78.48 90 A 1 ATOM 730 N N . ILE A 0 91 . -2.031 14.295 -11.505 1.00 75.32 91 A 1 ATOM 731 C CA . ILE A 0 91 . -0.703 13.870 -11.948 1.00 75.32 91 A 1 ATOM 732 C C . ILE A 0 91 . -0.752 13.641 -13.459 1.00 75.32 91 A 1 ATOM 733 C CB . ILE A 0 91 . -0.242 12.602 -11.199 1.00 75.32 91 A 1 ATOM 734 O O . ILE A 0 91 . -1.557 12.849 -13.941 1.00 75.32 91 A 1 ATOM 735 C CG1 . ILE A 0 91 . -0.268 12.821 -9.674 1.00 75.32 91 A 1 ATOM 736 C CG2 . ILE A 0 91 . 1.188 12.212 -11.626 1.00 75.32 91 A 1 ATOM 737 C CD1 . ILE A 0 91 . 0.057 11.542 -8.911 1.00 75.32 91 A 1 ATOM 738 N N . SER A 0 92 . 0.147 14.283 -14.204 1.00 65.09 92 A 1 ATOM 739 C CA . SER A 0 92 . 0.235 14.175 -15.671 1.00 65.09 92 A 1 ATOM 740 C C . SER A 0 92 . 0.825 12.852 -16.185 1.00 65.09 92 A 1 ATOM 741 C CB . SER A 0 92 . 1.073 15.331 -16.226 1.00 65.09 92 A 1 ATOM 742 O O . SER A 0 92 . 1.077 12.714 -17.378 1.00 65.09 92 A 1 ATOM 743 O OG . SER A 0 92 . 0.637 16.570 -15.697 1.00 65.09 92 A 1 ATOM 744 N N . ILE A 0 93 . 1.106 11.895 -15.302 1.00 63.53 93 A 1 ATOM 745 C CA . ILE A 0 93 . 1.892 10.702 -15.617 1.00 63.53 93 A 1 ATOM 746 C C . ILE A 0 93 . 0.915 9.537 -15.803 1.00 63.53 93 A 1 ATOM 747 C CB . ILE A 0 93 . 3.001 10.466 -14.562 1.00 63.53 93 A 1 ATOM 748 O O . ILE A 0 93 . 0.410 8.953 -14.840 1.00 63.53 93 A 1 ATOM 749 C CG1 . ILE A 0 93 . 3.875 11.730 -14.336 1.00 63.53 93 A 1 ATOM 750 C CG2 . ILE A 0 93 . 3.930 9.327 -15.025 1.00 63.53 93 A 1 ATOM 751 C CD1 . ILE A 0 93 . 4.603 11.734 -12.991 1.00 63.53 93 A 1 ATOM 752 N N . GLY A 0 94 . 0.621 9.215 -17.063 1.00 63.04 94 A 1 ATOM 753 C CA . GLY A 0 94 . -0.105 7.998 -17.433 1.00 63.04 94 A 1 ATOM 754 C C . GLY A 0 94 . 0.704 6.742 -17.102 1.00 63.04 94 A 1 ATOM 755 O O . GLY A 0 94 . 1.907 6.819 -16.859 1.00 63.04 94 A 1 ATOM 756 N N . PHE A 0 95 . 0.049 5.587 -17.028 1.00 62.44 95 A 1 ATOM 757 C CA . PHE A 0 95 . 0.767 4.313 -17.104 1.00 62.44 95 A 1 ATOM 758 C C . PHE A 0 95 . 1.166 4.096 -18.561 1.00 62.44 95 A 1 ATOM 759 C CB . PHE A 0 95 . -0.106 3.167 -16.580 1.00 62.44 95 A 1 ATOM 760 O O . PHE A 0 95 . 0.385 4.417 -19.457 1.00 62.44 95 A 1 ATOM 761 C CG . PHE A 0 95 . -0.414 3.290 -15.103 1.00 62.44 95 A 1 ATOM 762 C CD1 . PHE A 0 95 . 0.502 2.803 -14.154 1.00 62.44 95 A 1 ATOM 763 C CD2 . PHE A 0 95 . -1.594 3.925 -14.674 1.00 62.44 95 A 1 ATOM 764 C CE1 . PHE A 0 95 . 0.250 2.970 -12.781 1.00 62.44 95 A 1 ATOM 765 C CE2 . PHE A 0 95 . -1.849 4.089 -13.303 1.00 62.44 95 A 1 ATOM 766 C CZ . PHE A 0 95 . -0.922 3.621 -12.358 1.00 62.44 95 A 1 ATOM 767 N N . ASN A 0 96 . 2.362 3.571 -18.803 1.00 66.33 96 A 1 ATOM 768 C CA . ASN A 0 96 . 2.714 3.116 -20.137 1.00 66.33 96 A 1 ATOM 769 C C . ASN A 0 96 . 1.766 1.948 -20.490 1.00 66.33 96 A 1 ATOM 770 C CB . ASN A 0 96 . 