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 ILE 0 4 SER 0 5 LEU 0 6 MET 0 7 SER 0 8 THR 0 9 VAL 0 10 LEU 0 11 CYS 0 12 GLY 0 13 PHE 0 14 ARG 0 15 ARG 0 16 ALA 0 17 CYS 0 18 LEU 0 19 ILE 0 20 ALA 0 21 ASN 0 22 TYR 0 23 SER 0 24 ALA 0 25 ILE 0 26 SER 0 27 LYS 0 28 THR 0 29 LEU 0 30 VAL 0 31 ALA 0 32 SER 0 33 LYS 0 34 LYS 0 35 CYS 0 36 LEU 0 37 GLY 0 38 ILE 0 39 PRO 0 40 PHE 0 41 LYS 0 42 ALA 0 43 PHE 0 44 PRO 0 45 LEU 0 46 SER 0 47 THR 0 48 PRO 0 49 CYS 0 50 ARG 0 51 PHE 0 52 PHE 0 53 ALA 0 54 HIS 0 55 GLY 0 56 ILE 0 57 PRO 0 58 LEU 0 59 THR 0 60 LYS 0 61 THR 0 62 MET 0 63 ILE 0 64 GLU 0 65 ASP 0 66 ARG 0 67 VAL 0 68 MET 0 69 LEU 0 70 VAL 0 71 LEU 0 72 ARG 0 73 LEU 0 74 TYR 0 75 ASP 0 76 LYS 0 77 ILE 0 78 ASP 0 79 PRO 0 80 TYR 0 81 LYS 0 82 ILE 0 83 ALA 0 84 LEU 0 85 ASN 0 86 SER 0 87 ARG 0 88 PHE 0 89 ASN 0 90 GLU 0 91 ASP 0 92 PHE 0 93 GLY 0 94 ILE 0 95 ASP 0 96 SER 0 97 LEU 0 98 ASP 0 99 HIS 0 100 VAL 0 101 GLU 0 102 LEU 0 103 VAL 0 104 MET 0 105 ALA 0 106 ILE 0 107 GLU 0 108 GLU 0 109 GLU 0 110 PHE 0 111 ASN 0 112 ILE 0 113 GLU 0 114 ILE 0 115 PRO 0 116 ASP 0 117 MET 0 118 ASP 0 119 SER 0 120 GLN 0 121 ARG 0 122 PHE 0 123 LEU 0 124 SER 0 125 PRO 0 126 GLN 0 127 ASP 0 128 ILE 0 129 ILE 0 130 GLN 0 131 TYR 0 132 LEU 0 133 CYS 0 134 ASP 0 135 ARG 0 136 HIS 0 137 ASP 0 138 VAL 0 139 TYR 0 140 ASP # 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 . 9.619 20.931 11.658 1.00 44.81 1 A 1 ATOM 2 C CA . MET A 0 1 . 9.128 22.142 10.961 1.00 44.81 1 A 1 ATOM 3 C C . MET A 0 1 . 8.143 21.825 9.817 1.00 44.81 1 A 1 ATOM 4 C CB . MET A 0 1 . 10.330 22.981 10.470 1.00 44.81 1 A 1 ATOM 5 O O . MET A 0 1 . 7.998 22.653 8.937 1.00 44.81 1 A 1 ATOM 6 C CG . MET A 0 1 . 11.000 23.761 11.608 1.00 44.81 1 A 1 ATOM 7 S SD . MET A 0 1 . 12.450 24.691 11.052 1.00 44.81 1 A 1 ATOM 8 C CE . MET A 0 1 . 12.658 25.860 12.423 1.00 44.81 1 A 1 ATOM 9 N N . ASN A 0 2 . 7.392 20.706 9.839 1.00 50.59 2 A 1 ATOM 10 C CA . ASN A 0 2 . 6.609 20.247 8.667 1.00 50.59 2 A 1 ATOM 11 C C . ASN A 0 2 . 5.146 19.854 8.974 1.00 50.59 2 A 1 ATOM 12 C CB . ASN A 0 2 . 7.380 19.108 7.964 1.00 50.59 2 A 1 ATOM 13 O O . ASN A 0 2 . 4.588 19.003 8.298 1.00 50.59 2 A 1 ATOM 14 C CG . ASN A 0 2 . 8.684 19.559 7.335 1.00 50.59 2 A 1 ATOM 15 N ND2 . ASN A 0 2 . 9.682 18.712 7.303 1.00 50.59 2 A 1 ATOM 16 O OD1 . ASN A 0 2 . 8.847 20.685 6.914 1.00 50.59 2 A 1 ATOM 17 N N . ILE A 0 3 . 4.510 20.444 9.992 1.00 61.42 3 A 1 ATOM 18 C CA . ILE A 0 3 . 3.122 20.095 10.378 1.00 61.42 3 A 1 ATOM 19 C C . ILE A 0 3 . 2.066 21.061 9.812 1.00 61.42 3 A 1 ATOM 20 C CB . ILE A 0 3 . 3.074 19.839 11.907 1.00 61.42 3 A 1 ATOM 21 O O . ILE A 0 3 . 0.889 20.727 9.779 1.00 61.42 3 A 1 ATOM 22 C CG1 . ILE A 0 3 . 3.447 18.354 12.138 1.00 61.42 3 A 1 ATOM 23 C CG2 . ILE A 0 3 . 1.740 20.171 12.596 1.00 61.42 3 A 1 ATOM 24 C CD1 . ILE A 0 3 . 4.109 18.085 13.491 1.00 61.42 3 A 1 ATOM 25 N N . SER A 0 4 . 2.460 22.224 9.280 1.00 53.96 4 A 1 ATOM 26 C CA . SER A 0 4 . 1.482 23.254 8.884 1.00 53.96 4 A 1 ATOM 27 C C . SER A 0 4 . 1.042 23.224 7.412 1.00 53.96 4 A 1 ATOM 28 C CB . SER A 0 4 . 1.982 24.648 9.269 1.00 53.96 4 A 1 ATOM 29 O O . SER A 0 4 . 0.114 23.949 7.065 1.00 53.96 4 A 1 ATOM 30 O OG . SER A 0 4 . 0.870 25.488 9.481 1.00 53.96 4 A 1 ATOM 31 N N . LEU A 0 5 . 1.675 22.418 6.549 1.00 53.20 5 A 1 ATOM 32 C CA . LEU A 0 5 . 1.387 22.384 5.102 1.00 53.20 5 A 1 ATOM 33 C C . LEU A 0 5 . 0.421 21.265 4.670 1.00 53.20 5 A 1 ATOM 34 C CB . LEU A 0 5 . 2.719 22.354 4.320 1.00 53.20 5 A 1 ATOM 35 O O . LEU A 0 5 . -0.077 21.296 3.551 1.00 53.20 5 A 1 ATOM 36 C CG . LEU A 0 5 . 3.270 23.764 4.028 1.00 53.20 5 A 1 ATOM 37 C CD1 . LEU A 0 5 . 4.766 23.706 3.720 1.00 53.20 5 A 1 ATOM 38 C CD2 . LEU A 0 5 . 2.563 24.406 2.831 1.00 53.20 5 A 1 ATOM 39 N N . MET A 0 6 . 0.102 20.306 5.546 1.00 54.15 6 A 1 ATOM 40 C CA . MET A 0 6 . -0.786 19.178 5.212 1.00 54.15 6 A 1 ATOM 41 C C . MET A 0 6 . -2.282 19.483 5.424 1.00 54.15 6 A 1 ATOM 42 C CB . MET A 0 6 . -0.339 17.932 5.990 1.00 54.15 6 A 1 ATOM 43 O O . MET A 0 6 . -3.125 18.839 4.809 1.00 54.15 6 A 1 ATOM 44 C CG . MET A 0 6 . 0.963 17.317 5.450 1.00 54.15 6 A 1 ATOM 45 S SD . MET A 0 6 . 0.743 15.920 4.307 1.00 54.15 6 A 1 ATOM 46 C CE . MET A 0 6 . 0.809 16.720 2.681 1.00 54.15 6 A 1 ATOM 47 N N . SER A 0 7 . -2.643 20.501 6.216 1.00 52.50 7 A 1 ATOM 48 C CA . SER A 0 7 . -4.058 20.828 6.481 1.00 52.50 7 A 1 ATOM 49 C C . SER A 0 7 . -4.730 21.679 5.396 1.00 52.50 7 A 1 ATOM 50 C CB . SER A 0 7 . -4.226 21.503 7.846 1.00 52.50 7 A 1 ATOM 51 O O . SER A 0 7 . -5.949 21.821 5.404 1.00 52.50 7 A 1 ATOM 52 O OG . SER A 0 7 . -3.752 20.650 8.866 1.00 52.50 7 A 1 ATOM 53 N N . THR A 0 8 . -3.976 22.255 4.454 1.00 52.49 8 A 1 ATOM 54 C CA . THR A 0 8 . -4.532 23.148 3.417 1.00 52.49 8 A 1 ATOM 55 C C . THR A 0 8 . -4.999 22.411 2.159 1.00 52.49 8 A 1 ATOM 56 C CB . THR A 0 8 . -3.566 24.292 3.044 1.00 52.49 8 A 1 ATOM 57 O O . THR A 0 8 . -5.726 22.992 1.360 1.00 52.49 8 A 1 ATOM 58 C CG2 . THR A 0 8 . -4.264 25.649 3.131 1.00 52.49 8 A 1 ATOM 59 O OG1 . THR A 0 8 . -2.456 24.364 3.914 1.00 52.49 8 A 1 ATOM 60 N N . VAL A 0 9 . -4.646 21.132 2.000 1.00 51.79 9 A 1 ATOM 61 C CA . VAL A 0 9 . -5.038 20.321 0.831 1.00 51.79 9 A 1 ATOM 62 C C . VAL A 0 9 . -6.294 19.475 1.116 1.00 51.79 9 A 1 ATOM 63 C CB . VAL A 0 9 . -3.848 19.482 0.307 1.00 51.79 9 A 1 ATOM 64 O O . VAL A 0 9 . -7.066 19.185 0.207 1.00 51.79 9 A 1 ATOM 65 C CG1 . VAL A 0 9 . -4.058 19.107 -1.165 1.00 51.79 9 A 1 ATOM 66 C CG2 . VAL A 0 9 . -2.506 20.234 0.388 1.00 51.79 9 A 1 ATOM 67 N N . LEU A 0 10 . -6.592 19.187 2.392 1.00 50.79 10 A 1 ATOM 68 C CA . LEU A 0 10 . -7.737 18.358 2.808 1.00 50.79 10 A 1 ATOM 69 C C . LEU A 0 10 . -9.119 19.049 2.769 1.00 50.79 10 A 1 ATOM 70 C CB . LEU A 0 10 . -7.466 17.745 4.202 1.00 50.79 10 A 1 ATOM 71 O O . LEU A 0 10 . -10.134 18.387 2.958 1.00 50.79 10 A 1 ATOM 72 C CG . LEU A 0 10 . -7.010 16.272 4.151 1.00 50.79 10 A 1 ATOM 73 C CD1 . LEU A 0 10 . -5.487 16.163 4.079 1.00 50.79 10 A 1 ATOM 74 C CD2 . LEU A 0 10 . -7.497 15.540 5.400 1.00 50.79 10 A 1 ATOM 75 N N . CYS A 0 11 . -9.207 20.356 2.498 1.00 48.32 11 A 1 ATOM 76 C CA . CYS A 0 11 . -10.498 21.066 2.407 1.00 48.32 11 A 1 ATOM 77 C C . CYS A 0 11 . -11.029 21.197 0.956 1.00 48.32 11 A 1 ATOM 78 C CB . CYS A 0 11 . -10.370 22.403 3.158 1.00 48.32 11 A 1 ATOM 79 O O . CYS A 0 11 . -12.077 21.800 0.728 1.00 48.32 11 A 1 ATOM 80 S SG . CYS A 0 11 . -11.994 22.993 3.733 1.00 48.32 11 A 1 ATOM 81 N N . GLY A 0 12 . -10.312 20.654 -0.039 1.00 45.10 12 A 1 ATOM 82 C CA . GLY A 0 12 . -10.556 20.933 -1.462 1.00 45.10 12 A 1 ATOM 83 C C . GLY A 0 12 . -11.517 19.998 -2.208 1.00 45.10 12 A 1 ATOM 84 O O . GLY A 0 12 . -12.103 20.430 -3.196 1.00 45.10 12 A 1 ATOM 85 N N . PHE A 0 13 . -11.722 18.753 -1.765 1.00 50.88 13 A 1 ATOM 86 C CA . PHE A 0 13 . -12.345 17.731 -2.630 1.00 50.88 13 A 1 ATOM 87 C C . PHE A 0 13 . -13.795 17.341 -2.306 1.00 50.88 13 A 1 ATOM 88 C CB . PHE A 0 13 . -11.393 16.537 -2.787 1.00 50.88 13 A 1 ATOM 89 O O . PHE A 0 13 . -14.433 16.653 -3.093 1.00 50.88 13 A 1 ATOM 90 C CG . PHE A 0 13 . -10.543 16.679 -4.036 1.00 50.88 13 A 1 ATOM 91 C CD1 . PHE A 0 13 . -11.025 16.174 -5.258 1.00 50.88 13 A 1 ATOM 92 C CD2 . PHE A 0 13 . -9.311 17.360 -3.998 1.00 50.88 13 A 1 ATOM 93 C CE1 . PHE A 0 13 . -10.275 16.336 -6.435 1.00 50.88 13 A 1 ATOM 94 C CE2 . PHE A 0 13 . -8.561 17.524 -5.178 1.00 50.88 13 A 1 ATOM 95 C CZ . PHE A 0 13 . -9.043 17.010 -6.395 1.00 50.88 13 A 1 ATOM 96 N N . ARG A 0 14 . -14.393 17.849 -1.219 1.00 46.47 14 A 1 ATOM 97 C CA . ARG A 0 14 . -15.757 17.452 -0.802 1.00 46.47 14 A 1 ATOM 98 C C . ARG A 0 14 . -16.888 18.428 -1.184 1.00 46.47 14 A 1 ATOM 99 C CB . ARG A 0 14 . -15.742 17.008 0.681 1.00 46.47 14 A 1 ATOM 100 O O . ARG A 0 14 . -17.977 18.327 -0.626 1.00 46.47 14 A 1 ATOM 101 C CG . ARG A 0 14 . -16.198 15.546 0.827 1.00 46.47 14 A 1 ATOM 102 C CD . ARG A 0 14 . -16.225 15.095 2.294 1.00 46.47 14 A 1 ATOM 103 N NE . ARG A 0 14 . -16.924 13.803 2.445 1.00 46.47 14 A 1 ATOM 104 N NH1 . ARG A 0 14 . -16.841 13.642 4.740 1.00 46.47 14 A 1 ATOM 105 N NH2 . ARG A 0 14 . -17.789 12.012 3.564 1.00 46.47 14 A 1 ATOM 106 C CZ . ARG A 0 14 . -17.188 13.167 3.577 1.00 46.47 14 A 1 ATOM 107 N N . ARG A 0 15 . -16.667 19.394 -2.096 1.00 41.90 15 A 1 ATOM 108 C CA . ARG A 0 15 . -17.615 20.520 -2.315 1.00 41.90 15 A 1 ATOM 109 C C . ARG A 0 15 . -17.958 20.937 -3.754 1.00 41.90 15 A 1 ATOM 110 C CB . ARG A 0 15 . -17.190 21.727 -1.448 1.00 41.90 15 A 1 ATOM 111 O O . ARG A 0 15 . -18.585 21.977 -3.915 1.00 41.90 15 A 1 ATOM 112 C CG . ARG A 0 15 . -18.314 22.126 -0.480 1.00 41.90 15 A 1 ATOM 113 C CD . ARG A 0 15 . -17.891 23.329 0.366 1.00 41.90 15 A 1 ATOM 114 N NE . ARG A 0 15 . -18.866 23.601 1.440 1.00 41.90 15 A 1 ATOM 115 N NH1 . ARG A 0 15 . -17.933 25.556 2.188 1.00 41.90 15 A 1 ATOM 116 N NH2 . ARG A 0 15 . -19.732 24.726 3.220 1.00 41.90 15 A 1 ATOM 117 C CZ . ARG A 0 15 . -18.841 24.624 2.274 1.00 41.90 15 A 1 ATOM 118 N N . ALA A 0 16 . -17.623 20.164 -4.787 1.00 40.66 16 A 1 ATOM 119 C CA . ALA A 0 16 . -17.951 20.541 -6.174 1.00 40.66 16 A 1 ATOM 120 C C . ALA A 0 16 . -19.306 20.009 -6.695 1.00 40.66 16 A 1 ATOM 121 C CB . ALA A 0 16 . -16.770 20.190 -7.081 1.00 40.66 16 A 1 ATOM 122 O O . ALA A 0 16 . -19.641 20.207 -7.862 1.00 40.66 16 A 1 ATOM 123 N N . CYS A 0 17 . -20.116 19.364 -5.848 1.00 33.57 17 A 1 ATOM 124 C CA . CYS A 0 17 . -21.489 19.014 -6.199 1.00 33.57 17 A 1 ATOM 125 C C . CYS A 0 17 . -22.402 20.239 -6.013 1.00 33.57 17 A 1 ATOM 126 C CB . CYS A 0 17 . -21.934 17.790 -5.381 1.00 33.57 17 A 1 ATOM 127 O O . CYS A 0 17 . -22.541 20.740 -4.898 1.00 33.57 17 A 1 ATOM 128 S SG . CYS A 0 17 . -23.349 16.983 -6.186 1.00 33.57 17 A 1 ATOM 129 N N . LEU A 0 18 . -23.057 