3zee.cif

data_3ZEE
# 
_entry.id   3ZEE 
# 
_audit_conform.dict_name       mmcif_pdbx.dic 
_audit_conform.dict_version    5.284 
_audit_conform.dict_location   http://mmcif.pdb.org/dictionaries/ascii/mmcif_pdbx.dic 
# 
loop_
_database_2.database_id 
_database_2.database_code 
PDB   3ZEE         
PDBE  EBI-54961    
WWPDB D_1290054961 
# 
_pdbx_database_related.db_name        EMDB 
_pdbx_database_related.db_id          EMD-2237 
_pdbx_database_related.content_type   'associated EM volume' 
_pdbx_database_related.details        'ELECTRON CYRO-MICROSCOPY HELICAL RECONSTRUCTION OF PAR-3 N-TERMINAL DOMAIN' 
# 
_pdbx_database_status.status_code                     REL 
_pdbx_database_status.entry_id                        3ZEE 
_pdbx_database_status.deposit_site                    PDBE 
_pdbx_database_status.process_site                    PDBE 
_pdbx_database_status.SG_entry                        . 
_pdbx_database_status.recvd_initial_deposition_date   2012-12-05 
_pdbx_database_status.pdb_format_compatible           Y 
_pdbx_database_status.status_code_sf                  ? 
_pdbx_database_status.status_code_mr                  ? 
_pdbx_database_status.status_code_cs                  ? 
_pdbx_database_status.methods_development_category    ? 
# 
loop_
_audit_author.name 
_audit_author.pdbx_ordinal 
'Zhang, Y.' 1 
'Wang, W.'  2 
'Chen, J.'  3 
'Zhang, K.' 4 
'Gao, F.'   5 
'Gong, W.'  6 
'Zhang, M.' 7 
'Sun, F.'   8 
'Feng, W.'  9 
# 
_citation.id                        primary 
_citation.title                     'Structural Insights Into the Intrinsic Self-Assembly of Par-3 N-Terminal Domain.' 
_citation.journal_abbrev            Structure 
_citation.journal_volume            21 
_citation.page_first                997 
_citation.page_last                 ? 
_citation.year                      2013 
_citation.journal_id_ASTM           STRUE6 
_citation.country                   UK 
_citation.journal_id_ISSN           0969-2126 
_citation.journal_id_CSD            2005 
_citation.book_publisher            ? 
_citation.pdbx_database_id_PubMed   23643951 
_citation.pdbx_database_id_DOI      10.1016/J.STR.2013.04.004 
# 
loop_
_citation_author.citation_id 
_citation_author.name 
_citation_author.ordinal 
primary 'Zhang, Y.'       1  
primary 'Wang, W.'        2  
primary 'Chen, J.'        3  
primary 'Zhang, K.'       4  
primary 'Gao, F.'         5  
primary 'Gao, B.'         6  
primary 'Zhang, S.'       7  
primary 'Dong, M.'        8  
primary 'Besenbacher, F.' 9  
primary 'Gong, W.'        10 
primary 'Zhang, M.'       11 
primary 'Sun, F.'         12 
primary 'Feng, W.'        13 
# 
_cell.entry_id           3ZEE 
_cell.length_a           1.000 
_cell.length_b           1.000 
_cell.length_c           1.000 
_cell.angle_alpha        90.00 
_cell.angle_beta         90.00 
_cell.angle_gamma        90.00 
_cell.Z_PDB              1 
_cell.pdbx_unique_axis   ? 
# 
_symmetry.entry_id                         3ZEE 
_symmetry.space_group_name_H-M             'P 1' 
_symmetry.pdbx_full_space_group_name_H-M   ? 
_symmetry.cell_setting                     ? 
_symmetry.Int_Tables_number                1 
# 
_entity.id                         1 
_entity.type                       polymer 
_entity.src_method                 man 
_entity.pdbx_description           'PARTITIONING DEFECTIVE 3 HOMOLOG' 
_entity.formula_weight             9552.906 
_entity.pdbx_number_of_molecules   1 
_entity.pdbx_ec                    ? 