4.227 2.819 -20.140 1.00 66.33 96 A 1 ATOM 771 O O . ASN A 0 96 . 1.623 1.002 -19.716 1.00 66.33 96 A 1 ATOM 772 C CG . ASN A 0 96 . 4.861 2.722 -21.501 1.00 66.33 96 A 1 ATOM 773 N ND2 . ASN A 0 96 . 6.111 2.328 -21.540 1.00 66.33 96 A 1 ATOM 774 O OD1 . ASN A 0 96 . 4.256 3.009 -22.520 1.00 66.33 96 A 1 ATOM 775 N N . GLU A 0 97 . 1.039 2.042 -21.607 1.00 66.65 97 A 1 ATOM 776 C CA . GLU A 0 97 . -0.065 1.111 -21.930 1.00 66.65 97 A 1 ATOM 777 C C . GLU A 0 97 . 0.402 -0.346 -22.090 1.00 66.65 97 A 1 ATOM 778 C CB . GLU A 0 97 . -0.774 1.557 -23.219 1.00 66.65 97 A 1 ATOM 779 O O . GLU A 0 97 . -0.397 -1.277 -22.018 1.00 66.65 97 A 1 ATOM 780 C CG . GLU A 0 97 . -1.549 2.875 -23.061 1.00 66.65 97 A 1 ATOM 781 C CD . GLU A 0 97 . -2.329 3.276 -24.327 1.00 66.65 97 A 1 ATOM 782 O OE1 . GLU A 0 97 . -3.169 4.197 -24.211 1.00 66.65 97 A 1 ATOM 783 O OE2 . GLU A 0 97 . -2.086 2.680 -25.402 1.00 66.65 97 A 1 ATOM 784 N N . LEU A 0 98 . 1.706 -0.542 -22.284 1.00 65.38 98 A 1 ATOM 785 C CA . LEU A 0 98 . 2.352 -1.843 -22.428 1.00 65.38 98 A 1 ATOM 786 C C . LEU A 0 98 . 2.674 -2.524 -21.087 1.00 65.38 98 A 1 ATOM 787 C CB . LEU A 0 98 . 3.617 -1.650 -23.283 1.00 65.38 98 A 1 ATOM 788 O O . LEU A 0 98 . 3.096 -3.680 -21.086 1.00 65.38 98 A 1 ATOM 789 C CG . LEU A 0 98 . 3.343 -1.138 -24.710 1.00 65.38 98 A 1 ATOM 790 C CD1 . LEU A 0 98 . 4.666 -0.820 -25.406 1.00 65.38 98 A 1 ATOM 791 C CD2 . LEU A 0 98 . 2.590 -2.169 -25.556 1.00 65.38 98 A 1 ATOM 792 N N . ILE A 0 99 . 2.493 -1.841 -19.952 1.00 70.79 99 A 1 ATOM 793 C CA . ILE A 0 99 . 2.863 -2.384 -18.643 1.00 70.79 99 A 1 ATOM 794 C C . ILE A 0 99 . 1.861 -3.459 -18.212 1.00 70.79 99 A 1 ATOM 795 C CB . ILE A 0 99 . 3.009 -1.296 -17.559 1.00 70.79 99 A 1 ATOM 796 O O . ILE A 0 99 . 0.643 -3.327 -18.341 1.00 70.79 99 A 1 ATOM 797 C CG1 . ILE A 0 99 . 3.993 -0.183 -17.953 1.00 70.79 99 A 1 ATOM 798 C CG2 . ILE A 0 99 . 3.532 -1.918 -16.253 1.00 70.79 99 A 1 ATOM 799 C CD1 . ILE A 0 99 . 3.738 1.090 -17.126 1.00 70.79 99 A 1 ATOM 800 N N . GLN A 0 100 . 2.395 -4.528 -17.630 1.00 71.02 100 A 1 ATOM 801 C CA . GLN A 0 100 . 1.645 -5.638 -17.067 1.00 71.02 100 A 1 ATOM 802 C C . GLN A 0 100 . 0.689 -5.178 -15.952 1.00 71.02 100 A 1 ATOM 803 C CB . GLN A 0 100 . 2.691 -6.649 -16.569 1.00 71.02 100 A 1 ATOM 804 O O . GLN A 0 100 . 1.107 -4.917 -14.837 1.00 71.02 100 A 1 ATOM 805 C CG . GLN A 0 100 . 2.127 -8.061 -16.429 1.00 71.02 100 A 1 ATOM 806 C CD . GLN A 0 100 . 3.209 -9.084 -16.091 1.00 71.02 100 A 1 ATOM 807 N NE2 . GLN A 0 100 . 2.910 -10.359 -16.187 1.00 71.02 100 A 1 ATOM 808 O OE1 . GLN A 0 100 . 