20.635 -7.108 1.00 36.36 18 A 1 ATOM 130 C CA . LEU A 0 18 . -24.206 21.543 -7.212 1.00 36.36 18 A 1 ATOM 131 C C . LEU A 0 18 . -23.914 23.056 -7.247 1.00 36.36 18 A 1 ATOM 132 C CB . LEU A 0 18 . -25.291 21.181 -6.171 1.00 36.36 18 A 1 ATOM 133 O O . LEU A 0 18 . -23.172 23.599 -6.440 1.00 36.36 18 A 1 ATOM 134 C CG . LEU A 0 18 . -25.852 19.751 -6.313 1.00 36.36 18 A 1 ATOM 135 C CD1 . LEU A 0 18 . -25.982 19.055 -4.959 1.00 36.36 18 A 1 ATOM 136 C CD2 . LEU A 0 18 . -27.234 19.801 -6.967 1.00 36.36 18 A 1 ATOM 137 N N . ILE A 0 19 . -24.682 23.731 -8.118 1.00 46.76 19 A 1 ATOM 138 C CA . ILE A 0 19 . -24.914 25.187 -8.236 1.00 46.76 19 A 1 ATOM 139 C C . ILE A 0 19 . -23.969 25.855 -9.260 1.00 46.76 19 A 1 ATOM 140 C CB . ILE A 0 19 . -24.988 25.890 -6.852 1.00 46.76 19 A 1 ATOM 141 O O . ILE A 0 19 . -22.856 26.250 -8.951 1.00 46.76 19 A 1 ATOM 142 C CG1 . ILE A 0 19 . -25.884 25.159 -5.812 1.00 46.76 19 A 1 ATOM 143 C CG2 . ILE A 0 19 . -25.544 27.316 -7.011 1.00 46.76 19 A 1 ATOM 144 C CD1 . ILE A 0 19 . -25.481 25.463 -4.365 1.00 46.76 19 A 1 ATOM 145 N N . ALA A 0 20 . -24.308 25.823 -10.551 1.00 37.80 20 A 1 ATOM 146 C CA . ALA A 0 20 . -25.182 26.787 -11.240 1.00 37.80 20 A 1 ATOM 147 C C . ALA A 0 20 . -24.482 28.101 -11.652 1.00 37.80 20 A 1 ATOM 148 C CB . ALA A 0 20 . -26.507 27.049 -10.505 1.00 37.80 20 A 1 ATOM 149 O O . ALA A 0 20 . -23.661 28.645 -10.921 1.00 37.80 20 A 1 ATOM 150 N N . ASN A 0 21 . -24.943 28.635 -12.792 1.00 44.36 21 A 1 ATOM 151 C CA . ASN A 0 21 . -24.742 29.995 -13.324 1.00 44.36 21 A 1 ATOM 152 C C . ASN A 0 21 . -23.475 30.136 -14.192 1.00 44.36 21 A 1 ATOM 153 C CB . ASN A 0 21 . -24.888 31.036 -12.193 1.00 44.36 21 A 1 ATOM 154 O O . ASN A 0 21 . -22.383 30.393 -13.707 1.00 44.36 21 A 1 ATOM 155 C CG . ASN A 0 21 . -26.078 30.746 -11.289 1.00 44.36 21 A 1 ATOM 156 N ND2 . ASN A 0 21 . -25.900 30.792 -9.990 1.00 44.36 21 A 1 ATOM 157 O OD1 . ASN A 0 21 . -27.165 30.412 -11.733 1.00 44.36 21 A 1 ATOM 158 N N . TYR A 0 22 . -23.522 29.911 -15.510 1.00 41.74 22 A 1 ATOM 159 C CA . TYR A 0 22 . -24.286 30.702 -16.485 1.00 41.74 22 A 1 ATOM 160 C C . TYR A 0 22 . -24.439 32.176 -16.081 1.00 41.74 22 A 1 ATOM 161 C CB . TYR A 0 22 . -25.620 30.063 -16.917 1.00 41.74 22 A 1 ATOM 162 O O . TYR A 0 22 . -25.272 32.538 -15.260 1.00 41.74 22 A 1 ATOM 163 C CG . TYR A 0 22 . -25.489 29.127 -18.109 1.00 41.74 22 A 1 ATOM 164 C CD1 . TYR A 0 22 . -25.532 29.631 -19.427 1.00 41.74 22 A 1 ATOM 165 C CD2 . TYR A 0 22 . -25.316 27.747 -17.896 1.00 41.74 22 A 1 ATOM 166 C CE1 . TYR A 0 22 . -25.399 28.755 -20.524 1.00 41.74 22 A 1 ATOM 167 C CE2 . TYR A 0 22 . -25.189 26.868 -18.990 1.00 41.74 22 A 1 ATOM 168 O OH . TYR A 0 22 . -25.107 26.532 -21.367 1.00 41.74 22 A 1 ATOM 169 C CZ . TYR A 0 22 . -25.230 27.372 -20.307 1.00 41.74 22 A 1 ATOM 170 N N . SER A 0 23 . -23.698 33.017 -16.799 1.00 35.55 23 A 1 ATOM 171 C CA . SER A 0 23 . -23.922 34.452 -16.974 1.00 35.55 23 A 1 ATOM 172 C C . SER A 0 23 . -23.560 35.398 -15.820 1.00 35.55 23 A 1 ATOM 173 C CB . SER A 0 23 . -25.336 34.725 -17.515 1.00 35.55 23 A 1 ATOM 174 O O . SER A 0 23 . -23.903 35.212 -14.661 1.00 35.55 23 A 1 ATOM 175 O OG . SER A 0 23 . -26.278 34.874 -16.479 1.00 35.55 23 A 1 ATOM 176 N N . ALA A 0 24 . -22.951 36.506 -16.244 1.00 37.55 24 A 1 ATOM 177 C CA . ALA A 0 24 . -23.101 37.831 -15.662 1.00 37.55 24 A 1 ATOM 178 C C . ALA A 0 24 . -22.529 38.065 -14.255 1.00 37.55 24 A 1 ATOM 179 C CB . ALA A 0 24 . -24.572 38.254 -15.799 1.00 37.55 24 A 1 ATOM 180 O O . ALA A 0 24 . -23.242 38.107 -13.259 1.00 37.55 24 A 1 ATOM 181 N N . ILE A 0 25 . -21.264 38.490 -14.223 1.00 47.22 25 A 1 ATOM 182 C CA . ILE A 0 25 . -20.877 39.588 -13.333 1.00 47.22 25 A 1 ATOM 183 C C . ILE A 0 25 . -20.308 40.708 -14.204 1.00 47.22 25 A 1 ATOM 184 C CB . ILE A 0 25 . -20.000 39.140 -12.142 1.00 47.22 25 A 1 ATOM 185 O O . ILE A 0 25 . -19.107 40.857 -14.404 1.00 47.22 25 A 1 ATOM 186 C CG1 . ILE A 0 25 . -20.740 38.048 -11.329 1.00 47.22 25 A 1 ATOM 187 C CG2 . ILE A 0 25 . -19.699 40.356 -11.240 1.00 47.22 25 A 1 ATOM 188 C CD1 . ILE A 0 25 . -19.960 37.478 -10.141 1.00 47.22 25 A 1 ATOM 189 N N . SER A 0 26 . -21.233 41.507 -14.741 1.00 34.24 26 A 1 ATOM 190 C CA . SER A 0 26 . -21.011 42.937 -14.936 1.00 34.24 26 A 1 ATOM 191 C C . SER A 0 26 . -20.531 43.537 -13.621 1.00 34.24 26 A 1 ATOM 192 C CB . SER A 0 26 . -22.341 43.637 -15.263 1.00 34.24 26 A 1 ATOM 193 O O . SER A 0 26 . -21.164 43.290 -12.594 1.00 34.24 26 A 1 ATOM 194 O OG . SER A 0 26 . -22.693 43.447 -16.613 1.00 34.24 26 A 1 ATOM 195 N N . LYS A 0 27 . -19.504 44.390 -13.675 1.00 47.67 27 A 1 ATOM 196 C CA . LYS A 0 27 . -19.504 45.708 -13.021 1.00 47.67 27 A 1 ATOM 197 C C . LYS A 0 27 . -18.245 46.508 -13.384 1.00 47.67 27 A 1 ATOM 198 C CB . LYS A 0 27 . -19.698 45.597 -11.490 1.00 47.67 27 A 1 ATOM 199 O O . LYS A 0 27 . -17.134 46.186 -12.990 1.00 47.67 27 A 1 ATOM 200 C CG . LYS A 0 27 . -21.186 45.786 -11.098 1.00 47.67 27 A 1 ATOM 201 C CD . LYS A 0 27 . -21.544 45.061 -9.793 1.00 47.67 27 A 1 ATOM 202 C CE . LYS A 0 27 . -23.060 44.865 -9.668 1.00 47.67 27 A 1 ATOM 203 N NZ . LYS A 0 27 . -23.436 44.374 -8.318 1.00 47.67 27 A 1 ATOM 204 N N . THR A 0 28 . -18.513 47.587 -14.121 1.00 38.72 28 A 1 ATOM 205 C CA . THR A 0 28 . -17.977 48.942 -13.912 1.00 38.72 28 A 1 ATOM 206 C C . THR A 0 28 . -16.473 49.173 -14.048 1.00 38.72 28 A 1 ATOM 207 C CB . THR A 0 28 . -18.467 49.509 -12.561 1.00 38.72 28 A 1 ATOM 208 O O . THR A 0 28 . -15.758 49.113 -13.059 1.00 38.72 28 A 1 ATOM 209 C CG2 . THR A 0 28 . -19.995 49.547 -12.476 1.00 38.72 28 A 1 ATOM 210 O OG1 . THR A 0 28 . -18.029 48.727 -11.478 1.00 38.72 28 A 1 ATOM 211 N N . LEU A 0 29 . -16.046 49.652 -15.221 1.00 42.46 29 A 1 ATOM 212 C CA . LEU A 0 29 . -15.050 50.726 -15.327 1.00 42.46 29 A 1 ATOM 213 C C . LEU A 0 29 . -15.429 51.637 -16.508 1.00 42.46 29 A 1 ATOM 214 C CB . LEU A 0 29 . -13.611 50.171 -15.410 1.00 42.46 29 A 1 ATOM 215 O O . LEU A 0 29 . -15.377 51.254 -17.674 1.00 42.46 29 A 1 ATOM 216 C CG . LEU A 0 29 . -12.879 50.099 -14.048 1.00 42.46 29 A 1 ATOM 217 C CD1 . LEU A 0 29 . -11.575 49.319 -14.185 1.00 42.46 29 A 1 ATOM 218 C CD2 . LEU A 0 29 . -12.557 51.488 -13.485 1.00 42.46 29 A 1 ATOM 219 N N . VAL A 0 30 . -15.905 52.831 -16.155 1.00 47.34 30 A 1 ATOM 220 C CA . VAL A 0 30 . -16.328 53.931 -17.029 1.00 47.34 30 A 1 ATOM 221 C C . VAL A 0 30 . -15.176 54.929 -17.170 1.00 47.34 30 A 1 ATOM 222 C CB . VAL A 0 30 . -17.571 54.620 -16.405 1.00 47.34 30 A 1 ATOM 223 O O . VAL A 0 30 . -14.586 55.296 -16.161 1.00 47.34 30 A 1 ATOM 224 C CG1 . VAL A 0 30 . -17.885 56.024 -16.938 1.00 47.34 30 A 1 ATOM 225 C CG2 . VAL A 0 30 . -18.818 53.756 -16.621 1.00 47.34 30 A 1 ATOM 226 N N . ALA A 0 31 . -14.989 55.432 -18.401 1.00 44.67 31 A 1 ATOM 227 C CA . ALA A 0 31 . -14.250 56.649 -18.789 1.00 44.67 31 A 1 ATOM 228 C C . ALA A 0 31 . -12.712 56.601 -18.595 1.00 44.67 31 A 1 ATOM 229 C CB . ALA A 0 31 . -14.934 57.860 -18.136 1.00 44.67 31 A 1 ATOM 230 O O . ALA A 0 31 . -12.206 55.999 -17.669 1.00 44.67 31 A 1 ATOM 231 N N . SER A 0 32 . -11.857 57.201 -19.425 1.00 44.05 32 A 1 ATOM 232 C CA . SER A 0 32 . -12.004 58.310 -20.366 1.00 44.05 32 A 1 ATOM 233 C C . SER A 0 32 . -10.882 58.267 -21.420 1.00 44.05 32 A 1 ATOM 234 C CB . SER A 0 32 . -11.871 59.624 -19.589 1.00 44.05 32 A 1 ATOM 235 O O . SER A 0 32 . -9.859 57.612 -21.250 1.00 44.05 32 A 1 ATOM 236 O OG . SER A 0 32 . -12.236 60.720 -20.405 1.00 44.05 32 A 1 ATOM 237 N N . LYS A 0 33 . -11.104 58.987 -22.521 1.00 39.54 33 A 1 ATOM 238 C CA . LYS A 0 33 . -10.290 59.076 -23.741 1.00 39.54 33 A 1 ATOM 239 C C . LYS A 0 33 . -9.002 59.899 -23.551 1.00 39.54 33 A 1 ATOM 240 C CB . LYS A 0 33 . -11.163 59.748 -24.822 1.00 39.54 33 A 1 ATOM 241 O O . LYS A 0 33 . -9.010 60.862 -22.793 1.00 39.54 33 A 1 ATOM 242 C CG . LYS A 0 33 . -12.428 58.953 -25.198 1.00 39.54 33 A 1 ATOM 243 C CD . LYS A 0 33 . -13.318 59.755 -26.162 1.00 39.54 33 A 1 ATOM 244 C CE . LYS A 0 33 . -14.502 58.899 -26.634 1.00 39.54 33 A 1 ATOM 245 N NZ . LYS A 0 33 . -15.422 59.655 -27.524 1.00 39.54 33 A 1 ATOM 246 N N . LYS A 0 34 . -8.032 59.625 -24.442 1.00 40.63 34 A 1 ATOM 247 C CA . LYS A 0 34 . -6.838 60.407 -24.861 1.00 40.63 34 A 1 ATOM 248 C C . LYS A 0 34 . -5.497 59.952 -24.271 1.00 40.63 34 A 1 ATOM 249 C CB . LYS A 0 34 . -6.980 61.933 -24.669 1.00 40.63 34 A 1 ATOM 250 O O . LYS A 0 34 . -5.203 60.229 -23.121 1.00 40.63 34 A 1 ATOM 251 C CG . LYS A 0 34 . -8.077 62.588 -25.520 1.00 40.63 34 A 1 ATOM 252 C CD . LYS A 0 34 . -8.154 64.085 -25.191 1.00 40.63 34 A 1 ATOM 253 C CE . LYS A 0 34 . -9.145 64.806 -26.110 1.00 40.63 34 A 1 ATOM 254 N NZ . LYS A 0 34 . -9.156 66.267 -25.843 1.00 40.63 34 A 1 ATOM 255 N N . CYS A 0 35 . -4.683 59.333 -25.129 1.00 39.46 35 A 1 ATOM 256 C CA . CYS A 0 35 . -3.267 59.643 -25.405 1.00 39.46 35 A 1 ATOM 257 C C . CYS A 0 35 . -2.778 58.605 -26.435 1.00 39.46 35 A 1 ATOM 258 C CB . CYS A 0 35 . -2.409 59.640 -24.132 1.00 39.46 35 A 1 ATOM 259 O O . CYS A 0 35 . -2.797 57.411 -26.174 1.00 39.46 35 A 1 ATOM 260 S SG . CYS A 0 35 . -2.310 61.350 -23.514 1.00 39.46 35 A 1 ATOM 261 N N . LEU A 0 36 . -2.667 58.972 -27.713 1.00 47.01 36 A 1 ATOM 262 C CA . LEU A 0 36 . -1.431 59.473 -28.332 1.00 47.01 36 A 1 ATOM 263 C C . LEU A 0 36 . -0.265 58.476 -28.229 1.00 47.01 36 A 1 ATOM 264 C CB . LEU A 0 36 . -1.062 60.901 -27.876 1.00 47.01 36 A 1 ATOM 265 O O . LEU A 0 36 . 0.448 58.435 -27.237 1.00 47.01 36 A 1 ATOM 266 C CG . LEU A 0 36 . -1.817 61.987 -28.668 1.00 47.01 36 A 1 ATOM 267 C CD1 . LEU A 0 36 . -1.976 63.257 -27.837 1.00 47.01 36 A 1 ATOM 268 C CD2 . LEU A 0 36 . -1.079 62.344 -29.962 1.00 47.01 36 A 1 ATOM 269 N N . GLY A 0 37 . -0.095 57.719 -29.318 1.00 41.59 37 A 1 ATOM 270 C CA . GLY A 0 37 . 