4.336 -8.794 -15.738 1.00 71.02 100 A 1 ATOM 809 N N . THR A 0 101 . -0.620 -5.156 -16.202 1.00 80.22 101 A 1 ATOM 810 C CA . THR A 0 101 . -1.646 -4.641 -15.263 1.00 80.22 101 A 1 ATOM 811 C C . THR A 0 101 . -1.919 -5.524 -14.037 1.00 80.22 101 A 1 ATOM 812 C CB . THR A 0 101 . -2.964 -4.388 -16.006 1.00 80.22 101 A 1 ATOM 813 O O . THR A 0 101 . -2.849 -5.271 -13.269 1.00 80.22 101 A 1 ATOM 814 C CG2 . THR A 0 101 . -2.819 -3.311 -17.079 1.00 80.22 101 A 1 ATOM 815 O OG1 . THR A 0 101 . -3.388 -5.569 -16.653 1.00 80.22 101 A 1 ATOM 816 N N . SER A 0 102 . -1.124 -6.575 -13.838 1.00 86.16 102 A 1 ATOM 817 C CA . SER A 0 102 . -1.268 -7.518 -12.733 1.00 86.16 102 A 1 ATOM 818 C C . SER A 0 102 . -0.017 -7.518 -11.861 1.00 86.16 102 A 1 ATOM 819 C CB . SER A 0 102 . -1.555 -8.923 -13.263 1.00 86.16 102 A 1 ATOM 820 O O . SER A 0 102 . 1.079 -7.539 -12.419 1.00 86.16 102 A 1 ATOM 821 O OG . SER A 0 102 . -0.422 -9.498 -13.888 1.00 86.16 102 A 1 ATOM 822 N N . PRO A 0 103 . -0.156 -7.607 -10.528 1.00 89.01 103 A 1 ATOM 823 C CA . PRO A 0 103 . 0.985 -7.631 -9.633 1.00 89.01 103 A 1 ATOM 824 C C . PRO A 0 103 . 1.784 -8.916 -9.836 1.00 89.01 103 A 1 ATOM 825 C CB . PRO A 0 103 . 0.404 -7.523 -8.222 1.00 89.01 103 A 1 ATOM 826 O O . PRO A 0 103 . 1.247 -9.950 -10.268 1.00 89.01 103 A 1 ATOM 827 C CG . PRO A 0 103 . -0.956 -8.195 -8.368 1.00 89.01 103 A 1 ATOM 828 C CD . PRO A 0 103 . -1.382 -7.811 -9.780 1.00 89.01 103 A 1 ATOM 829 N N . SER A 0 104 . 3.057 -8.861 -9.469 1.00 90.64 104 A 1 ATOM 830 C CA . SER A 0 104 . 3.953 -10.004 -9.483 1.00 90.64 104 A 1 ATOM 831 C C . SER A 0 104 . 3.385 -11.155 -8.646 1.00 90.64 104 A 1 ATOM 832 C CB . SER A 0 104 . 5.352 -9.591 -9.009 1.00 90.64 104 A 1 ATOM 833 O O . SER A 0 104 . 2.634 -10.969 -7.682 1.00 90.64 104 A 1 ATOM 834 O OG . SER A 0 104 . 5.391 -9.366 -7.613 1.00 90.64 104 A 1 ATOM 835 N N . SER A 0 105 . 3.753 -12.391 -8.990 1.00 92.56 105 A 1 ATOM 836 C CA . SER A 0 105 . 3.364 -13.577 -8.212 1.00 92.56 105 A 1 ATOM 837 C C . SER A 0 105 . 3.796 -13.464 -6.747 1.00 92.56 105 A 1 ATOM 838 C CB . SER A 0 105 . 3.979 -14.830 -8.841 1.00 92.56 105 A 1 ATOM 839 O O . SER A 0 105 . 3.043 -13.838 -5.846 1.00 92.56 105 A 1 ATOM 840 O OG . SER A 0 105 . 5.374 -14.652 -9.016 1.00 92.56 105 A 1 ATOM 841 N N . LYS A 0 106 . 4.975 -12.878 -6.509 1.00 93.17 106 A 1 ATOM 842 C CA . LYS A 0 106 . 5.494 -12.571 -5.176 1.00 93.17 106 A 1 ATOM 843 C C . LYS A 0 106 . 4.574 -11.604 -4.430 1.00 93.17 106 A 1 ATOM 844 C CB . LYS A 0 106 . 6.919 -12.018 -5.316 1.00 93.17 106 A 1 ATOM 845 O O . LYS A 0 106 . 4.216 -11.888 -3.290 1.00 93.17 106 A 1 ATOM 846 C CG . LYS A 0 106 . 7.597 -11.806 -3.954 1.00 93.17 106 A 1 ATOM 847 C CD . LYS A 0 106 . 8.997 -11.209 -4.143 1.00 93.17 106 A 1 ATOM 848 C CE . LYS A 0 106 . 9.661 -10.937 -2.788 1.00 93.17 106 A 1 ATOM 849 N NZ . LYS A 0 106 . 10.949 -10.215 -2.953 1.00 93.17 106 A 1 ATOM 850 N N . MET A 0 107 . 4.156 -10.506 -5.059 1.00 92.86 107 A 1 ATOM 851 C CA . MET A 0 107 . 3.272 -9.530 -4.420 1.00 92.86 107 A 1 ATOM 852 C C . MET A 0 107 . 1.882 -10.107 -4.136 1.00 92.86 107 A 1 ATOM 853 C CB . MET A 0 107 . 3.209 -8.255 -5.268 1.00 92.86 107 A 1 ATOM 854 O O . MET A 0 107 . 1.366 -9.929 -3.035 1.00 92.86 107 A 1 ATOM 855 C CG . MET A 0 107 . 2.342 -7.171 -4.616 1.00 92.86 107 A 1 ATOM 856 S SD . MET A 0 107 . 2.823 -6.745 -2.916 1.00 92.86 107 A 1 ATOM 857 C CE . MET A 0 107 . 4.287 -5.724 -3.227 1.00 92.86 107 A 1 ATOM 858 N N . LYS A 0 108 . 1.306 -10.893 -5.059 1.00 94.67 108 A 1 ATOM 859 C CA . LYS A 0 108 . 0.046 -11.621 -4.801 1.00 94.67 108 A 1 ATOM 860 C C . LYS A 0 108 . 0.147 -12.490 -3.551 1.00 94.67 108 A 1 ATOM 861 C CB . LYS A 0 108 . -0.344 -12.505 -5.995 1.00 94.67 108 A 1 ATOM 862 O O . LYS A 0 108 . -0.744 -12.458 -2.707 1.00 94.67 108 A 1 ATOM 863 C CG . LYS A 0 108 . -0.758 -11.666 -7.202 1.00 94.67 108 A 1 ATOM 864 C CD . LYS A 0 108 . -1.169 -12.532 -8.397 1.00 94.67 108 A 1 ATOM 865 C CE . LYS A 0 108 . -1.500 -11.611 -9.576 1.00 94.67 108 A 1 ATOM 866 N NZ . LYS A 0 108 . -1.760 -12.360 -10.828 1.00 94.67 108 A 1 ATOM 867 N N . HIS A 0 109 . 1.246 -13.231 -3.420 1.00 96.32 109 A 1 ATOM 868 C CA . HIS A 0 109 . 1.473 -14.088 -2.264 1.00 96.32 109 A 1 ATOM 869 C C . HIS A 0 109 . 1.624 -13.282 -0.965 1.00 96.32 109 A 1 ATOM 870 C CB . HIS A 0 109 . 2.699 -14.964 -2.533 1.00 96.32 109 A 1 ATOM 871 O O . HIS A 0 109 . 1.036 -13.642 0.050 1.00 96.32 109 A 1 ATOM 872 C CG . HIS A 0 109 . 2.843 -16.059 -1.515 1.00 96.32 109 A 1 ATOM 873 C CD2 . HIS A 0 109 . 3.893 -16.261 -0.662 1.00 96.32 109 A 1 ATOM 874 N ND1 . HIS A 0 109 . 1.914 -17.042 -1.260 1.00 96.32 109 A 1 ATOM 875 C CE1 . HIS A 0 109 . 2.398 -17.823 -0.282 1.00 96.32 109 A 1 ATOM 876 N NE2 . HIS A 0 109 . 3.608 -17.393 0.107 1.00 96.32 109 A 1 ATOM 877 N N . ILE A 0 110 . 2.349 -12.159 -1.000 1.00 96.11 110 A 1 ATOM 878 C CA . ILE A 0 110 . 2.490 -11.255 0.152 1.00 96.11 110 A 1 ATOM 879 C C . ILE A 0 110 . 1.127 -10.705 0.588 1.00 96.11 110 A 1 ATOM 880 C CB . ILE A 0 110 . 3.497 -10.126 -0.170 1.00 96.11 110 A 1 ATOM 881 O O . ILE A 0 110 . 0.805 -10.765 1.772 1.00 96.11 110 A 1 ATOM 882 C CG1 . ILE A 0 110 . 4.928 -10.708 -0.235 1.00 96.11 110 A 1 ATOM 883 C CG2 . ILE A 0 110 . 3.436 -8.992 0.873 1.00 96.11 110 A 1 ATOM 884 C CD1 . ILE A 0 110 . 5.960 -9.751 -0.846 1.00 96.11 110 A 1 ATOM 885 N N . ILE A 0 111 . 