1.195 57.422 -29.944 1.00 41.59 37 A 1 ATOM 271 C C . GLY A 0 37 . 2.278 56.790 -29.077 1.00 41.59 37 A 1 ATOM 272 O O . GLY A 0 37 . 3.176 57.483 -28.615 1.00 41.59 37 A 1 ATOM 273 N N . ILE A 0 38 . 2.280 55.460 -28.991 1.00 59.19 38 A 1 ATOM 274 C CA . ILE A 0 38 . 3.483 54.692 -28.653 1.00 59.19 38 A 1 ATOM 275 C C . ILE A 0 38 . 3.535 53.498 -29.615 1.00 59.19 38 A 1 ATOM 276 C CB . ILE A 0 38 . 3.519 54.233 -27.174 1.00 59.19 38 A 1 ATOM 277 O O . ILE A 0 38 . 2.523 52.804 -29.750 1.00 59.19 38 A 1 ATOM 278 C CG1 . ILE A 0 38 . 2.896 55.251 -26.188 1.00 59.19 38 A 1 ATOM 279 C CG2 . ILE A 0 38 . 4.985 53.941 -26.797 1.00 59.19 38 A 1 ATOM 280 C CD1 . ILE A 0 38 . 2.775 54.731 -24.752 1.00 59.19 38 A 1 ATOM 281 N N . PRO A 0 39 . 4.649 53.258 -30.331 1.00 51.93 39 A 1 ATOM 282 C CA . PRO A 0 39 . 4.736 52.130 -31.246 1.00 51.93 39 A 1 ATOM 283 C C . PRO A 0 39 . 4.688 50.825 -30.445 1.00 51.93 39 A 1 ATOM 284 C CB . PRO A 0 39 . 6.045 52.325 -32.018 1.00 51.93 39 A 1 ATOM 285 O O . PRO A 0 39 . 5.529 50.584 -29.578 1.00 51.93 39 A 1 ATOM 286 C CG . PRO A 0 39 . 6.916 53.125 -31.050 1.00 51.93 39 A 1 ATOM 287 C CD . PRO A 0 39 . 5.905 53.993 -30.302 1.00 51.93 39 A 1 ATOM 288 N N . PHE A 0 40 . 3.700 49.980 -30.744 1.00 45.03 40 A 1 ATOM 289 C CA . PHE A 0 40 . 3.665 48.587 -30.308 1.00 45.03 40 A 1 ATOM 290 C C . PHE A 0 40 . 4.957 47.906 -30.787 1.00 45.03 40 A 1 ATOM 291 C CB . PHE A 0 40 . 2.412 47.892 -30.889 1.00 45.03 40 A 1 ATOM 292 O O . PHE A 0 40 . 5.116 47.627 -31.975 1.00 45.03 40 A 1 ATOM 293 C CG . PHE A 0 40 . 1.287 47.637 -29.903 1.00 45.03 40 A 1 ATOM 294 C CD1 . PHE A 0 40 . 1.148 46.363 -29.319 1.00 45.03 40 A 1 ATOM 295 C CD2 . PHE A 0 40 . 0.358 48.649 -29.591 1.00 45.03 40 A 1 ATOM 296 C CE1 . PHE A 0 40 . 0.088 46.099 -28.434 1.00 45.03 40 A 1 ATOM 297 C CE2 . PHE A 0 40 . -0.703 48.384 -28.705 1.00 45.03 40 A 1 ATOM 298 C CZ . PHE A 0 40 . -0.839 47.109 -28.128 1.00 45.03 40 A 1 ATOM 299 N N . LYS A 0 41 . 5.900 47.638 -29.875 1.00 54.50 41 A 1 ATOM 300 C CA . LYS A 0 41 . 6.955 46.655 -30.136 1.00 54.50 41 A 1 ATOM 301 C C . LYS A 0 41 . 6.263 45.303 -30.272 1.00 54.50 41 A 1 ATOM 302 C CB . LYS A 0 41 . 8.014 46.638 -29.018 1.00 54.50 41 A 1 ATOM 303 O O . LYS A 0 41 . 5.636 44.842 -29.322 1.00 54.50 41 A 1 ATOM 304 C CG . LYS A 0 41 . 9.102 47.701 -29.236 1.00 54.50 41 A 1 ATOM 305 C CD . LYS A 0 41 . 10.164 47.634 -28.128 1.00 54.50 41 A 1 ATOM 306 C CE . LYS A 0 41 . 11.308 48.615 -28.417 1.00 54.50 41 A 1 ATOM 307 N NZ . LYS A 0 41 . 12.313 48.624 -27.323 1.00 54.50 41 A 1 ATOM 308 N N . ALA A 0 42 . 6.351 44.708 -31.460 1.00 57.61 42 A 1 ATOM 309 C CA . ALA A 0 42 . 5.900 43.350 -31.708 1.00 57.61 42 A 1 ATOM 310 C C . ALA A 0 42 . 6.586 42.420 -30.699 1.00 57.61 42 A 1 ATOM 311 C CB . ALA A 0 42 . 6.215 42.979 -33.164 1.00 57.61 42 A 1 ATOM 312 O O . ALA A 0 42 . 7.805 42.249 -30.719 1.00 57.61 42 A 1 ATOM 313 N N . PHE A 0 43 . 5.796 41.881 -29.774 1.00 54.81 43 A 1 ATOM 314 C CA . PHE A 0 43 . 6.224 40.795 -28.909 1.00 54.81 43 A 1 ATOM 315 C C . PHE A 0 43 . 6.545 39.608 -29.827 1.00 54.81 43 A 1 ATOM 316 C CB . PHE A 0 43 . 5.091 40.487 -27.917 1.00 54.81 43 A 1 ATOM 317 O O . PHE A 0 43 . 5.727 39.316 -30.708 1.00 54.81 43 A 1 ATOM 318 C CG . PHE A 0 43 . 5.546 39.894 -26.601 1.00 54.81 43 A 1 ATOM 319 C CD1 . PHE A 0 43 . 5.528 38.502 -26.395 1.00 54.81 43 A 1 ATOM 320 C CD2 . PHE A 0 43 . 5.956 40.751 -25.561 1.00 54.81 43 A 1 ATOM 321 C CE1 . PHE A 0 43 . 5.908 37.973 -25.149 1.00 54.81 43 A 1 ATOM 322 C CE2 . PHE A 0 43 . 6.339 40.220 -24.317 1.00 54.81 43 A 1 ATOM 323 C CZ . PHE A 0 43 . 6.311 38.831 -24.110 1.00 54.81 43 A 1 ATOM 324 N N . PRO A 0 44 . 7.712 38.952 -29.706 1.00 55.59 44 A 1 ATOM 325 C CA . PRO A 0 44 . 7.975 37.766 -30.501 1.00 55.59 44 A 1 ATOM 326 C C . PRO A 0 44 . 6.872 36.753 -30.188 1.00 55.59 44 A 1 ATOM 327 C CB . PRO A 0 44 . 9.379 37.296 -30.106 1.00 55.59 44 A 1 ATOM 328 O O . PRO A 0 44 . 6.662 36.399 -29.029 1.00 55.59 44 A 1 ATOM 329 C CG . PRO A 0 44 . 9.574 37.870 -28.702 1.00 55.59 44 A 1 ATOM 330 C CD . PRO A 0 44 . 8.757 39.162 -28.718 1.00 55.59 44 A 1 ATOM 331 N N . LEU A 0 45 . 6.135 36.339 -31.221 1.00 51.53 45 A 1 ATOM 332 C CA . LEU A 0 45 . 5.227 35.201 -31.156 1.00 51.53 45 A 1 ATOM 333 C C . LEU A 0 45 . 6.081 33.990 -30.774 1.00 51.53 45 A 1 ATOM 334 C CB . LEU A 0 45 . 4.539 35.012 -32.528 1.00 51.53 45 A 1 ATOM 335 O O . LEU A 0 45 . 6.716 33.382 -31.635 1.00 51.53 45 A 1 ATOM 336 C CG . LEU A 0 45 . 3.368 35.977 -32.797 1.00 51.53 45 A 1 ATOM 337 C CD1 . LEU A 0 45 . 3.062 36.038 -34.295 1.00 51.53 45 A 1 ATOM 338 C CD2 . LEU A 0 45 . 2.096 35.521 -32.077 1.00 51.53 45 A 1 ATOM 339 N N . SER A 0 46 . 6.152 33.675 -29.479 1.00 61.98 46 A 1 ATOM 340 C CA . SER A 0 46 . 6.695 32.404 -29.032 1.00 61.98 46 A 1 ATOM 341 C C . SER A 0 46 . 5.742 31.336 -29.548 1.00 61.98 46 A 1 ATOM 342 C CB . SER A 0 46 . 6.913 32.343 -27.513 1.00 61.98 46 A 1 ATOM 343 O O . SER A 0 46 . 4.620 31.168 -29.071 1.00 61.98 46 A 1 ATOM 344 O OG . SER A 0 46 . 5.731 32.575 -26.775 1.00 61.98 46 A 1 ATOM 345 N N . THR A 0 47 . 6.164 30.647 -30.603 1.00 67.03 47 A 1 ATOM 346 C CA . THR A 0 47 . 5.512 29.426 -31.058 1.00 67.03 47 A 1 ATOM 347 C C . THR A 0 47 . 5.402 28.484 -29.860 1.00 67.03 47 A 1 ATOM 348 C CB . THR A 0 47 . 6.337 28.751 -32.163 1.00 67.03 47 A 1 ATOM 349 O O . THR A 0 47 . 6.438 28.165 -29.268 1.00 67.03 47 A 1 ATOM 350 C CG2 . THR A 0 47 . 6.080 29.406 -33.518 1.00 67.03 47 A 1 ATOM 351 O OG1 . THR A 0 47 . 7.718 28.864 -31.891 1.00 67.03 47 A 1 ATOM 352 N N . PRO A 0 48 . 4.196 28.043 -29.463 1.00 67.69 48 A 1 ATOM 353 C CA . PRO A 0 48 . 4.072 27.059 -28.404 1.00 67.69 48 A 1 ATOM 354 C C . PRO A 0 48 . 4.675 25.747 -28.912 1.00 67.69 48 A 1 ATOM 355 C CB . PRO A 0 48 . 2.573 26.978 -28.089 1.00 67.69 48 A 1 ATOM 356 O O . PRO A 0 48 . 4.091 25.064 -29.754 1.00 67.69 48 A 1 ATOM 357 C CG . PRO A 0 48 . 1.902 27.402 -29.396 1.00 67.69 48 A 1 ATOM 358 C CD . PRO A 0 48 . 2.889 28.401 -29.998 1.00 67.69 48 A 1 ATOM 359 N N . CYS A 0 49 . 5.866 25.397 -28.429 1.00 62.29 49 A 1 ATOM 360 C CA . CYS A 0 49 . 6.395 24.056 -28.610 1.00 62.29 49 A 1 ATOM 361 C C . CYS A 0 49 . 5.487 23.104 -27.831 1.00 62.29 49 A 1 ATOM 362 C CB . CYS A 0 49 . 7.855 23.980 -28.142 1.00 62.29 49 A 1 ATOM 363 O O . CYS A 0 49 . 5.365 23.211 -26.610 1.00 62.29 49 A 1 ATOM 364 S SG . CYS A 0 49 . 8.900 24.944 -29.271 1.00 62.29 49 A 1 ATOM 365 N N . ARG A 0 50 . 4.836 22.178 -28.540 1.00 63.93 50 A 1 ATOM 366 C CA . ARG A 0 50 . 4.178 21.027 -27.923 1.00 63.93 50 A 1 ATOM 367 C C . ARG A 0 50 . 5.273 20.145 -27.333 1.00 63.93 50 A 1 ATOM 368 C CB . ARG A 0 50 . 3.332 20.258 -28.953 1.00 63.93 50 A 1 ATOM 369 O O . ARG A 0 50 . 5.803 19.275 -28.016 1.00 63.93 50 A 1 ATOM 370 C CG . ARG A 0 50 . 2.065 21.008 -29.383 1.00 63.93 50 A 1 ATOM 371 C CD . ARG A 0 50 . 1.263 20.129 -30.351 1.00 63.93 50 A 1 ATOM 372 N NE . ARG A 0 50 . -0.008 20.764 -30.750 1.00 63.93 50 A 1 ATOM 373 N NH1 . ARG A 0 50 . -1.025 18.876 -31.582 1.00 63.93 50 A 1 ATOM 374 N NH2 . ARG A 0 50 . -2.126 20.814 -31.592 1.00 63.93 50 A 1 ATOM 375 C CZ . ARG A 0 50 . -1.042 20.151 -31.304 1.00 63.93 50 A 1 ATOM 376 N N . PHE A 0 51 . 5.650 20.404 -26.086 1.00 56.13 51 A 1 ATOM 377 C CA . PHE A 0 51 . 6.377 19.419 -25.302 1.00 56.13 51 A 1 ATOM 378 C C . PHE A 0 51 . 5.450 18.213 -25.180 1.00 56.13 51 A 1 ATOM 379 C CB . PHE A 0 51 . 6.788 20.007 -23.947 1.00 56.13 51 A 1 ATOM 380 O O . PHE A 0 51 . 4.355 18.331 -24.633 1.00 56.13 51 A 1 ATOM 381 C CG . PHE A 0 51 . 7.986 20.931 -24.051 1.00 56.13 51 A 1 ATOM 382 C CD1 . PHE A 0 51 . 9.285 20.396 -23.967 1.00 56.13 51 A 1 ATOM 383 C CD2 . PHE A 0 51 . 7.812 22.313 -24.263 1.00 56.13 51 A 1 ATOM 384 C CE1 . PHE A 0 51 . 10.405 21.236 -24.090 1.00 56.13 51 A 1 ATOM 385 C CE2 . PHE A 0 51 . 8.934 23.154 -24.384 1.00 56.13 51 A 1 ATOM 386 C CZ . PHE A 0 51 . 10.230 22.615 -24.297 1.00 56.13 51 A 1 ATOM 387 N N . PHE A 0 52 . 5.843 17.096 -25.793 1.00 60.34 52 A 1 ATOM 388 C CA . PHE A 0 52 . 5.177 15.813 -25.626 1.00 60.34 52 A 1 ATOM 389 C C . PHE A 0 52 . 5.027 15.560 -24.125 1.00 60.34 52 A 1 ATOM 390 C CB . PHE A 0 52 . 6.007 14.714 -26.306 1.00 60.34 52 A 1 ATOM 391 O O . PHE A 0 52 . 6.011 15.327 -23.428 1.00 60.34 52 A 1 ATOM 392 C CG . PHE A 0 52 . 5.916 14.709 -27.820 1.00 60.34 52 A 1 ATOM 393 C CD1 . PHE A 0 52 . 4.891 13.977 -28.449 1.00 60.34 52 A 1 ATOM 394 C CD2 . PHE A 0 52 . 6.856 15.405 -28.605 1.00 60.34 52 A 1 ATOM 395 C CE1 . PHE A 0 52 . 4.808 13.936 -29.852 1.00 60.34 52 A 1 ATOM 396 C CE2 . PHE A 0 52 . 6.772 15.366 -30.009 1.00 60.34 52 A 1 ATOM 397 C CZ . PHE A 0 52 . 5.749 14.629 -30.632 1.00 60.34 52 A 1 ATOM 398 N N . ALA A 0 53 . 3.800 15.685 -23.628 1.00 68.37 53 A 1 ATOM 399 C CA . ALA A 0 53 . 3.469 15.485 -22.230 1.00 68.37 53 A 1 ATOM 400 C C . ALA A 0 53 . 3.352 13.979 -21.966 1.00 68.37 53 A 1 ATOM 401 C CB . ALA A 0 53 . 2.202 16.287 -21.901 1.00 68.37 53 A 1 ATOM 402 O O . ALA A 0 53 . 2.258 13.448 -21.801 1.00 68.37 53 A 1 ATOM 403 N N . HIS A 0 54 . 4.482 13.274 -21.977 1.00 72.91 54 A 1 ATOM 404 C CA . HIS A 0 54 . 4.580 12.061 -21.176 1.00 72.91 54 A 1 ATOM 405 C C . HIS A 0 54 . 4.502 12.517 -19.712 1.00 72.91 54 A 1 ATOM 406 C CB . HIS A 0 54 . 5.872 11.313 -21.529 1.00 72.91 54 A 1 ATOM 407 O O . HIS A 0 54 . 5.198 13.460 -19.329 1.00 72.91 54 A 1 ATOM 408 C CG . HIS A 0 54 . 6.301 10.290 -20.508 1.00 72.91 54 A 1 ATOM 409 C CD2 . HIS A 0 54 . 7.450 10.345 -19.766 1.00 72.91 54 A 1 ATOM 410 N ND1 . HIS A 0 54 . 5.632 9.145 -20.130 1.00 72.91 54 A 1 ATOM 411 C CE1 . HIS A 0 54 . 6.365 8.534 -19.181 1.00 72.91 54 A 1 ATOM 412 N NE2 . HIS A 0 54 . 7.494 9.217 -18.947 1.00 72.91 54 A 1 ATOM 413 N N . GLY A 0 55 . 3.578 11.937 -18.940 1.00 73.30 55 A 1 ATOM 414 C CA . GLY A 0 55 . 