0.307 -10.222 -0.350 1.00 95.48 111 A 1 ATOM 886 C CA . ILE A 0 111 . -1.041 -9.710 -0.059 1.00 95.48 111 A 1 ATOM 887 C C . ILE A 0 111 . -1.891 -10.796 0.610 1.00 95.48 111 A 1 ATOM 888 C CB . ILE A 0 111 . -1.687 -9.157 -1.353 1.00 95.48 111 A 1 ATOM 889 O O . ILE A 0 111 . -2.487 -10.550 1.658 1.00 95.48 111 A 1 ATOM 890 C CG1 . ILE A 0 111 . -0.969 -7.854 -1.776 1.00 95.48 111 A 1 ATOM 891 C CG2 . ILE A 0 111 . -3.196 -8.892 -1.182 1.00 95.48 111 A 1 ATOM 892 C CD1 . ILE A 0 111 . -1.342 -7.356 -3.178 1.00 95.48 111 A 1 ATOM 893 N N . GLN A 0 112 . -1.890 -12.016 0.063 1.00 95.51 112 A 1 ATOM 894 C CA . GLN A 0 112 . -2.614 -13.149 0.647 1.00 95.51 112 A 1 ATOM 895 C C . GLN A 0 112 . -2.150 -13.464 2.072 1.00 95.51 112 A 1 ATOM 896 C CB . GLN A 0 112 . -2.435 -14.387 -0.241 1.00 95.51 112 A 1 ATOM 897 O O . GLN A 0 112 . -2.982 -13.646 2.959 1.00 95.51 112 A 1 ATOM 898 C CG . GLN A 0 112 . -3.250 -14.290 -1.535 1.00 95.51 112 A 1 ATOM 899 C CD . GLN A 0 112 . -2.966 -15.445 -2.491 1.00 95.51 112 A 1 ATOM 900 N NE2 . GLN A 0 112 . -3.923 -15.812 -3.314 1.00 95.51 112 A 1 ATOM 901 O OE1 . GLN A 0 112 . -1.897 -16.041 -2.530 1.00 95.51 112 A 1 ATOM 902 N N . LEU A 0 113 . -0.837 -13.487 2.315 1.00 96.74 113 A 1 ATOM 903 C CA . LEU A 0 113 . -0.283 -13.730 3.648 1.00 96.74 113 A 1 ATOM 904 C C . LEU A 0 113 . -0.696 -12.643 4.646 1.00 96.74 113 A 1 ATOM 905 C CB . LEU A 0 113 . 1.249 -13.817 3.564 1.00 96.74 113 A 1 ATOM 906 O O . LEU A 0 113 . -1.085 -12.963 5.768 1.00 96.74 113 A 1 ATOM 907 C CG . LEU A 0 113 . 1.792 -15.118 2.949 1.00 96.74 113 A 1 ATOM 908 C CD1 . LEU A 0 113 . 3.305 -14.974 2.775 1.00 96.74 113 A 1 ATOM 909 C CD2 . LEU A 0 113 . 1.522 -16.331 3.843 1.00 96.74 113 A 1 ATOM 910 N N . ILE A 0 114 . -0.649 -11.368 4.247 1.00 96.51 114 A 1 ATOM 911 C CA . ILE A 0 114 . -1.047 -10.254 5.117 1.00 96.51 114 A 1 ATOM 912 C C . ILE A 0 114 . -2.529 -10.366 5.484 1.00 96.51 114 A 1 ATOM 913 C CB . ILE A 0 114 . -0.720 -8.890 4.471 1.00 96.51 114 A 1 ATOM 914 O O . ILE A 0 114 . -2.863 -10.239 6.665 1.00 96.51 114 A 1 ATOM 915 C CG1 . ILE A 0 114 . 0.811 -8.695 4.363 1.00 96.51 114 A 1 ATOM 916 C CG2 . ILE A 0 114 . -1.319 -7.743 5.310 1.00 96.51 114 A 1 ATOM 917 C CD1 . ILE A 0 114 . 1.217 -7.519 3.464 1.00 96.51 114 A 1 ATOM 918 N N . ILE A 0 115 . -3.400 -10.648 4.510 1.00 95.82 115 A 1 ATOM 919 C CA . ILE A 0 115 . -4.838 -10.846 4.742 1.00 95.82 115 A 1 ATOM 920 C C . ILE A 0 115 . -5.055 -12.008 5.714 1.00 95.82 115 A 1 ATOM 921 C CB . ILE A 0 115 . -5.584 -11.057 3.403 1.00 95.82 115 A 1 ATOM 922 O O . ILE A 0 115 . -5.685 -11.834 6.758 1.00 95.82 115 A 1 ATOM 923 C CG1 . ILE A 0 115 . -5.601 -9.732 2.609 1.00 95.82 115 A 1 ATOM 924 C CG2 . ILE A 0 115 . -7.021 -11.550 3.645 1.00 95.82 115 A 1 ATOM 925 C CD1 . ILE A 0 115 . -6.075 -9.872 1.157 1.00 95.82 115 A 1 ATOM 926 N N . GLN A 0 116 . -4.460 -13.171 5.443 1.00 95.50 116 A 1 ATOM 927 C CA . GLN A 0 116 . -4.597 -14.352 6.299 1.00 95.50 116 A 1 ATOM 928 C C . GLN A 0 116 . -4.149 -14.091 7.738 1.00 95.50 116 A 1 ATOM 929 C CB . GLN A 0 116 . -3.779 -15.509 5.719 1.00 95.50 116 A 1 ATOM 930 O O . GLN A 0 116 . -4.811 -14.531 8.673 1.00 95.50 116 A 1 ATOM 931 C CG . GLN A 0 116 . -4.478 -16.148 4.516 1.00 95.50 116 A 1 ATOM 932 C CD . GLN A 0 116 . -3.689 -17.322 3.948 1.00 95.50 116 A 1 ATOM 933 N NE2 . GLN A 0 116 . -4.336 -18.201 3.218 1.00 95.50 116 A 1 ATOM 934 O OE1 . GLN A 0 116 . -2.497 -17.491 4.150 1.00 95.50 116 A 1 ATOM 935 N N . GLN A 0 117 . -3.067 -13.343 7.940 1.00 95.73 117 A 1 ATOM 936 C CA . GLN A 0 117 . -2.557 -13.055 9.281 1.00 95.73 117 A 1 ATOM 937 C C . GLN A 0 117 . -3.359 -11.985 10.030 1.00 95.73 117 A 1 ATOM 938 C CB . GLN A 0 117 . -1.086 -12.648 9.175 1.00 95.73 117 A 1 ATOM 939 O O . GLN A 0 117 . -3.298 -11.934 11.257 1.00 95.73 117 A 1 ATOM 940 C CG . GLN A 0 117 . -0.202 -13.850 8.811 1.00 95.73 117 A 1 ATOM 941 C CD . GLN A 0 117 . 1.265 -13.472 8.655 1.00 95.73 117 A 1 ATOM 942 N NE2 . GLN A 0 117 . 2.118 -14.424 8.349 1.00 95.73 117 A 1 ATOM 943 O OE1 . GLN A 0 117 . 1.686 -12.339 8.819 1.00 95.73 117 A 1 ATOM 944 N N . ASN A 0 118 . -4.102 -11.125 9.326 1.00 95.68 118 A 1 ATOM 945 C CA . ASN A 0 118 . -4.708 -9.939 9.930 1.00 95.68 118 A 1 ATOM 946 C C . ASN A 0 118 . -6.238 -9.854 9.806 1.00 95.68 118 A 1 ATOM 947 C CB . ASN A 0 118 . -4.000 -8.687 9.402 1.00 95.68 118 A 1 ATOM 948 O O . ASN A 0 118 . -6.822 -8.958 10.415 1.00 95.68 118 A 1 ATOM 949 C CG . ASN A 0 118 . -2.550 -8.596 9.829 1.00 95.68 118 A 1 ATOM 950 N ND2 . ASN A 0 118 . -1.643 -9.026 8.986 1.00 95.68 118 A 1 ATOM 951 O OD1 . ASN A 0 118 . -2.234 -8.145 10.923 1.00 95.68 118 A 1 ATOM 952 N N . HIS A 0 119 . -6.904 -10.785 9.114 1.00 94.01 119 A 1 ATOM 953 C CA . HIS A 0 119 . -8.367 -10.787 8.935 1.00 94.01 119 A 1 ATOM 954 C C . HIS A 0 119 . -9.167 -10.787 10.250 1.00 94.01 119 A 1 ATOM 955 C CB . HIS A 0 119 . -8.784 -11.989 8.072 1.00 94.01 119 A 1 ATOM 956 O O . HIS A 0 119 . -10.292 -10.306 10.289 1.00 94.01 119 A 1 ATOM 957 C CG . HIS A 0 119 . -8.669 -13.323 8.772 1.00 94.01 119 A 1 ATOM 958 C CD2 . HIS A 0 119 . -9.690 -14.028 9.355 1.00 94.01 119 A 1 ATOM 959 N ND1 . HIS A 0 119 . -7.522 -14.054 8.972 1.00 94.01 119 A 1 ATOM 960 C CE1 . HIS A 0 119 . -7.840 -15.169 9.644 1.00 94.01 119 A 1 ATOM 961 N NE2 . HIS A 0 119 . -9.152 -15.192 9.922 1.00 94.01 119 A 1 ATOM 962 N N . GLN A 0 120 . -8.596 -11.298 11.347 1.00 93.16 120 A 1 ATOM 963 C CA . GLN A 0 120 . -9.241 -11.259 12.668 1.00 93.16 120 A 1 ATOM 964 C C . GLN A 0 120 . -9.144 -9.887 13.348 1.00 93.16 120 A 1 ATOM 965 C CB . GLN A 0 120 . -8.621 -12.322 13.583 1.00 93.16 120 A 1 ATOM 966 O O . GLN A 0 120 . -9.924 -9.589 14.248 1.00 93.16 120 A 1 ATOM 967 C CG . GLN A 0 120 . -8.840 -13.742 13.048 