3.416 12.256 -17.521 1.00 73.30 55 A 1 ATOM 415 C C . GLY A 0 55 . 4.729 12.097 -16.751 1.00 73.30 55 A 1 ATOM 416 O O . GLY A 0 55 . 5.664 11.456 -17.222 1.00 73.30 55 A 1 ATOM 417 N N . ILE A 0 56 . 4.809 12.704 -15.568 1.00 81.21 56 A 1 ATOM 418 C CA . ILE A 0 56 . 5.974 12.557 -14.686 1.00 81.21 56 A 1 ATOM 419 C C . ILE A 0 56 . 6.182 11.051 -14.430 1.00 81.21 56 A 1 ATOM 420 C CB . ILE A 0 56 . 5.749 13.336 -13.369 1.00 81.21 56 A 1 ATOM 421 O O . ILE A 0 56 . 5.210 10.392 -14.049 1.00 81.21 56 A 1 ATOM 422 C CG1 . ILE A 0 56 . 5.501 14.841 -13.645 1.00 81.21 56 A 1 ATOM 423 C CG2 . ILE A 0 56 . 6.947 13.168 -12.416 1.00 81.21 56 A 1 ATOM 424 C CD1 . ILE A 0 56 . 4.869 15.581 -12.461 1.00 81.21 56 A 1 ATOM 425 N N . PRO A 0 57 . 7.390 10.493 -14.648 1.00 81.98 57 A 1 ATOM 426 C CA . PRO A 0 57 . 7.634 9.082 -14.384 1.00 81.98 57 A 1 ATOM 427 C C . PRO A 0 57 . 7.404 8.802 -12.898 1.00 81.98 57 A 1 ATOM 428 C CB . PRO A 0 57 . 9.077 8.811 -14.822 1.00 81.98 57 A 1 ATOM 429 O O . PRO A 0 57 . 7.889 9.535 -12.033 1.00 81.98 57 A 1 ATOM 430 C CG . PRO A 0 57 . 9.747 10.178 -14.691 1.00 81.98 57 A 1 ATOM 431 C CD . PRO A 0 57 . 8.624 11.148 -15.061 1.00 81.98 57 A 1 ATOM 432 N N . LEU A 0 58 . 6.639 7.753 -12.605 1.00 86.15 58 A 1 ATOM 433 C CA . LEU A 0 58 . 6.377 7.332 -11.235 1.00 86.15 58 A 1 ATOM 434 C C . LEU A 0 58 . 7.627 6.636 -10.690 1.00 86.15 58 A 1 ATOM 435 C CB . LEU A 0 58 . 5.132 6.424 -11.199 1.00 86.15 58 A 1 ATOM 436 O O . LEU A 0 58 . 8.102 5.665 -11.269 1.00 86.15 58 A 1 ATOM 437 C CG . LEU A 0 58 . 3.816 7.125 -11.591 1.00 86.15 58 A 1 ATOM 438 C CD1 . LEU A 0 58 . 2.689 6.098 -11.697 1.00 86.15 58 A 1 ATOM 439 C CD2 . LEU A 0 58 . 3.396 8.185 -10.566 1.00 86.15 58 A 1 ATOM 440 N N . THR A 0 59 . 8.169 7.133 -9.580 1.00 92.30 59 A 1 ATOM 441 C CA . THR A 0 59 . 9.166 6.406 -8.783 1.00 92.30 59 A 1 ATOM 442 C C . THR A 0 59 . 8.450 5.604 -7.701 1.00 92.30 59 A 1 ATOM 443 C CB . THR A 0 59 . 10.211 7.345 -8.159 1.00 92.30 59 A 1 ATOM 444 O O . THR A 0 59 . 7.361 5.989 -7.269 1.00 92.30 59 A 1 ATOM 445 C CG2 . THR A 0 59 . 10.975 8.145 -9.214 1.00 92.30 59 A 1 ATOM 446 O OG1 . THR A 0 59 . 9.613 8.277 -7.291 1.00 92.30 59 A 1 ATOM 447 N N . LYS A 0 60 . 9.063 4.525 -7.204 1.00 93.12 60 A 1 ATOM 448 C CA . LYS A 0 60 . 8.478 3.708 -6.129 1.00 93.12 60 A 1 ATOM 449 C C . LYS A 0 60 . 8.087 4.541 -4.907 1.00 93.12 60 A 1 ATOM 450 C CB . LYS A 0 60 . 9.475 2.615 -5.750 1.00 93.12 60 A 1 ATOM 451 O O . LYS A 0 60 . 6.979 4.409 -4.402 1.00 93.12 60 A 1 ATOM 452 C CG . LYS A 0 60 . 8.915 1.718 -4.638 1.00 93.12 60 A 1 ATOM 453 C CD . LYS A 0 60 . 9.966 0.670 -4.338 1.00 93.12 60 A 1 ATOM 454 C CE . LYS A 0 60 . 9.584 -0.261 -3.200 1.00 93.12 60 A 1 ATOM 455 N NZ . LYS A 0 60 . 10.614 -1.315 -3.120 1.00 93.12 60 A 1 ATOM 456 N N . THR A 0 61 . 8.944 5.480 -4.511 1.00 94.01 61 A 1 ATOM 457 C CA . THR A 0 61 . 8.673 6.422 -3.412 1.00 94.01 61 A 1 ATOM 458 C C . THR A 0 61 . 7.391 7.231 -3.622 1.00 94.01 61 A 1 ATOM 459 C CB . THR A 0 61 . 9.844 7.398 -3.239 1.00 94.01 61 A 1 ATOM 460 O O . THR A 0 61 . 6.618 7.410 -2.688 1.00 94.01 61 A 1 ATOM 461 C CG2 . THR A 0 61 . 11.117 6.688 -2.776 1.00 94.01 61 A 1 ATOM 462 O OG1 . THR A 0 61 . 10.166 8.046 -4.460 1.00 94.01 61 A 1 ATOM 463 N N . MET A 0 62 . 7.114 7.674 -4.854 1.00 93.51 62 A 1 ATOM 464 C CA . MET A 0 62 . 5.884 8.406 -5.170 1.00 93.51 62 A 1 ATOM 465 C C . MET A 0 62 . 4.651 7.502 -5.079 1.00 93.51 62 A 1 ATOM 466 C CB . MET A 0 62 . 5.963 9.023 -6.576 1.00 93.51 62 A 1 ATOM 467 O O . MET A 0 62 . 3.591 7.967 -4.672 1.00 93.51 62 A 1 ATOM 468 C CG . MET A 0 62 . 7.041 10.101 -6.730 1.00 93.51 62 A 1 ATOM 469 S SD . MET A 0 62 . 6.722 11.680 -5.900 1.00 93.51 62 A 1 ATOM 470 C CE . MET A 0 62 . 7.886 11.528 -4.517 1.00 93.51 62 A 1 ATOM 471 N N . ILE A 0 63 . 4.767 6.224 -5.450 1.00 94.89 63 A 1 ATOM 472 C CA . ILE A 0 63 . 3.668 5.254 -5.329 1.00 94.89 63 A 1 ATOM 473 C C . ILE A 0 63 . 3.350 5.021 -3.849 1.00 94.89 63 A 1 ATOM 474 C CB . ILE A 0 63 . 4.001 3.937 -6.071 1.00 94.89 63 A 1 ATOM 475 O O . ILE A 0 63 . 2.194 5.146 -3.450 1.00 94.89 63 A 1 ATOM 476 C CG1 . ILE A 0 63 . 4.184 4.209 -7.584 1.00 94.89 63 A 1 ATOM 477 C CG2 . ILE A 0 63 . 2.903 2.881 -5.841 1.00 94.89 63 A 1 ATOM 478 C CD1 . ILE A 0 63 . 4.682 3.001 -8.388 1.00 94.89 63 A 1 ATOM 479 N N . GLU A 0 64 . 4.373 4.760 -3.034 1.00 94.69 64 A 1 ATOM 480 C CA . GLU A 0 64 . 4.239 4.555 -1.587 1.00 94.69 64 A 1 ATOM 481 C C . GLU A 0 64 . 3.567 5.749 -0.899 1.00 94.69 64 A 1 ATOM 482 C CB . GLU A 0 64 . 5.626 4.317 -0.966 1.00 94.69 64 A 1 ATOM 483 O O . GLU A 0 64 . 2.594 5.574 -0.161 1.00 94.69 64 A 1 ATOM 484 C CG . GLU A 0 64 . 6.236 2.971 -1.381 1.00 94.69 64 A 1 ATOM 485 C CD . GLU A 0 64 . 7.631 2.703 -0.790 1.00 94.69 64 A 1 ATOM 486 O OE1 . GLU A 0 64 . 8.178 1.612 -1.079 1.00 94.69 64 A 1 ATOM 487 O OE2 . GLU A 0 64 . 8.157 3.568 -0.052 1.00 94.69 64 A 1 ATOM 488 N N . ASP A 0 65 . 4.032 6.968 -1.189 1.00 94.75 65 A 1 ATOM 489 C CA . ASP A 0 65 . 3.481 8.199 -0.618 1.00 94.75 65 A 1 ATOM 490 C C . ASP A 0 65 . 2.001 8.390 -0.981 1.00 94.75 65 A 1 ATOM 491 C CB . ASP A 0 65 . 4.293 9.410 -1.114 1.00 94.75 65 A 1 ATOM 492 O O . ASP A 0 65 . 1.193 8.785 -0.135 1.00 94.75 65 A 1 ATOM 493 C CG . ASP A 0 65 . 5.654 9.593 -0.428 1.00 94.75 65 A 1 ATOM 494 O OD1 . ASP A 0 65 . 5.799 9.145 0.734 1.00 94.75 65 A 1 ATOM 495 O OD2 . ASP A 0 65 . 6.498 10.312 -1.015 1.00 94.75 65 A 1 ATOM 496 N N . ARG A 0 66 . 1.630 8.087 -2.232 1.00 94.53 66 A 1 ATOM 497 C CA . ARG A 0 66 . 0.250 8.210 -2.717 1.00 94.53 66 A 1 ATOM 498 C C . ARG A 0 66 . -0.669 7.164 -2.103 1.00 94.53 66 A 1 ATOM 499 C CB . ARG A 0 66 . 0.218 8.129 -4.244 1.00 94.53 66 A 1 ATOM 500 O O . ARG A 0 66 . -1.726 7.530 -1.600 1.00 94.53 66 A 1 ATOM 501 C CG . ARG A 0 66 . 0.773 9.409 -4.884 1.00 94.53 66 A 1 ATOM 502 C CD . ARG A 0 66 . 0.661 9.322 -6.407 1.00 94.53 66 A 1 ATOM 503 N NE . ARG A 0 66 . -0.739 9.550 -6.801 1.00 94.53 66 A 1 ATOM 504 N NH1 . ARG A 0 66 . -0.644 8.970 -9.020 1.00 94.53 66 A 1 ATOM 505 N NH2 . ARG A 0 66 . -2.559 9.694 -8.094 1.00 94.53 66 A 1 ATOM 506 C CZ . ARG A 0 66 . -1.300 9.402 -7.977 1.00 94.53 66 A 1 ATOM 507 N N . VAL A 0 67 . -0.257 5.896 -2.070 1.00 95.16 67 A 1 ATOM 508 C CA . VAL A 0 67 . -1.033 4.830 -1.414 1.00 95.16 67 A 1 ATOM 509 C C . VAL A 0 67 . -1.234 5.170 0.062 1.00 95.16 67 A 1 ATOM 510 C CB . VAL A 0 67 . -0.351 3.458 -1.584 1.00 95.16 67 A 1 ATOM 511 O O . VAL A 0 67 . -2.355 5.135 0.562 1.00 95.16 67 A 1 ATOM 512 C CG1 . VAL A 0 67 . -1.059 2.355 -0.784 1.00 95.16 67 A 1 ATOM 513 C CG2 . VAL A 0 67 . -0.359 3.018 -3.053 1.00 95.16 67 A 1 ATOM 514 N N . MET A 0 68 . -0.177 5.597 0.756 1.00 94.29 68 A 1 ATOM 515 C CA . MET A 0 68 . -0.262 5.975 2.166 1.00 94.29 68 A 1 ATOM 516 C C . MET A 0 68 . -1.194 7.169 2.404 1.00 94.29 68 A 1 ATOM 517 C CB . MET A 0 68 . 1.153 6.280 2.672 1.00 94.29 68 A 1 ATOM 518 O O . MET A 0 68 . -1.858 7.240 3.439 1.00 94.29 68 A 1 ATOM 519 C CG . MET A 0 68 . 1.212 6.421 4.193 1.00 94.29 68 A 1 ATOM 520 S SD . MET A 0 68 . 0.803 4.893 5.073 1.00 94.29 68 A 1 ATOM 521 C CE . MET A 0 68 . 1.338 5.311 6.745 1.00 94.29 68 A 1 ATOM 522 N N . LEU A 0 69 . -1.257 8.115 1.465 1.00 93.99 69 A 1 ATOM 523 C CA . LEU A 0 69 . -2.189 9.237 1.527 1.00 93.99 69 A 1 ATOM 524 C C . LEU A 0 69 . -3.638 8.744 1.470 1.00 93.99 69 A 1 ATOM 525 C CB . LEU A 0 69 . -1.822 10.244 0.423 1.00 93.99 69 A 1 ATOM 526 O O . LEU A 0 69 . -4.420 9.131 2.336 1.00 93.99 69 A 1 ATOM 527 C CG . LEU A 0 69 . -2.595 11.574 0.470 1.00 93.99 69 A 1 ATOM 528 C CD1 . LEU A 0 69 . -1.811 12.642 -0.297 1.00 93.99 69 A 1 ATOM 529 C CD2 . LEU A 0 69 . -3.978 11.496 -0.177 1.00 93.99 69 A 1 ATOM 530 N N . VAL A 0 70 . -3.975 7.861 0.526 1.00 94.76 70 A 1 ATOM 531 C CA . VAL A 0 70 . -5.326 7.279 0.406 1.00 94.76 70 A 1 ATOM 532 C C . VAL A 0 70 . -5.723 6.552 1.686 1.00 94.76 70 A 1 ATOM 533 C CB . VAL A 0 70 . -5.419 6.308 -0.784 1.00 94.76 70 A 1 ATOM 534 O O . VAL A 0 70 . -6.793 6.810 2.232 1.00 94.76 70 A 1 ATOM 535 C CG1 . VAL A 0 70 . -6.816 5.690 -0.923 1.00 94.76 70 A 1 ATOM 536 C CG2 . VAL A 0 70 . -5.129 7.037 -2.086 1.00 94.76 70 A 1 ATOM 537 N N . LEU A 0 71 . -4.828 5.717 2.225 1.00 94.04 71 A 1 ATOM 538 C CA . LEU A 0 71 . -5.093 4.966 3.455 1.00 94.04 71 A 1 ATOM 539 C C . LEU A 0 71 . -5.353 5.881 4.660 1.00 94.04 71 A 1 ATOM 540 C CB . LEU A 0 71 . -3.911 4.031 3.764 1.00 94.04 71 A 1 ATOM 541 O O . LEU A 0 71 . -6.189 5.566 5.499 1.00 94.04 71 A 1 ATOM 542 C CG . LEU A 0 71 . -3.647 2.914 2.742 1.00 94.04 71 A 1 ATOM 543 C CD1 . LEU A 0 71 . -2.468 2.072 3.215 1.00 94.04 71 A 1 ATOM 544 C CD2 . LEU A 0 71 . -4.848 2.006 2.540 1.00 94.04 71 A 1 ATOM 545 N N . ARG A 0 72 . -4.665 7.027 4.753 1.00 93.24 72 A 1 ATOM 546 C CA . ARG A 0 72 . -4.873 8.014 5.830 1.00 93.24 72 A 1 ATOM 547 C C . ARG A 0 72 . -6.172 8.805 5.693 1.00 93.24 72 A 1 ATOM 548 C CB . ARG A 0 72 . -3.708 9.005 5.858 1.00 93.24 72 A 1 ATOM 549 O O . ARG A 0 72 . -6.617 9.378 6.683 1.00 93.24 72 A 1 ATOM 550 C CG . ARG A 0 72 . -2.418 8.398 6.409 1.00 93.24 72 A 1 ATOM 551 C CD . ARG A 0 72 . -1.300 9.421 6.214 1.00 93.24 72 A 1 ATOM 552 N NE . ARG A 0 72 . -0.003 8.901 6.668 1.00 93.24 72 A 1 ATOM 553 N NH1 . ARG A 0 72 . 1.279 10.589 5.796 1.00 93.24 72 A 1 ATOM 554 N NH2 . ARG A 0 72 . 2.271 8.813 6.716 1.00 93.24 72 A 1 ATOM 555 C CZ . ARG A 0 72 . 1.172 9.437 6.399 1.00 93.24 72 A 1 ATOM 556 N N . LEU A 0 73 . -6.719 8.913 4.483 1.00 93.11 73 A 1 ATOM 557 C CA . LEU A 0 73 . -7.985 9.603 4.232 1.00 93.11 73 A 1 ATOM 558 C C . LEU A 0 73 . -9.203 8.719 4.512 1.00 93.11 73 A 1 ATOM 559 C CB . LEU A 0 73 . -8.024 10.116 2.782 1.00 93.11 73 A 1 ATOM 560 O O . LEU A 0 73 . -10.310 9.245 4.603 1.00 93.11 73 A 1 ATOM 561 C CG . LEU A 0 73 . -7.077 11.283 2.461 1.00 93.11 73 A 1 ATOM 562 C CD1 . LEU A 0 73 . -7.266 11.682 0.998 1.00 93.11 73 A 1 ATOM 563 C CD2 . LEU A 0 73 . -7.347 12.521 3.319 1.00 93.11 73 A 1 ATOM 564 N N . TYR A 0 74 . -9.017 7.406 4.636 1.00 92.87 74 A 1 ATOM 565 C CA . TYR A 0 74 . -10.112 6.477 4.870 1.00 92.87 74 A 1 ATOM 566 C C . TYR A 0 74 . -10.573 6.521 6.336 1.00 92.87 74 A 1 ATOM 567 C CB . TYR A 0 74 . -9.685 5.078 4.414 1.00 92.87 74 A 1 ATOM 568 O O . TYR A 0 74 . -9.789 6.272 7.250 1.00 92.87 74 A 1 ATOM 569 C CG . TYR A 0 74 . -10.866 4.159 4.193 1.00 92.87 74 A 1 ATOM 570 C CD1 . TYR A 0 74 . -11.191 3.176 5.144 1.00 92.87 74 A 1 ATOM 571 C CD2 . TYR A 0 74 . -11.665 4.314 3.042 1.00 92.87 74 A 1 ATOM 572 C CE1 . TYR A 0 74 . -12.318 2.353 4.947 1.00 92.87 74 A 1 ATOM 573 C CE2 . TYR A 0 74 . -12.809 3.512 2.859 1.00 92.87 74 A 1 ATOM 574 O OH . TYR A 0 74 . -14.280 1.800 3.707 1.00 92.87 74 A 1 ATOM 575 C CZ . TYR A 0 74 . -13.145 2.535 3.817 1.00 92.87 74 A 1 ATOM 576 N N . ASP A 0 75 . -11.861 6.803 6.568 1.00 91.14 75 A 1 ATOM 577 C CA . ASP A 0 75 . -12.422 7.111 7.898 1.00 91.14 75 A 1 ATOM 578 C C . ASP A 0 75 . -12.250 5.982 8.940 1.00 91.14 75 A 1 ATOM 579 C CB . ASP A 0 75 . -13.927 7.442 7.754 1.00 91.14 75 A 1 ATOM 580 O O . ASP A 0 75 . -12.296 6.238 10.144 1.00 91.14 75 A 1 ATOM 581 C CG . ASP A 0 75 . -14.267 8.811 7.132 1.00 91.14 75 A 1 ATOM 582 O OD1 . ASP A 0 75 . -13.437 9.741 7.209 1.00 91.14 75 A 1 ATOM 583 O OD2 . ASP A 0 75 . -15.417 8.968 6.652 1.00 91.14 75 A 1 ATOM 584 N N . LYS A 0 76 . -12.079 4.725 8.501 1.00 88.96 76 A 1 ATOM 585 C CA . LYS A 0 76 . -11.927 3.548 9.381 1.00 88.96 76 A 1 ATOM 586 C C . LYS A 0 76 . -10.489 3.276 9.819 1.00 88.96 76 A 1 ATOM 587 C CB . LYS A 0 76 . -12.484 2.292 8.691 1.00 88.96 76 A 1 ATOM 588 O O . LYS A 0 76 . -10.274 2.447 10.700 1.00 88.96 76 A 1 ATOM 589 C CG . LYS A 0 76 . -13.945 2.399 8.245 1.00 88.96 76 A 1 ATOM 590 C CD . LYS A 0 76 . -14.893 2.613 9.425 1.00 88.96 76 A 1 ATOM 591 C CE . LYS A 0 76 . -16.309 2.504 8.872 1.00 88.96 76 A 1 ATOM 592 N NZ . LYS A 0 76 . -17.308 2.566 9.955 1.00 88.96 76 A 1 ATOM 593 N N . ILE A 0 77 . -9.509 3.929 9.197 1.00 90.52 77 A 1 ATOM 594 C CA . ILE A 0 77 . -8.091 3.648 9.413 1.00 90.52 77 A 1 ATOM 595 C C . ILE A 0 77 . -7.468 4.782 10.228 1.00 90.52 77 A 1 ATOM 596 C CB . ILE A 0 77 . -7.382 3.411 8.063 1.00 90.52 77 A 1 ATOM 597 O O . ILE A 0 77 . -7.426 5.935 9.804 1.00 90.52 77 A 1 ATOM 598 C CG1 . ILE A 0 77 . -7.962 2.181 7.332 1.00 90.52 77 A 1 ATOM 599 C CG2 . ILE A 0 77 . -5.889 3.154 8.287 1.00 90.52 77 A 1 ATOM 600 C CD1 . ILE A 0 77 . -7.418 1.971 5.910 1.00 90.52 77 A 1 ATOM 601 N N . ASP A 0 78 . -6.908 4.445 11.391 1.00 90.91 78 A 1 ATOM 602 C CA . ASP A 0 78 . -6.195 5.416 12.220 1.00 90.91 78 A 1 ATOM 603 C C . ASP A 0 78 . -4.851 5.807 11.577 1.00 90.91 78 A 1 ATOM 604 C CB . ASP A 0 78 . -5.927 4.853 13.620 1.00 90.91 78 A 1 ATOM 605 O O . ASP A 0 78 . -3.951 4.963 11.493 1.00 90.91 78 A 1 ATOM 606 C CG . ASP A 0 78 . -7.167 4.776 14.507 1.00 90.91 78 A 1 ATOM 607 O OD1 . ASP A 0 78 . -7.977 5.726 14.458 1.00 90.91 78 A 1 ATOM 608 O OD2 . ASP A 0 78 . -7.214 3.816 15.307 1.00 90.91 78 A 1 ATOM 609 N N . PRO A 0 79 . -4.615 7.088 11.229 1.00 89.96 79 A 1 ATOM 610 C CA . PRO A 0 79 . -3.427 7.514 10.479 1.00 89.96 79 A 1 ATOM 611 C C . PRO A 0 79 . -2.103 7.293 11.226 1.00 89.96 79 A 1 ATOM 612 C CB . PRO A 0 79 . -3.663 8.999 10.176 1.00 89.96 79 A 1 ATOM 613 O O . PRO A 0 79 . -1.037 7.293 10.610 1.00 89.96 79 A 1 ATOM 614 C CG . PRO A 0 79 . -4.611 9.455 11.284 1.00 89.96 79 A 1 ATOM 615 C CD . PRO A 0 79 . -5.486 8.224 11.491 1.00 89.96 79 A 1 ATOM 616 N N . TYR A 0 80 . -2.157 7.106 12.547 1.00 89.90 80 A 1 ATOM 617 C CA . TYR A 0 80 . -0.993 6.868 13.401 1.00 89.90 80 A 1 ATOM 618 C C . TYR A 0 80 . -0.607 5.388 13.523 1.00 89.90 80 A 1 ATOM 619 C CB . TYR A 0 80 . -1.263 7.464 14.788 1.00 89.90 80 A 1 ATOM 620 O O . TYR A 0 80 . 0.508 5.096 13.948 1.00 89.90 80 A 1 ATOM 621 C CG . TYR A 0 80 . -1.522 8.957 14.770 1.00 89.90 80 A 1 ATOM 622 C CD1 . TYR A 0 80 . -0.450 9.845 14.556 1.00 89.90 80 A 1 ATOM 623 C CD2 . TYR A 0 80 . -2.828 9.455 14.942 1.00 89.90 80 A 1 ATOM 624 C CE1 . TYR A 0 80 . -0.679 11.233 14.518 1.00 89.90 80 A 1 ATOM 625 C CE2 . TYR A 0 80 . -3.061 10.843 14.906 1.00 89.90 80 A 1 ATOM 626 O OH . TYR A 0 80 . -2.212 13.072 14.660 1.00 89.90 80 A 1 ATOM 627 C CZ . TYR A 0 80 . -1.988 11.733 14.694 1.00 89.90 80 A 1 ATOM 628 N N . LYS A 0 81 . -1.509 4.460 13.174 1.00 89.47 81 A 1 ATOM 629 C CA . LYS A 0 81 . -1.299 3.010 13.323 1.00 89.47 81 A 1 ATOM 630 C C . LYS A 0 81 . -0.868 2.333 12.014 1.00 89.47 81 A 1 ATOM 631 C CB . LYS A 0 81 . -2.574 2.401 13.934 1.00 89.47 81 A 1 ATOM 632 O O . LYS A 0 81 . -0.410 1.195 12.038 1.00 89.47 81 A 1 ATOM 633 C CG . LYS A 0 81 . -2.376 0.968 14.455 1.00 89.47 81 A 1 ATOM 634 C CD . LYS A 0 81 . -3.672 0.402 15.045 1.00 89.47 81 A 1 ATOM 635 C CE . LYS A 0 81 . -3.440 -1.046 15.496 1.00 89.47 81 A 1 ATOM 636 N NZ . LYS A 0 81 . -4.715 -1.733 15.812 1.00 89.47 81 A 1 ATOM 637 N N . ILE A 0 82 . -0.979 3.026 10.880 1.00 90.53 82 A 1 ATOM 638 C CA . ILE A 0 82 . -0.667 2.472 9.558 1.00 90.53 82 A 1 ATOM 639 C C . ILE A 0 82 . 0.830 2.185 9.432 1.00 90.53 82 A 1 ATOM 640 C CB . ILE A 0 82 . -1.163 3.377 8.411 1.00 90.53 82 A 1 ATOM 641 O O . ILE A 0 82 . 1.665 3.090 9.477 1.00 90.53 82 A 1 ATOM 642 C CG1 . ILE A 0 82 . -2.630 3.800 8.588 1.00 90.53 82 A 1 ATOM 643 C CG2 . ILE A 0 82 . -0.999 2.639 7.068 1.00 90.53 82 A 1 ATOM 644 C CD1 . ILE A 0 82 . -3.081 4.870 7.585 1.00 90.53 82 A 1 ATOM 645 N N . ALA A 0 83 . 1.148 0.912 9.215 1.00 93.20 83 A 1 ATOM 646 C CA . ALA A 0 83 . 2.466 0.434 8.823 1.00 93.20 83 A 1 ATOM 647 C C . ALA A 0 83 . 2.359 -0.319 7.492 1.00 93.20 83 A 1 ATOM 648 C CB . ALA A 0 83 . 3.030 -0.449 9.944 1.00 93.20 83 A 1 ATOM 649 O O . ALA A 0 83 . 1.321 -0.909 7.198 1.00 93.20 83 A 1 ATOM 650 N N . LEU A 0 84 . 3.442 -0.368 6.712 1.00 92.34 84 A 1 ATOM 651 C CA . LEU A 0 84 . 3.454 -1.086 5.426 1.00 92.34 84 A 1 ATOM 652 C C . LEU A 0 84 . 3.107 -2.577 5.575 1.00 92.34 84 A 1 ATOM 653 C CB . LEU A 0 84 . 4.832 -0.919 4.761 1.00 92.34 84 A 1 ATOM 654 O O . LEU A 0 84 . 2.473 -3.152 4.698 1.00 92.34 84 A 1 ATOM 655 C CG . LEU A 0 84 . 5.204 0.532 4.402 1.00 92.34 84 A 1 ATOM 656 C CD1 . LEU A 0 84 . 6.609 0.564 3.806 1.00 92.34 84 A 1 ATOM 657 C CD2 . LEU A 0 84 . 4.227 1.148 3.401 1.00 92.34 84 A 1 ATOM 658 N N . ASN A 0 85 . 3.457 -3.160 6.725 1.00 92.97 85 A 1 ATOM 659 C CA . ASN A 0 85 . 3.245 -4.573 7.046 1.00 92.97 85 A 1 ATOM 660 C C . ASN A 0 85 . 1.944 -4.834 7.829 1.00 92.97 85 A 1 ATOM 661 C CB . ASN A 0 85 . 4.463 -5.083 7.838 1.00 92.97 85 A 1 ATOM 662 O O . ASN A 0 85 . 1.736 -5.956 8.288 1.00 92.97 85 A 1 ATOM 663 C CG . ASN A 0 85 . 5.796 -4.871 7.145 1.00 92.97 85 A 1 ATOM 664 N ND2 . ASN A 0 85 . 6.875 -4.822 7.888 1.00 92.97 85 A 1 ATOM 665 O OD1 . ASN A 0 85 . 5.915 -4.707 5.951 1.00 92.97 85 A 1 ATOM 666 N N . SER A 0 86 . 1.119 -3.807 8.066 1.00 92.58 86 A 1 ATOM 667 C CA . SER A 0 86 . -0.145 -3.970 8.796 1.00 92.58 86 A 1 ATOM 668 C C . SER A 0 86 . -1.180 -4.700 7.943 1.00 92.58 86 A 1 ATOM 669 C CB . SER A 0 86 . -0.686 -2.641 9.336 1.00 92.58 86 A 1 ATOM 670 O O . SER A 0 86 . -1.216 -4.528 6.724 1.00 92.58 86 A 1 ATOM 671 O OG . SER A 0 86 . -0.959 -1.684 8.326 1.00 92.58 86 A 1 ATOM 672 N N . ARG A 0 87 . -2.009 -5.531 8.579 1.00 92.63 87 A 1 ATOM 673 C CA . ARG A 0 87 . -3.069 -6.291 7.908 1.00 92.63 87 A 1 ATOM 674 C C . ARG A 0 87 . -4.412 -5.597 8.081 1.00 92.63 87 A 1 ATOM 675 C CB . ARG A 0 87 . -3.118 -7.728 8.439 1.00 92.63 87 A 1 ATOM 676 O O . ARG A 0 87 . -4.835 -5.363 9.210 1.00 92.63 87 A 1 ATOM 677 C CG . ARG A 0 87 . -1.949 -8.576 7.928 1.00 92.63 87 A 1 ATOM 678 C CD . ARG A 0 87 . -2.105 -10.008 8.445 1.00 92.63 87 A 1 ATOM 679 N NE . ARG A 0 87 . -1.092 -10.896 7.859 1.00 92.63 87 A 1 ATOM 680 N NH1 . ARG A 0 87 . -2.029 -12.879 8.563 1.00 92.63 87 A 1 ATOM 681 N NH2 . ARG A 0 87 . -0.155 -12.896 7.350 1.00 92.63 87 A 1 ATOM 682 C CZ . ARG A 0 87 . -1.102 -12.213 7.934 1.00 92.63 87 A 1 ATOM 683 N N . PHE A 0 88 . -5.125 -5.344 6.984 1.00 92.31 88 A 1 ATOM 684 C CA . PHE A 0 88 . -6.410 -4.626 7.008 1.00 92.31 88 A 1 ATOM 685 C C . PHE A 0 88 . -7.458 -5.295 7.915 1.00 92.31 88 A 1 ATOM 686 C CB . PHE A 0 88 . -6.913 -4.459 5.567 1.00 92.31 88 A 1 ATOM 687 O O . PHE A 0 88 . -8.088 -4.634 8.743 1.00 92.31 88 A 1 ATOM 688 C CG . PHE A 0 88 . -6.016 -3.578 4.711 1.00 92.31 88 A 1 ATOM 689 C CD1 . PHE A 0 88 . -5.738 -2.252 5.100 1.00 92.31 88 A 1 ATOM 690 C CD2 . PHE A 0 88 . -5.452 -4.085 3.525 1.00 92.31 88 A 1 ATOM 691 C CE1 . PHE A 0 88 . -4.894 -1.445 4.316 1.00 92.31 88 A 1 ATOM 692 C CE2 . PHE A 0 88 . -4.606 -3.280 2.743 1.00 92.31 88 A 1 ATOM 693 C CZ . PHE A 0 88 . -4.330 -1.959 3.136 1.00 92.31 88 A 1 ATOM 694 N N . ASN A 0 89 . -7.563 -6.623 7.839 1.00 91.46 89 A 1 ATOM 695 C CA . ASN A 0 89 . -8.553 -7.386 8.602 1.00 91.46 89 A 1 ATOM 696 C C . ASN A 0 89 . -8.184 -7.521 10.090 1.00 91.46 89 A 1 ATOM 697 C CB . ASN A 0 89 . -8.717 -8.775 7.954 1.00 91.46 89 A 1 ATOM 698 O O . ASN A 0 89 . -9.051 -7.420 10.950 1.00 91.46 89 A 1 ATOM 699 C CG . ASN A 0 89 . -9.205 -8.726 6.515 1.00 91.46 89 A 1 ATOM 700 N ND2 . ASN A 0 89 . -9.150 -9.826 5.805 1.00 91.46 89 A 1 ATOM 701 O OD1 . ASN A 0 89 . -9.601 -7.710 5.987 1.00 91.46 89 A 1 ATOM 702 N N . GLU A 0 90 . -6.907 -7.770 10.404 1.00 92.12 90 A 1 ATOM 703 C CA . GLU A 0 90 . -6.459 -8.081 11.774 1.00 92.12 90 A 1 ATOM 704 C C . GLU A 0 90 . -6.186 -6.817 12.606 1.00 92.12 90 A 1 ATOM 705 C CB . GLU A 0 90 . -5.209 -8.985 11.743 1.00 92.12 90 A 1 ATOM 706 O O . GLU A 0 90 . -6.550 -6.768 13.780 1.00 92.12 90 A 1 ATOM 707 C CG . GLU A 0 90 . -5.465 -10.389 11.161 1.00 92.12 90 