1.00 93.16 120 A 1 ATOM 968 C CD . GLN A 0 120 . -8.373 -14.822 14.015 1.00 93.16 120 A 1 ATOM 969 N NE2 . GLN A 0 120 . -8.823 -16.042 13.833 1.00 93.16 120 A 1 ATOM 970 O OE1 . GLN A 0 120 . -7.596 -14.606 14.931 1.00 93.16 120 A 1 ATOM 971 N N . ARG A 0 121 . -8.164 -9.066 12.951 1.00 94.72 121 A 1 ATOM 972 C CA . ARG A 0 121 . -7.892 -7.745 13.535 1.00 94.72 121 A 1 ATOM 973 C C . ARG A 0 121 . -8.576 -6.623 12.763 1.00 94.72 121 A 1 ATOM 974 C CB . ARG A 0 121 . -6.380 -7.490 13.586 1.00 94.72 121 A 1 ATOM 975 O O . ARG A 0 121 . -8.992 -5.653 13.384 1.00 94.72 121 A 1 ATOM 976 C CG . ARG A 0 121 . -5.638 -8.490 14.485 1.00 94.72 121 A 1 ATOM 977 C CD . ARG A 0 121 . -4.127 -8.245 14.452 1.00 94.72 121 A 1 ATOM 978 N NE . ARG A 0 121 . -3.767 -6.938 15.035 1.00 94.72 121 A 1 ATOM 979 N NH1 . ARG A 0 121 . -1.522 -7.050 14.591 1.00 94.72 121 A 1 ATOM 980 N NH2 . ARG A 0 121 . -2.354 -5.266 15.656 1.00 94.72 121 A 1 ATOM 981 C CZ . ARG A 0 121 . -2.552 -6.426 15.094 1.00 94.72 121 A 1 ATOM 982 N N . TRP A 0 122 . -8.676 -6.771 11.444 1.00 95.77 122 A 1 ATOM 983 C CA . TRP A 0 122 . -9.267 -5.788 10.539 1.00 95.77 122 A 1 ATOM 984 C C . TRP A 0 122 . -10.450 -6.404 9.810 1.00 95.77 122 A 1 ATOM 985 C CB . TRP A 0 122 . -8.212 -5.308 9.544 1.00 95.77 122 A 1 ATOM 986 O O . TRP A 0 122 . -10.287 -7.355 9.040 1.00 95.77 122 A 1 ATOM 987 C CG . TRP A 0 122 . -7.021 -4.668 10.173 1.00 95.77 122 A 1 ATOM 988 C CD1 . TRP A 0 122 . -5.785 -5.197 10.230 1.00 95.77 122 A 1 ATOM 989 C CD2 . TRP A 0 122 . -6.924 -3.361 10.803 1.00 95.77 122 A 1 ATOM 990 C CE2 . TRP A 0 122 . -5.581 -3.175 11.250 1.00 95.77 122 A 1 ATOM 991 C CE3 . TRP A 0 122 . -7.829 -2.303 11.008 1.00 95.77 122 A 1 ATOM 992 N NE1 . TRP A 0 122 . -4.928 -4.332 10.879 1.00 95.77 122 A 1 ATOM 993 C CH2 . TRP A 0 122 . -6.087 -0.955 12.063 1.00 95.77 122 A 1 ATOM 994 C CZ2 . TRP A 0 122 . -5.159 -1.994 11.877 1.00 95.77 122 A 1 ATOM 995 C CZ3 . TRP A 0 122 . -7.416 -1.111 11.628 1.00 95.77 122 A 1 ATOM 996 N N . LYS A 0 123 . -11.642 -5.849 10.035 1.00 95.04 123 A 1 ATOM 997 C CA . LYS A 0 123 . -12.881 -6.346 9.426 1.00 95.04 123 A 1 ATOM 998 C C . LYS A 0 123 . -12.844 -6.219 7.908 1.00 95.04 123 A 1 ATOM 999 C CB . LYS A 0 123 . -14.075 -5.563 9.978 1.00 95.04 123 A 1 ATOM 1000 O O . LYS A 0 123 . -13.360 -7.098 7.222 1.00 95.04 123 A 1 ATOM 1001 C CG . LYS A 0 123 . -14.293 -5.803 11.476 1.00 95.04 123 A 1 ATOM 1002 C CD . LYS A 0 123 . -15.432 -4.907 11.964 1.00 95.04 123 A 1 ATOM 1003 C CE . LYS A 0 123 . -15.621 -5.071 13.471 1.00 95.04 123 A 1 ATOM 1004 N NZ . LYS A 0 123 . -16.582 -4.067 13.984 1.00 95.04 123 A 1 ATOM 1005 N N . CYS A 0 124 . -12.216 -5.165 7.386 1.00 94.29 124 A 1 ATOM 1006 C CA . CYS A 0 124 . -12.081 -4.933 5.950 