A 1 ATOM 708 C CD . GLU A 0 90 . -4.180 -11.219 10.964 1.00 92.12 90 A 1 ATOM 709 O OE1 . GLU A 0 90 . -4.181 -12.128 10.098 1.00 92.12 90 A 1 ATOM 710 O OE2 . GLU A 0 90 . -3.148 -10.942 11.609 1.00 92.12 90 A 1 ATOM 711 N N . ASP A 0 91 . -5.575 -5.783 12.013 1.00 92.41 91 A 1 ATOM 712 C CA . ASP A 0 91 . -5.148 -4.587 12.750 1.00 92.41 91 A 1 ATOM 713 C C . ASP A 0 91 . -6.227 -3.504 12.826 1.00 92.41 91 A 1 ATOM 714 C CB . ASP A 0 91 . -3.877 -3.992 12.125 1.00 92.41 91 A 1 ATOM 715 O O . ASP A 0 91 . -6.299 -2.785 13.832 1.00 92.41 91 A 1 ATOM 716 C CG . ASP A 0 91 . -2.641 -4.863 12.337 1.00 92.41 91 A 1 ATOM 717 O OD1 . ASP A 0 91 . -2.433 -5.275 13.500 1.00 92.41 91 A 1 ATOM 718 O OD2 . ASP A 0 91 . -1.863 -5.019 11.366 1.00 92.41 91 A 1 ATOM 719 N N . PHE A 0 92 . -7.037 -3.368 11.774 1.00 91.07 92 A 1 ATOM 720 C CA . PHE A 0 92 . -8.056 -2.320 11.649 1.00 91.07 92 A 1 ATOM 721 C C . PHE A 0 92 . -9.486 -2.862 11.720 1.00 91.07 92 A 1 ATOM 722 C CB . PHE A 0 92 . -7.813 -1.529 10.358 1.00 91.07 92 A 1 ATOM 723 O O . PHE A 0 92 . -10.404 -2.093 11.988 1.00 91.07 92 A 1 ATOM 724 C CG . PHE A 0 92 . -6.447 -0.889 10.283 1.00 91.07 92 A 1 ATOM 725 C CD1 . PHE A 0 92 . -6.178 0.290 11.000 1.00 91.07 92 A 1 ATOM 726 C CD2 . PHE A 0 92 . -5.434 -1.491 9.518 1.00 91.07 92 A 1 ATOM 727 C CE1 . PHE A 0 92 . -4.894 0.859 10.959 1.00 91.07 92 A 1 ATOM 728 C CE2 . PHE A 0 92 . -4.156 -0.919 9.465 1.00 91.07 92 A 1 ATOM 729 C CZ . PHE A 0 92 . -3.883 0.247 10.198 1.00 91.07 92 A 1 ATOM 730 N N . GLY A 0 93 . -9.686 -4.173 11.536 1.00 90.59 93 A 1 ATOM 731 C CA . GLY A 0 93 . -11.021 -4.775 11.565 1.00 90.59 93 A 1 ATOM 732 C C . GLY A 0 93 . -11.912 -4.308 10.414 1.00 90.59 93 A 1 ATOM 733 O O . GLY A 0 93 . -13.123 -4.208 10.596 1.00 90.59 93 A 1 ATOM 734 N N . ILE A 0 94 . -11.306 -3.989 9.266 1.00 91.29 94 A 1 ATOM 735 C CA . ILE A 0 94 . -12.007 -3.605 8.036 1.00 91.29 94 A 1 ATOM 736 C C . ILE A 0 94 . -12.816 -4.808 7.542 1.00 91.29 94 A 1 ATOM 737 C CB . ILE A 0 94 . -10.984 -3.097 6.994 1.00 91.29 94 A 1 ATOM 738 O O . ILE A 0 94 . -12.323 -5.940 7.556 1.00 91.29 94 A 1 ATOM 739 C CG1 . ILE A 0 94 . -10.314 -1.814 7.529 1.00 91.29 94 A 1 ATOM 740 C CG2 . ILE A 0 94 . -11.604 -2.781 5.632 1.00 91.29 94 A 1 ATOM 741 C CD1 . ILE A 0 94 . -9.267 -1.214 6.588 1.00 91.29 94 A 1 ATOM 742 N N . ASP A 0 95 . -14.067 -4.576 7.148 1.00 92.21 95 A 1 ATOM 743 C CA . ASP A 0 95 . -14.916 -5.629 6.601 1.00 92.21 95 A 1 ATOM 744 C C . ASP A 0 95 . -14.699 -5.813 5.085 1.00 92.21 95 A 1 ATOM 745 C CB . ASP A 0 95 . -16.378 -5.434 7.055 1.00 92.21 95 A 1 ATOM 746 O O . ASP A 0 95 . -13.944 -5.097 4.428 1.00 92.21 95 A 1 ATOM 747 C CG . ASP A 0 95 . -17.179 -4.345 6.337 1.00 92.21 95 A 1 ATOM 748 O OD1 . ASP A 0 95 . -16.735 -3.917 5.256 1.00 92.21 95 A 1 ATOM 749 O OD2 . ASP A 0 95 . -18.317 -4.091 6.790 1.00 92.21 95 A 1 ATOM 750 N N . SER A 0 96 . -15.343 -6.820 4.495 1.00 91.44 96 A 1 ATOM 751 C CA . SER A 0 96 . -15.186 -7.096 3.063 1.00 91.44 96 A 1 ATOM 752 C C . SER A 0 96 . -15.748 -5.996 2.155 1.00 91.44 96 A 1 ATOM 753 C CB . SER A 0 96 . -15.858 -8.425 2.715 1.00 91.44 96 A 1 ATOM 754 O O . SER A 0 96 . -15.362 -5.939 0.991 1.00 91.44 96 A 1 ATOM 755 O OG . SER A 0 96 . -17.222 -8.422 3.108 1.00 91.44 96 A 1 ATOM 756 N N . LEU A 0 97 . -16.690 -5.180 2.639 1.00 92.63 97 A 1 ATOM 757 C CA . LEU A 0 97 . -17.305 -4.112 1.851 1.00 92.63 97 A 1 ATOM 758 C C . LEU A 0 97 . -16.404 -2.875 1.848 1.00 92.63 97 A 1 ATOM 759 C CB . LEU A 0 97 . -18.706 -3.818 2.418 1.00 92.63 97 A 1 ATOM 760 O O . LEU A 0 97 . -16.098 -2.352 0.779 1.00 92.63 97 A 1 ATOM 761 C CG . LEU A 0 97 . -19.487 -2.746 1.636 1.00 92.63 97 A 1 ATOM 762 C CD1 . LEU A 0 97 . -19.755 -3.169 0.187 1.00 92.63 97 A 1 ATOM 763 C CD2 . LEU A 0 97 . -20.840 -2.515 2.314 1.00 92.63 97 A 1 ATOM 764 N N . ASP A 0 98 . -15.905 -2.498 3.023 1.00 93.52 98 A 1 ATOM 765 C CA . ASP A 0 98 . -14.926 -1.433 3.218 1.00 93.52 98 A 1 ATOM 766 C C . ASP A 0 98 . -13.638 -1.718 2.409 1.00 93.52 98 A 1 ATOM 767 C CB . ASP A 0 98 . -14.591 -1.330 4.719 1.00 93.52 98 A 1 ATOM 768 O O . ASP A 0 98 . -13.050 -0.814 1.815 1.00 93.52 98 A 1 ATOM 769 C CG . ASP A 0 98 . -15.659 -0.784 5.687 1.00 93.52 98 A 1 ATOM 770 O OD1 . ASP A 0 98 . -16.646 -0.148 5.259 1.00 93.52 98 A 1 ATOM 771 O OD2 . ASP A 0 98 . -15.425 -0.920 6.918 1.00 93.52 98 A 1 ATOM 772 N N . HIS A 0 99 . -13.217 -2.989 2.302 1.00 93.19 99 A 1 ATOM 773 C CA . HIS A 0 99 . -12.079 -3.386 1.455 1.00 93.19 99 A 1 ATOM 774 C C . HIS A 0 99 . -12.291 -3.049 -0.029 1.00 93.19 99 A 1 ATOM 775 C CB . HIS A 0 99 . -11.798 -4.886 1.621 1.00 93.19 99 A 1 ATOM 776 O O . HIS A 0 99 . -11.382 -2.549 -0.690 1.00 93.19 99 A 1 ATOM 777 C CG . HIS A 0 99 . -10.561 -5.321 0.875 1.00 93.19 99 A 1 ATOM 778 C CD2 . HIS A 0 99 . -10.516 -5.990 -0.316 1.00 93.19 99 A 1 ATOM 779 N ND1 . HIS A 0 99 . -9.261 -5.018 1.272 1.00 93.19 99 A 1 ATOM 780 C CE1 . HIS A 0 99 . -8.462 -5.504 0.316 1.00 93.19 99 A 1 ATOM 781 N NE2 . HIS A 0 99 . -9.182 -6.103 -0.647 1.00 93.19 99 A 1 ATOM 782 N N . VAL A 0 100 . -13.492 -3.288 -0.564 1.00 93.86 100 A 1 ATOM 783 C CA . VAL A 0 100 . -13.823 -2.964 -1.965 1.00 93.86 100 A 1 ATOM 784 C C . VAL A 0 100 . -13.825 -1.450 -2.191 1.00 93.86 100 A 1 ATOM 785 C CB . VAL A 0 100 . -15.168 -3.602 -2.372 1.00 93.86 100 A 1 ATOM 786 O O . VAL A 0 100 . -13.346 -0.988 -3.226 1.00 93.86 100 A 1 ATOM 787 C CG1 . VAL A 0 100 . -15.639 -3.169 -3.767 1.00 93.86 100 A 1 ATOM 788 C CG2 . VAL A 0 100 . -15.055 -5.133 -2.391 1.00 93.86 100 A 1 ATOM 789 N N . GLU A 0 101 . -14.297 -0.663 -1.220 1.00 93.49 101 A 1 ATOM 790 C CA . GLU A 0 101 . -14.235 0.804 -1.283 1.00 93.49 101 A 1 ATOM 791 C C . GLU A 0 101 . -12.793 1.324 -1.292 1.00 93.49 101 A 1 ATOM 792 C CB . GLU A 0 101 . -14.964 1.426 -0.087 1.00 93.49 101 A 1 ATOM 793 O O . GLU A 0 101 . -12.462 2.230 -2.059 1.00 93.49 101 A 1 ATOM 794 C CG . GLU A 0 101 . -16.471 1.140 -0.049 1.00 93.49 101 A 1 ATOM 795 C CD . GLU A 0 101 . -17.164 1.840 1.132 1.00 93.49 101 A 1 ATOM 796 O OE1 . GLU A 0 101 . -18.419 1.808 1.154 1.00 93.49 101 A 1 ATOM 797 O OE2 . GLU A 0 101 . -16.453 2.469 1.958 1.00 93.49 101 A 1 ATOM 798 N N . LEU A 0 102 . -11.920 0.730 -0.472 1.00 93.75 102 A 1 ATOM 799 C CA . LEU A 0 102 . -10.501 1.077 -0.420 1.00 93.75 102 A 1 ATOM 800 C C . LEU A 0 102 . -9.818 0.847 -1.772 1.00 93.75 102 A 1 ATOM 801 C CB . LEU A 0 102 . -9.829 0.215 0.660 1.00 93.75 102 A 1 ATOM 802 O O . LEU A 0 102 . -9.083 1.707 -2.257 1.00 93.75 102 A 1 ATOM 803 C CG . LEU A 0 102 . -8.418 0.702 1.023 1.00 93.75 102 A 1 ATOM 804 C CD1 . LEU A 0 102 . -8.528 1.900 1.973 1.00 93.75 102 A 1 ATOM 805 C CD2 . LEU A 0 102 . -7.641 -0.431 1.693 1.00 93.75 102 A 1 ATOM 806 N N . VAL A 0 103 . -10.074 -0.311 -2.384 1.00 94.72 103 A 1 ATOM 807 C CA . VAL A 0 103 . -9.527 -0.664 -3.699 1.00 94.72 103 A 1 ATOM 808 C C . VAL A 0 103 . -10.027 0.311 -4.761 1.00 94.72 103 A 1 ATOM 809 C CB . VAL A 0 103 . -9.864 -2.121 -4.053 1.00 94.72 103 A 1 ATOM 810 O O . VAL A 0 103 . -9.213 0.832 -5.516 1.00 94.72 103 A 1 ATOM 811 C CG1 . VAL A 0 103 . -9.464 -2.472 -5.493 1.00 94.72 103 A 1 ATOM 812 C CG2 . VAL A 0 103 . -9.108 -3.066 -3.105 1.00 94.72 103 A 1 ATOM 813 N N . MET A 0 104 . -11.320 0.639 -4.759 1.00 94.20 104 A 1 ATOM 814 C CA . MET A 0 104 . -11.904 1.607 -5.693 1.00 94.20 104 A 1 ATOM 815 C C . MET A 0 104 . -11.260 2.999 -5.573 1.00 94.20 104 A 1 ATOM 816 C CB . MET A 0 104 . -13.411 1.662 -5.423 1.00 94.20 104 A 1 ATOM 817 O O . MET A 0 104 . -10.989 3.649 -6.582 1.00 94.20 104 A 1 ATOM 818 C CG . MET A 0 104 . -14.191 2.434 -6.492 1.00 94.20 104 A 1 ATOM 819 S SD . MET A 0 104 . -15.973 2.597 -6.155 1.00 94.20 104 A 1 ATOM 820 C CE . MET A 0 104 . -16.418 0.866 -5.842 1.00 94.20 104 A 1 ATOM 821 N N . ALA A 0 105 . -10.945 3.447 -4.351 1.00 95.11 105 A 1 ATOM 822 C CA . ALA A 0 105 . -10.236 4.710 -4.132 1.00 95.11 105 A 1 ATOM 823 C C . ALA A 0 105 . -8.796 4.682 -4.684 1.00 95.11 105 A 1 ATOM 824 C CB . ALA A 0 105 . -10.254 5.024 -2.630 1.00 95.11 105 A 1 ATOM 825 O O . ALA A 0 105 . -8.304 5.679 -5.212 1.00 95.11 105 A 1 ATOM 826 N N . ILE A 0 106 . -8.111 3.539 -4.587 1.00 95.68 106 A 1 ATOM 827 C CA . ILE A 0 106 . -6.761 3.360 -5.140 1.00 95.68 106 A 1 ATOM 828 C C . ILE A 0 106 . -6.797 3.319 -6.676 1.00 95.68 106 A 1 ATOM 829 C CB . ILE A 0 106 . -6.111 2.098 -4.530 1.00 95.68 106 A 1 ATOM 830 O O . ILE A 0 106 . -5.936 3.914 -7.328 1.00 95.68 106 A 1 ATOM 831 C CG1 . ILE A 0 106 . -5.856 2.312 -3.020 1.00 95.68 106 A 1 ATOM 832 C CG2 . ILE A 0 106 . -4.786 1.747 -5.239 1.00 95.68 106 A 1 ATOM 833 C CD1 . ILE A 0 106 . -5.691 0.997 -2.258 1.00 95.68 106 A 1 ATOM 834 N N . GLU A 0 107 . -7.792 2.655 -7.262 1.00 95.68 107 A 1 ATOM 835 C CA . GLU A 0 107 . -8.022 2.625 -8.710 1.00 95.68 107 A 1 ATOM 836 C C . GLU A 0 107 . -8.215 4.027 -9.292 1.00 95.68 107 A 1 ATOM 837 C CB . GLU A 0 107 . -9.266 1.785 -9.013 1.00 95.68 107 A 1 ATOM 838 O O . GLU A 0 107 . -7.582 4.366 -10.296 1.00 95.68 107 A 1 ATOM 839 C CG . GLU A 0 107 . -8.991 0.292 -8.843 1.00 95.68 107 A 1 ATOM 840 C CD . GLU A 0 107 . -10.223 -0.557 -9.163 1.00 95.68 107 A 1 ATOM 841 O OE1 . GLU A 0 107 . -9.995 -1.699 -9.611 1.00 95.68 107 A 1 ATOM 842 O OE2 . GLU A 0 107 . -11.366 -0.078 -8.996 1.00 95.68 107 A 1 ATOM 843 N N . GLU A 0 108 . -9.026 4.863 -8.634 1.00 95.08 108 A 1 ATOM 844 C CA . GLU A 0 108 . -9.267 6.251 -9.041 1.00 95.08 108 A 1 ATOM 845 C C . GLU A 0 108 . -7.979 7.092 -8.994 1.00 95.08 108 A 1 ATOM 846 C CB . GLU A 0 108 . -10.390 6.851 -8.169 1.00 95.08 108 A 1 ATOM 847 O O . GLU A 0 108 . -7.681 7.837 -9.930 1.00 95.08 108 A 1 ATOM 848 C CG . GLU A 0 108 . -10.820 8.246 -8.660 1.00 95.08 108 A 1 ATOM 849 C CD . GLU A 0 108 . -12.046 8.841 -7.937 1.00 95.08 108 A 1 ATOM 850 O OE1 . GLU A 0 108 . -12.451 9.964 -8.331 1.00 95.08 108 A 1 ATOM 851 O OE2 . GLU A 0 108 . -12.596 8.204 -7.012 1.00 95.08 108 A 1 ATOM 852 N N . GLU A 0 109 . -7.151 6.925 -7.960 1.00 93.34 109 A 1 ATOM 853 C CA . GLU A 0 109 . -5.887 7.659 -7.834 1.00 93.34 109 A 1 ATOM 854 C C . GLU A 0 109 . -4.891 7.328 -8.950 1.00 93.34 109 A 1 ATOM 855 C CB . GLU A 0 109 . -5.250 7.348 -6.476 1.00 93.34 109 A 1 ATOM 856 O O . GLU A 0 109 . -4.281 8.223 -9.554 1.00 93.34 109 A 1 ATOM 857 C CG . GLU A 0 109 . -5.879 8.180 -5.358 1.00 93.34 109 A 1 ATOM 858 C CD . GLU A 0 109 . -5.583 9.679 -5.469 1.00 93.34 109 A 1 ATOM 859 O OE1 . GLU A 0 109 . -6.415 10.477 -4.985 1.00 93.34 109 A 1 ATOM 860 O OE2 . GLU A 0 109 . -4.490 10.033 -6.000 1.00 93.34 109 A 1 ATOM 861 N N . PHE A 0 110 . -4.697 6.046 -9.248 1.00 93.59 110 A 1 ATOM 862 C CA . PHE A 0 110 . -3.742 5.621 -10.273 1.00 93.59 110 A 1 ATOM 863 C C . PHE A 0 110 . -4.345 5.576 -11.681 1.00 93.59 110 A 1 ATOM 864 C CB . PHE A 0 110 . -3.043 4.332 -9.828 1.00 93.59 110 A 1 ATOM 865 O O . PHE A 0 110 . -3.593 5.461 -12.648 1.00 93.59 110 A 1 ATOM 866 C CG . PHE A 0 110 . -2.081 4.579 -8.679 1.00 93.59 110 A 1 ATOM 867 C CD1 . PHE A 0 110 . -0.765 5.009 -8.936 1.00 93.59 110 A 1 ATOM 868 C CD2 . PHE A 0 110 . -2.510 4.419 -7.349 1.00 93.59 110 A 1 ATOM 869 C CE1 . PHE A 0 110 . 0.114 5.275 -7.868 1.00 93.59 110 A 1 ATOM 870 C CE2 . PHE A 0 110 . -1.636 4.687 -6.282 1.00 93.59 110 A 1 ATOM 871 C CZ . PHE A 0 110 . -0.321 5.110 -6.541 1.00 93.59 110 A 1 ATOM 872 N N . ASN A 0 111 . -5.661 5.773 -11.815 1.00 92.71 111 A 1 ATOM 873 C CA . ASN A 0 111 . -6.417 5.655 -13.064 1.00 92.71 111 A 1 ATOM 874 C C . ASN A 0 111 . -6.177 4.296 -13.745 1.00 92.71 111 A 1 ATOM 875 C CB . ASN A 0 111 . -6.170 6.868 -13.979 1.00 92.71 111 A 1 ATOM 876 O O . ASN A 0 111 . -5.847 4.222 -14.932 1.00 92.71 111 A 1 ATOM 877 C CG . ASN A 0 111 . -6.608 8.172 -13.350 1.00 92.71 111 A 1 ATOM 878 N ND2 . ASN A 0 111 . -5.737 8.855 -12.650 1.00 92.71 111 A 1 ATOM 879 O OD1 . ASN A 0 111 . -7.731 8.613 -13.493 1.00 92.71 111 A 1 ATOM 880 N N . ILE A 0 112 . -6.307 3.221 -12.967 1.00 93.19 112 A 1 ATOM 881 C CA . ILE A 0 112 . -6.152 1.835 -13.422 1.00 93.19 112 A 1 ATOM 882 C C . ILE A 0 112 . -7.389 1.012 -13.060 1.00 93.19 112 A 1 ATOM 883 C CB . ILE A 0 112 . -4.869 1.180 -12.859 1.00 93.19 112 A 1 ATOM 884 O O . ILE A 0 112 . -8.115 1.355 -12.139 1.00 93.19 112 A 1 ATOM 885 C CG1 . ILE A 0 112 . -4.903 1.060 -11.320 1.00 93.19 112 A 1 ATOM 886 C CG2 . ILE A 0 112 . -3.614 1.924 -13.353 1.00 93.19 112 A 1 ATOM 887 C CD1 . ILE A 0 112 . -3.750 0.226 -10.760 1.00 93.19 112 A 1 ATOM 888 N N . GLU A 0 113 . -7.584 -0.105 -13.756 1.00 95.05 113 A 1 ATOM 889 C CA . GLU A 0 113 . -8.600 -1.109 -13.424 1.00 95.05 113 A 1 ATOM 890 C C . GLU A 0 113 . -7.914 -2.338 -12.813 1.00 95.05 113 A 1 ATOM 891 C CB . GLU A 0 113 . -9.384 -1.489 -14.692 1.00 95.05 113 A 1 ATOM 892 O O . GLU A 0 113 . -7.006 -2.916 -13.435 1.00 95.05 113 A 1 ATOM 893 C CG . GLU A 0 113 . -10.188 -0.318 -15.290 1.00 95.05 113 A 1 ATOM 894 C CD . GLU A 0 113 . -10.891 -0.670 -16.615 1.00 95.05 113 A 1 ATOM 895 O OE1 . GLU A 0 113 . -11.589 0.218 -17.158 1.00 95.05 113 A 1 ATOM 896 O OE2 . GLU A 0 113 . -10.688 -1.796 -17.131 1.00 95.05 113 A 1 ATOM 897 N N . ILE A 0 114 . -8.326 -2.732 -11.606 1.00 95.62 114 A 1 ATOM 898 C CA . ILE A 0 114 . -7.836 -3.909 -10.889 1.00 95.62 114 A 1 ATOM 899 C C . ILE A 0 114 . -8.946 -4.969 -10.901 1.00 95.62 114 A 1 ATOM 900 C CB . ILE A 0 114 . -7.388 -3.564 -9.447 1.00 95.62 114 A 1 ATOM 901 O O . ILE A 0 114 . -10.064 -4.714 -10.468 1.00 95.62 114 A 1 ATOM 902 C CG1 . ILE A 0 114 . -6.352 -2.415 -9.457 1.00 95.62 114 A 1 ATOM 903 C CG2 . ILE A 0 114 . -6.813 -4.820 -8.762 1.00 95.62 114 A 1 ATOM 904 C CD1 . ILE A 0 114 . -5.912 -1.939 -8.066 1.00 95.62 114 A 1 ATOM 905 N N . PRO A 0 115 . -8.684 -6.190 -11.394 1.00 95.76 115 A 1 ATOM 906 C CA . PRO A 0 115 . -9.695 -7.239 -11.371 1.00 95.76 115 A 1 ATOM 907 C C . PRO A 0 115 . -9.976 -7.714 -9.935 1.00 95.76 115 A 1 ATOM 908 C CB . PRO A 0 115 . -9.127 -8.348 -12.261 1.00 95.76 115 A 1 ATOM 909 O O . PRO A 0 115 . -9.054 -7.857 -9.129 1.00 95.76 115 A 1 ATOM 910 C CG . PRO A 0 115 . -7.616 -8.187 -12.097 1.00 95.76 115 A 1 ATOM 911 C CD . PRO A 0 115 . -7.427 -6.681 -11.939 1.00 95.76 115 A 1 ATOM 912 N N . ASP A 0 116 . -11.230 -8.084 -9.653 1.00 93.28 116 A 1 ATOM 913 C CA . ASP A 0 116 . -11.679 -8.566 -8.332 1.00 93.28 116 A 1 ATOM 914 C C . ASP A 0 116 . -10.836 -9.728 -7.775 1.00 93.28 116 A 1 ATOM 915 C CB . ASP A 0 116 . -13.139 -9.047 -8.417 1.00 93.28 116 A 1 ATOM 916 O O . ASP A 0 116 . -10.649 -9.876 -6.568 1.00 93.28 116 A 1 ATOM 917 C CG . ASP A 0 116 . -14.164 -7.952 -8.719 1.00 93.28 116 A 1 ATOM 918 O OD1 . ASP A 0 116 . -13.820 -6.766 -8.559 1.00 93.28 116 A 1 ATOM 919 O OD2 . ASP A 0 116 . -15.286 -8.338 -9.115 1.00 93.28 116 A 1 ATOM 920 N N . MET A 0 117 . -10.308 -10.575 -8.662 1.00 93.83 117 A 1 ATOM 921 C CA . MET A 0 117 . -9.479 -11.723 -8.280 1.00 93.83 117 A 1 ATOM 922 C C . MET A 0 117 . -8.131 -11.315 -7.674 1.00 93.83 117 A 1 ATOM 923 C CB . MET A 0 117 . -9.227 -12.606 -9.509 1.00 93.83 117 A 1 ATOM 924 O O . MET A 0 117 . -7.593 -12.054 -6.844 1.00 93.83 117 A 1 ATOM 925 C CG . MET A 0 117 . -10.501 -13.266 -10.050 1.00 93.83 117 A 1 ATOM 926 S SD . MET A 0 117 . -11.417 -14.336 -8.898 1.00 93.83 117 A 1 ATOM 927 C CE . MET A 0 117 . -10.161 -15.572 -8.482 1.00 93.83 117 A 1 ATOM 928 N N . ASP A 0 118 . -7.586 -10.173 -8.097 1.00 94.35 118 A 1 ATOM 929 C CA . ASP A 0 118 . -6.322 -9.643 -7.587 1.00 94.35 118 A 1 ATOM 930 C C . ASP A 0 118 . -6.570 -8.735 -6.381 1.00 94.35 118 A 1 ATOM 931 C CB . ASP A 0 118 . -5.546 -8.926 -8.705 1.00 94.35 118 A 1 ATOM 932 O O . ASP A 0 118 . -5.834 -8.820 -5.398 1.00 94.35 118 A 1 ATOM 933 C CG . ASP A 0 118 . -5.030 -9.883 -9.792 1.00 94.35 118 A 1 ATOM 934 O OD1 . ASP A 0 118 . -4.828 -11.091 -9.496 1.00 94.35 118 A 1 ATOM 935 O OD2 . ASP A 0 118 . -4.814 -9.408 -10.929 1.00 94.35 118 A 1 ATOM 936 N N . SER A 0 119 . -7.658 -7.957 -6.388 1.00 93.59 119 A 1 ATOM 937 C CA . SER A 0 119 . -8.009 -7.073 -5.272 1.00 93.59 119 A 1 ATOM 938 C C . SER A 0 119 . -8.269 -7.824 -3.961 1.00 93.59 119 A 1 ATOM 939 C CB . SER A 0 119 . -9.206 -6.200 -5.642 1.00 93.59 119 A 1 ATOM 940 O O . SER A 0 119 . -7.894 -7.352 -2.887 1.00 93.59 119 A 1 ATOM 941 O OG . SER A 0 119 . -10.397 -6.949 -5.715 1.00 93.59 119 A 1 ATOM 942 N N . GLN A 0 120 . -8.820 -9.040 -4.029 1.00 92.71 120 A 1 ATOM 943 C CA . GLN A 0 120 . -9.015 -9.919 -2.867 1.00 92.71 120 A 1 ATOM 944 C C . GLN A 0 120 . -7.704 -10.387 -2.213 1.00 92.71 120 A 1 ATOM 945 C CB . GLN A 0 120 . -9.825 -11.148 -3.303 1.00 92.71 120 A 1 ATOM 946 O O . GLN A 0 120 . -7.724 -10.869 -1.080 1.00 92.71 120 A 1 ATOM 947 C CG . GLN A 0 120 . -11.301 -10.810 -3.536 1.00 92.71 120 A 1 ATOM 948 C CD . GLN A 0 120 . -12.077 -11.969 -4.152 1.00 92.71 120 A 1 ATOM 949 N NE2 . GLN A 0 120 . -13.241 -11.704 -4.701 1.00 92.71 120 A 1 ATOM 950 O OE1 . GLN A 0 120 . -11.685 -13.129 -4.135 1.00 92.71 120 A 1 ATOM 951 N N . ARG A 0 121 . -6.562 -10.280 -2.906 1.00 92.39 121 A 1 ATOM 952 C CA . ARG A 0 121 . -5.251 -10.708 -2.388 1.00 92.39 121 A 1 ATOM 953 C C . ARG A 0 121 . -4.537 -9.622 -1.589 1.00 92.39 121 A 1 ATOM 954 C CB . ARG A 0 121 . -4.355 -11.191 -3.534 1.00 92.39 121 A 1 ATOM 955 O O . ARG A 0 121 . -3.540 -9.928 -0.942 1.00 92.39 121 A 1 ATOM 956 C CG . ARG A 0 121 . -4.971 -12.367 -4.295 1.00 92.39 121 A 1 ATOM 957 C CD . ARG A 0 121 . -4.040 -12.758 -5.439 1.00 92.39 121 A 1 ATOM 958 N NE . ARG A 0 121 . -4.608 -13.866 -6.217 1.00 92.39 121 A 1 ATOM 959 N NH1 . ARG A 0 121 . -3.027 -13.839 -7.875 1.00 92.39 121 A 1 ATOM 960 N NH2 . ARG A 0 121 . -4.723 -15.290 -7.982 1.00 92.39 121 A 1 ATOM 961 C CZ . ARG A 0 121 . -4.113 -14.329 -7.347 1.00 92.39 121 A 1 ATOM 962 N N . PHE A 0 122 . -5.021 -8.383 -1.623 1.00 93.67 122 A 1 ATOM 963 C CA . PHE A 0 122 . -4.420 -7.270 -0.895 1.00 93.67 122 A 1 ATOM 964 C C . PHE A 0 122 . -4.708 -7.384 0.603 1.00 93.67 122 A 1 ATOM 965 C CB . PHE A 0 122 . -4.919 -5.945 -1.487 1.00 93.67 122 A 1 ATOM 966 O O . PHE A 0 122 . -5.738 -6.930 1.091 1.00 93.67 122 A 1 ATOM 967 C CG . PHE A 0 122 . -4.604 -5.704 -2.953 1.00 93.67 122 A 1 ATOM 968 C CD1 . PHE A 0 122 . -3.442 -6.226 -3.559 1.00 93.67 122 A 1 ATOM 969 C CD2 . PHE A 0 122 . -5.480 -4.909 -3.712 1.00 93.67 122 A 1 ATOM 970 C CE1 . PHE A 0 122 . -3.186 -5.982 -4.918 1.00 93.67 122 A 1 ATOM 971 C CE2 . PHE A 0 122 . -5.210 -4.646 -5.065 1.00 93.67 122 A 1 ATOM 972 C CZ . PHE A 0 122 . -4.070 -5.196 -5.674 1.00 93.67 122 A 1 ATOM 973 N N . LEU A 0 123 . -3.792 -8.003 1.348 1.00 92.66 123 A 1 ATOM 974 C CA . LEU A 0 123 . -3.909 -8.134 2.803 1.00 92.66 123 A 1 ATOM 975 C C . LEU A 0 123 . -3.232 -6.973 3.531 1.00 92.66 123 A 1 ATOM 976 C CB . LEU A 0 123 . -3.307 -9.477 3.241 1.00 92.66 123 A 1 ATOM 977 O O . LEU A 0 123 . -3.639 -6.629 4.643 1.00 92.66 123 A 1 ATOM 978 C CG . LEU A 0 123 . -4.005 -10.715 2.648 1.00 92.66 123 A 1 ATOM 979 C CD1 . LEU A 0 123 . -3.299 -11.975 3.155 1.00 92.66 123 A 1 ATOM 980 C CD2 . LEU A 0 123 . -5.482 -10.803 3.040 1.00 92.66 123 A 1 ATOM 981 N N . SER A 0 124 . -2.205 -6.393 2.910 1.00 93.93 124 A 1 ATOM 982 C CA . SER A 0 124 . -1.385 -5.320 3.460 1.00 93.93 124 A 1 ATOM 983 C C . SER A 0 124 . -1.153 -4.186 2.450 1.00 93.93 124 A 1 ATOM 984 C CB . SER A 0 124 . -0.050 -5.907 3.929 1.00 93.93 124 A 1 ATOM 985 O O . SER A 0 124 . -1.223 -4.410 1.237 1.00 93.93 124 A 1 ATOM 986 O OG . SER A 0 124 . 0.732 -6.356 2.836 1.00 93.93 124 A 1 ATOM 987 N N . PRO A 0 125 . -0.820 -2.964 2.913 1.00 94.82 125 A 1 ATOM 988 C CA . PRO A 0 125 . -0.402 -1.868 2.036 1.00 94.82 125 A 1 ATOM 989 C C . PRO A 0 125 . 