1.00 94.29 124 A 1 ATOM 1007 C C . CYS A 0 124 . -11.310 -6.051 5.231 1.00 94.29 124 A 1 ATOM 1008 C CB . CYS A 0 124 . -11.426 -3.563 5.721 1.00 94.29 124 A 1 ATOM 1009 O O . CYS A 0 124 . -11.605 -6.348 4.078 1.00 94.29 124 A 1 ATOM 1010 S SG . CYS A 0 124 . -9.730 -3.503 6.375 1.00 94.29 124 A 1 ATOM 1011 N N . LEU A 0 125 . -10.371 -6.717 5.911 1.00 93.29 125 A 1 ATOM 1012 C CA . LEU A 0 125 . -9.579 -7.799 5.321 1.00 93.29 125 A 1 ATOM 1013 C C . LEU A 0 125 . -10.300 -9.153 5.352 1.00 93.29 125 A 1 ATOM 1014 C CB . LEU A 0 125 . -8.219 -7.894 6.025 1.00 93.29 125 A 1 ATOM 1015 O O . LEU A 0 125 . -9.916 -10.057 4.622 1.00 93.29 125 A 1 ATOM 1016 C CG . LEU A 0 125 . -7.354 -6.623 5.990 1.00 93.29 125 A 1 ATOM 1017 C CD1 . LEU A 0 125 . -6.024 -6.953 6.669 1.00 93.29 125 A 1 ATOM 1018 C CD2 . LEU A 0 125 . -7.076 -6.098 4.580 1.00 93.29 125 A 1 ATOM 1019 N N . GLY A 0 126 . -11.341 -9.313 6.172 1.00 86.11 126 A 1 ATOM 1020 C CA . GLY A 0 126 . -12.123 -10.553 6.246 1.00 86.11 126 A 1 ATOM 1021 C C . GLY A 0 126 . -13.138 -10.739 5.113 1.00 86.11 126 A 1 ATOM 1022 O O . GLY A 0 126 . -13.855 -11.735 5.111 1.00 86.11 126 A 1 ATOM 1023 N N . GLN A 0 127 . -13.244 -9.778 4.191 1.00 75.64 127 A 1 ATOM 1024 C CA . GLN A 0 127 . -14.237 -9.773 3.108 1.00 75.64 127 A 1 ATOM 1025 C C . GLN A 0 127 . -13.689 -10.273 1.760 1.00 75.64 127 A 1 ATOM 1026 C CB . GLN A 0 127 . -14.827 -8.359 2.972 1.00 75.64 127 A 1 ATOM 1027 O O . GLN A 0 127 . -14.460 -10.360 0.804 1.00 75.64 127 A 1 ATOM 1028 C CG . GLN A 0 127 . -15.556 -7.902 4.245 1.00 75.64 127 A 1 ATOM 1029 C CD . GLN A 0 127 . -16.198 -6.524 4.117 1.00 75.64 127 A 1 ATOM 1030 N NE2 . GLN A 0 127 . -16.837 -6.042 5.160 1.00 75.64 127 A 1 ATOM 1031 O OE1 . GLN A 0 127 . -16.160 -5.845 3.107 1.00 75.64 127 A 1 ATOM 1032 N N . PHE A 0 128 . -12.389 -10.579 1.684 1.00 64.25 128 A 1 ATOM 1033 C CA . PHE A 0 128 . -11.689 -10.999 0.464 1.00 64.25 128 A 1 ATOM 1034 C C . PHE A 0 128 . -11.447 -12.508 0.401 1.00 64.25 128 A 1 ATOM 1035 C CB . PHE A 0 128 . -10.373 -10.220 0.329 1.00 64.25 128 A 1 ATOM 1036 O O . PHE A 0 128 . -11.181 -13.118 1.462 1.00 64.25 128 A 1 ATOM 1037 C CG . PHE A 0 128 . -10.547 -8.742 0.049 1.00 64.25 128 A 1 ATOM 1038 C CD1 . PHE A 0 128 . -10.839 -8.304 -1.257 1.00 64.25 128 A 1 ATOM 1039 C CD2 . PHE A 0 128 . -10.416 -7.802 1.087 1.00 64.25 128 A 1 ATOM 1040 C CE1 . PHE A 0 128 . -10.984 -6.930 -1.527 1.00 64.25 128 A 1 ATOM 1041 C CE2 . PHE A 0 128 . -10.562 -6.429 0.819 1.00 64.25 128 A 1 ATOM 1042 C CZ . PHE A 0 128 . -10.842 -5.993 -0.488 1.00 64.25 128 A 1 ATOM 1043 O OXT . PHE A 0 128 . -11.483 -13.010 -0.743 1.00 64.25 128 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 81.19 # loop_ _atom_type.symbol C N O S #