0.781 -2.230 1.131 1.00 94.82 125 A 1 ATOM 990 C CB . PRO A 0 125 . -0.020 -0.725 2.981 1.00 94.82 125 A 1 ATOM 991 O O . PRO A 0 125 . 0.860 -1.755 -0.000 1.00 94.82 125 A 1 ATOM 992 C CG . PRO A 0 125 . -0.862 -0.990 4.227 1.00 94.82 125 A 1 ATOM 993 C CD . PRO A 0 125 . -0.903 -2.511 4.295 1.00 94.82 125 A 1 ATOM 994 N N . GLN A 0 126 . 1.692 -3.081 1.615 1.00 95.18 126 A 1 ATOM 995 C CA . GLN A 0 126 . 2.837 -3.554 0.842 1.00 95.18 126 A 1 ATOM 996 C C . GLN A 0 126 . 2.416 -4.333 -0.413 1.00 95.18 126 A 1 ATOM 997 C CB . GLN A 0 126 . 3.727 -4.404 1.760 1.00 95.18 126 A 1 ATOM 998 O O . GLN A 0 126 . 3.009 -4.128 -1.471 1.00 95.18 126 A 1 ATOM 999 C CG . GLN A 0 126 . 5.014 -4.839 1.050 1.00 95.18 126 A 1 ATOM 1000 C CD . GLN A 0 126 . 5.968 -5.620 1.945 1.00 95.18 126 A 1 ATOM 1001 N NE2 . GLN A 0 126 . 7.169 -5.876 1.476 1.00 95.18 126 A 1 ATOM 1002 O OE1 . GLN A 0 126 . 5.687 -6.024 3.059 1.00 95.18 126 A 1 ATOM 1003 N N . ASP A 0 127 . 1.381 -5.175 -0.320 1.00 94.99 127 A 1 ATOM 1004 C CA . ASP A 0 127 . 0.882 -5.959 -1.460 1.00 94.99 127 A 1 ATOM 1005 C C . ASP A 0 127 . 0.351 -5.044 -2.575 1.00 94.99 127 A 1 ATOM 1006 C CB . ASP A 0 127 . -0.233 -6.918 -1.004 1.00 94.99 127 A 1 ATOM 1007 O O . ASP A 0 127 . 0.590 -5.281 -3.759 1.00 94.99 127 A 1 ATOM 1008 C CG . ASP A 0 127 . 0.199 -7.879 0.107 1.00 94.99 127 A 1 ATOM 1009 O OD1 . ASP A 0 127 . 1.302 -8.456 0.003 1.00 94.99 127 A 1 ATOM 1010 O OD2 . ASP A 0 127 . -0.574 -8.004 1.092 1.00 94.99 127 A 1 ATOM 1011 N N . ILE A 0 128 . -0.317 -3.955 -2.184 1.00 95.24 128 A 1 ATOM 1012 C CA . ILE A 0 128 . -0.850 -2.937 -3.098 1.00 95.24 128 A 1 ATOM 1013 C C . ILE A 0 128 . 0.297 -2.208 -3.803 1.00 95.24 128 A 1 ATOM 1014 C CB . ILE A 0 128 . -1.749 -1.947 -2.322 1.00 95.24 128 A 1 ATOM 1015 O O . ILE A 0 128 . 0.282 -2.064 -5.024 1.00 95.24 128 A 1 ATOM 1016 C CG1 . ILE A 0 128 . -2.947 -2.689 -1.683 1.00 95.24 128 A 1 ATOM 1017 C CG2 . ILE A 0 128 . -2.239 -0.804 -3.231 1.00 95.24 128 A 1 ATOM 1018 C CD1 . ILE A 0 128 . -3.743 -1.853 -0.677 1.00 95.24 128 A 1 ATOM 1019 N N . ILE A 0 129 . 1.308 -1.768 -3.048 1.00 95.15 129 A 1 ATOM 1020 C CA . ILE A 0 129 . 2.481 -1.077 -3.604 1.00 95.15 129 A 1 ATOM 1021 C C . ILE A 0 129 . 3.203 -1.981 -4.607 1.00 95.15 129 A 1 ATOM 1022 C CB . ILE A 0 129 . 3.424 -0.618 -2.471 1.00 95.15 129 A 1 ATOM 1023 O O . ILE A 0 129 . 3.527 -1.526 -5.702 1.00 95.15 129 A 1 ATOM 1024 C CG1 . ILE A 0 129 . 2.761 0.495 -1.627 1.00 95.15 129 A 1 ATOM 1025 C CG2 . ILE A 0 129 . 4.766 -0.100 -3.030 1.00 95.15 129 A 1 ATOM 1026 C CD1 . ILE A 0 129 . 3.328 0.586 -0.205 1.00 95.15 129 A 1 ATOM 1027 N N . GLN A 0 130 . 3.411 -3.257 -4.268 1.00 94.51 130 A 1 ATOM 1028 C CA . GLN A 0 130 . 4.061 -4.211 -5.164 1.00 94.51 130 A 1 ATOM 1029 C C . GLN A 0 130 . 3.267 -4.394 -6.462 1.00 94.51 130 A 1 ATOM 1030 C CB . GLN A 0 130 . 4.258 -5.550 -4.436 1.00 94.51 130 A 1 ATOM 1031 O O . GLN A 0 130 . 3.838 -4.302 -7.545 1.00 94.51 130 A 1 ATOM 1032 C CG . GLN A 0 130 . 5.043 -6.566 -5.285 1.00 94.51 130 A 1 ATOM 1033 C CD . GLN A 0 130 . 6.446 -6.075 -5.633 1.00 94.51 130 A 1 ATOM 1034 N NE2 . GLN A 0 130 . 6.820 -6.037 -6.892 1.00 94.51 130 A 1 ATOM 1035 O OE1 . GLN A 0 130 . 7.228 -5.709 -4.764 1.00 94.51 130 A 1 ATOM 1036 N N . TYR A 0 131 . 1.948 -4.575 -6.361 1.00 95.39 131 A 1 ATOM 1037 C CA . TYR A 0 131 . 1.083 -4.711 -7.532 1.00 95.39 131 A 1 ATOM 1038 C C . TYR A 0 131 . 1.131 -3.470 -8.438 1.00 95.39 131 A 1 ATOM 1039 C CB . TYR A 0 131 . -0.340 -5.000 -7.043 1.00 95.39 131 A 1 ATOM 1040 O O . TYR A 0 131 . 1.180 -3.588 -9.663 1.00 95.39 131 A 1 ATOM 1041 C CG . TYR A 0 131 . -1.340 -5.182 -8.165 1.00 95.39 131 A 1 ATOM 1042 C CD1 . TYR A 0 131 . -2.049 -4.070 -8.654 1.00 95.39 131 A 1 ATOM 1043 C CD2 . TYR A 0 131 . -1.532 -6.452 -8.743 1.00 95.39 131 A 1 ATOM 1044 C CE1 . TYR A 0 131 . -2.938 -4.222 -9.731 1.00 95.39 131 A 1 ATOM 1045 C CE2 . TYR A 0 131 . -2.436 -6.612 -9.814 1.00 95.39 131 A 1 ATOM 1046 O OH . TYR A 0 131 . -3.992 -5.620 -11.360 1.00 95.39 131 A 1 ATOM 1047 C CZ . TYR A 0 131 . -3.136 -5.493 -10.312 1.00 95.39 131 A 1 ATOM 1048 N N . LEU A 0 132 . 1.163 -2.269 -7.853 1.00 94.80 132 A 1 ATOM 1049 C CA . LEU A 0 132 . 1.282 -1.016 -8.601 1.00 94.80 132 A 1 ATOM 1050 C C . LEU A 0 132 . 2.657 -0.852 -9.262 1.00 94.80 132 A 1 ATOM 1051 C CB . LEU A 0 132 . 0.987 0.163 -7.661 1.00 94.80 132 A 1 ATOM 1052 O O . LEU A 0 132 . 2.728 -0.388 -10.400 1.00 94.80 132 A 1 ATOM 1053 C CG . LEU A 0 132 . -0.483 0.270 -7.221 1.00 94.80 132 A 1 ATOM 1054 C CD1 . LEU A 0 132 . -0.602 1.348 -6.150 1.00 94.80 132 A 1 ATOM 1055 C CD2 . LEU A 0 132 . -1.401 0.647 -8.379 1.00 94.80 132 A 1 ATOM 1056 N N . CYS A 0 133 . 3.738 -1.246 -8.588 1.00 94.12 133 A 1 ATOM 1057 C CA . CYS A 0 133 . 5.084 -1.266 -9.164 1.00 94.12 133 A 1 ATOM 1058 C C . CYS A 0 133 . 5.155 -2.177 -10.395 1.00 94.12 133 A 1 ATOM 1059 C CB . CYS A 0 133 . 6.083 -1.714 -8.090 1.00 94.12 133 A 1 ATOM 1060 O O . CYS A 0 133 . 5.636 -1.737 -11.440 1.00 94.12 133 A 1 ATOM 1061 S SG . CYS A 0 133 . 6.474 -0.324 -6.991 1.00 94.12 133 A 1 ATOM 1062 N N . ASP A 0 134 . 4.603 -3.389 -10.301 1.00 93.96 134 A 1 ATOM 1063 C CA . ASP A 0 134 . 4.566 -4.353 -11.407 1.00 93.96 134 A 1 ATOM 1064 C C . ASP A 0 134 . 3.707 -3.835 -12.575 1.00 93.96 134 A 1 ATOM 1065 C CB . ASP A 0 134 . 4.023 -5.704 -10.903 1.00 93.96 134 A 1 ATOM 1066 O O . ASP A 0 134 . 4.065 -3.991 -13.739 1.00 93.96 134 A 1 ATOM 1067 C CG . ASP A 0 134 . 4.892 -6.409 -9.847 1.00 93.96 134 A 1 ATOM 1068 O OD1 . ASP A 0 134 . 6.082 -6.059 -9.679 1.00 93.96 134 A 1 ATOM 1069 O OD2 . ASP A 0 134 . 4.367 -7.336 -9.190 1.00 93.96 134 A 1 ATOM 1070 N N . ARG A 0 135 . 2.585 -3.159 -12.282 1.00 92.26 135 A 1 ATOM 1071 C CA . ARG A 0 135 . 1.693 -2.557 -13.292 1.00 92.26 135 A 1 ATOM 1072 C C . ARG A 0 135 . 2.349 -1.398 -14.052 1.00 92.26 135 A 1 ATOM 1073 C CB . ARG A 0 135 . 0.416 -2.078 -12.579 1.00 92.26 135 A 1 ATOM 1074 O O . ARG A 0 135 . 2.033 -1.188 -15.222 1.00 92.26 135 A 1 ATOM 1075 C CG . ARG A 0 135 . -0.749 -1.677 -13.498 1.00 92.26 135 A 1 ATOM 1076 C CD . ARG A 0 135 . -1.597 -2.884 -13.909 1.00 92.26 135 A 1 ATOM 1077 N NE . ARG A 0 135 . -2.782 -2.460 -14.681 1.00 92.26 135 A 1 ATOM 1078 N NH1 . ARG A 0 135 . -3.595 -4.554 -15.137 1.00 92.26 135 A 1 ATOM 1079 N NH2 . ARG A 0 135 . -4.754 -2.758 -15.781 1.00 92.26 135 A 1 ATOM 1080 C CZ . ARG A 0 135 . -3.698 -3.256 -15.202 1.00 92.26 135 A 1 ATOM 1081 N N . HIS A 0 136 . 3.198 -0.618 -13.383 1.00 90.51 136 A 1 ATOM 1082 C CA . HIS A 0 136 . 3.861 0.563 -13.946 1.00 90.51 136 A 1 ATOM 1083 C C . HIS A 0 136 . 5.302 0.302 -14.417 1.00 90.51 136 A 1 ATOM 1084 C CB . HIS A 0 136 . 3.766 1.731 -12.947 1.00 90.51 136 A 1 ATOM 1085 O O . HIS A 0 136 . 5.971 1.254 -14.821 1.00 90.51 136 A 1 ATOM 1086 C CG . HIS A 0 136 . 2.379 2.308 -12.821 1.00 90.51 136 A 1 ATOM 1087 C CD2 . HIS A 0 136 . 1.587 2.325 -11.704 1.00 90.51 136 A 1 ATOM 1088 N ND1 . HIS A 0 136 . 1.687 2.960 -13.816 1.00 90.51 136 A 1 ATOM 1089 C CE1 . HIS A 0 136 . 0.505 3.354 -13.315 1.00 90.51 136 A 1 ATOM 1090 N NE2 . HIS A 0 136 . 0.403 3.001 -12.026 1.00 90.51 136 A 1 ATOM 1091 N N . ASP A 0 137 . 5.774 -0.949 -14.376 1.00 91.58 137 A 1 ATOM 1092 C CA . ASP A 0 137 . 7.157 -1.341 -14.682 1.00 91.58 137 A 1 ATOM 1093 C C . ASP A 0 137 . 8.208 -0.546 -13.876 1.00 91.58 137 A 1 ATOM 1094 C CB . ASP A 0 137 . 7.409 -1.328 -16.202 1.00 91.58 137 A 1 ATOM 1095 O O . ASP A 0 137 . 9.290 -0.212 -14.369 1.00 91.58 137 A 1 ATOM 1096 C CG . ASP A 0 137 . 6.577 -2.360 -16.966 1.00 91.58 137 A 1 ATOM 1097 O OD1 . ASP A 0 137 . 6.623 -3.544 -16.557 1.00 91.58 137 A 1 ATOM 1098 O OD2 . ASP A 0 137 . 5.999 -1.982 -18.013 1.00 91.58 137 A 1 ATOM 1099 N N . VAL A 0 138 . 7.886 -0.218 -12.620 1.00 89.73 138 A 1 ATOM 1100 C CA . VAL A 0 138 . 8.766 0.525 -11.711 1.00 89.73 138 A 1 ATOM 1101 C C . VAL A 0 138 . 9.473 -0.461 -10.794 1.00 89.73 138 A 1 ATOM 1102 C CB . VAL A 0 138 . 8.014 1.606 -10.913 1.00 89.73 138 A 1 ATOM 1103 O O . VAL A 0 138 . 8.923 -0.900 -9.785 1.00 89.73 138 A 1 ATOM 1104 C CG1 . VAL A 0 138 . 8.969 2.414 -10.021 1.00 89.73 138 A 1 ATOM 1105 C CG2 . VAL A 0 138 . 7.318 2.606 -11.842 1.00 89.73 138 A 1 ATOM 1106 N N . TYR A 0 139 . 10.717 -0.768 -11.141 1.00 81.57 139 A 1 ATOM 1107 C CA . TYR A 0 139 . 11.629 -1.564 -10.328 1.00 81.57 139 A 1 ATOM 1108 C C . TYR A 0 139 . 12.725 -0.642 -9.778 1.00 81.57 139 A 1 ATOM 1109 C CB . TYR A 0 139 . 12.167 -2.738 -11.164 1.00 81.57 139 A 1 ATOM 1110 O O . TYR A 0 139 . 13.185 0.252 -10.494 1.00 81.57 139 A 1 ATOM 1111 C CG . TYR A 0 139 . 11.083 -3.530 -11.887 1.00 81.57 139 A 1 ATOM 1112 C CD1 . TYR A 0 139 . 10.315 -4.489 -11.195 1.00 81.57 139 A 1 ATOM 1113 C CD2 . TYR A 0 139 . 10.789 -3.251 -13.239 1.00 81.57 139 A 1 ATOM 1114 C CE1 . TYR A 0 139 . 9.265 -5.166 -11.851 1.00 81.57 139 A 1 ATOM 1115 C CE2 . TYR A 0 139 . 9.735 -3.918 -13.894 1.00 81.57 139 A 1 ATOM 1116 O OH . TYR A 0 139 . 7.937 -5.504 -13.827 1.00 81.57 139 A 1 ATOM 1117 C CZ . TYR A 0 139 . 8.969 -4.878 -13.201 1.00 81.57 139 A 1 ATOM 1118 N N . ASP A 0 140 . 13.094 -0.824 -8.508 1.00 73.38 140 A 1 ATOM 1119 C CA . ASP A 0 140 . 14.227 -0.113 -7.893 1.00 73.38 140 A 1 ATOM 1120 C C . ASP A 0 140 . 15.575 -0.515 -8.514 1.00 73.38 140 A 1 ATOM 1121 C CB . ASP A 0 140 . 14.265 -0.352 -6.369 1.00 73.38 140 A 1 ATOM 1122 O O . ASP A 0 140 . 15.740 -1.711 -8.861 1.00 73.38 140 A 1 ATOM 1123 C CG . ASP A 0 140 . 13.107 0.239 -5.555 1.00 73.38 140 A 1 ATOM 1124 O OD1 . ASP A 0 140 . 12.664 1.384 -5.815 1.00 73.38 140 A 1 ATOM 1125 O OD2 . ASP A 0 140 . 12.682 -0.458 -4.595 1.00 73.38 140 A 1 ATOM 1126 O OXT . ASP A 0 140 . 16.444 0.384 -8.582 1.00 73.38 140 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 76.83 # loop_ _atom_type.symbol C N O S #