_entity.pdbx_mutation              ? 
_entity.pdbx_fragment              'N-TERMINAL DUF3534 DOMAIN, RESIDUES 2-82' 
_entity.details                    ? 
# 
_entity_name_com.entity_id   1 
_entity_name_com.name        
'PAR-3, PARD-3, ATYPICAL PKC ISOTYPE-SPECIFIC-INTERACTING PROTEIN, ASIP, ATYPICAL PKC-SPECIFIC-BINDING PROTEIN, ASBP' 
# 
_entity_poly.entity_id                      1 
_entity_poly.type                           'polypeptide(L)' 
_entity_poly.nstd_linkage                   no 
_entity_poly.nstd_monomer                   no 
_entity_poly.pdbx_seq_one_letter_code       
;SEFKVTVCFGRTRVVVPCGDGRMKVFSLIQQAVTRYRKAVAKDPNYWIQVHRLEHGDGGILDLDDILCDVADDKDRLVAV
FDEQ
;
_entity_poly.pdbx_seq_one_letter_code_can   
;SEFKVTVCFGRTRVVVPCGDGRMKVFSLIQQAVTRYRKAVAKDPNYWIQVHRLEHGDGGILDLDDILCDVADDKDRLVAV
FDEQ
;
_entity_poly.pdbx_strand_id                 A 
_entity_poly.pdbx_target_identifier         ? 
# 
loop_
_entity_poly_seq.entity_id 
_entity_poly_seq.num 
_entity_poly_seq.mon_id 
_entity_poly_seq.hetero 
1 1  SER n 
1 2  GLU n 
1 3  PHE n 
1 4  LYS n 
1 5  VAL n 
1 6  THR n 
1 7  VAL n 
1 8  CYS n 
1 9  PHE n 
1 10 GLY n 
1 11 ARG n 
1 12 THR n 
1 13 ARG n 
1 14 VAL n 
1 15 VAL n 
1 16 VAL n 
1 17 PRO n 
1 18 CYS n 
1 19 GLY n 
1 20 ASP n 
1 21 GLY n 
1 22 ARG n 
1 23 MET n 
1 24 LYS n 
1 25 VAL n 
1 26 PHE n 
1 27 SER n 
1 28 LEU n 
1 29 ILE n 
1 30 GLN n 
1 31 GLN n 
1 32 ALA n 
1 33 VAL n 
1 34 THR n 
1 35 ARG n 
1 36 TYR n 
1 37 ARG n 
1 38 LYS n 
1 39 ALA n 
1 40 VAL n 
1 41 ALA n 
1 42 LYS n 
1 43 ASP n 
1 44 PRO n 
1 45 ASN n 
1 46 TYR n 
1 47 TRP n 
1 48 ILE n 
1 49 GLN n 
1 50 VAL n 
1 51 HIS n 
1 52 ARG n 
1 53 LEU n 
1 54 GLU n 
1 55 HIS n 
1 56 GLY n 
1 57 ASP n 
1 58 GLY n 
1 59 GLY n 
1 60 ILE n 
1 61 LEU n 
1 62 ASP n 
1 63 LEU n 
1 64 ASP n 
1 65 ASP n 
1 66 ILE n 
1 67 LEU n 
1 68 CYS n 
1 69 ASP n 
1 70 VAL n 
1 71 ALA n 
1 72 ASP n 
1 73 ASP n 
1 74 LYS n 
1 75 ASP n 
1 76 ARG n 
1 77 LEU n 
1 78 VAL n 
1 79 ALA n 
1 80 VAL n 
1 81 PHE n 
1 82 ASP n 
1 83 GLU n 
1 84 GLN n 
# 
_entity_src_gen.entity_id                          1 
_entity_src_gen.pdbx_src_id                        1 
_entity_src_gen.pdbx_alt_source_flag               sample 
_entity_src_gen.pdbx_seq_type                      ? 
_entity_src_gen.pdbx_beg_seq_num                   ? 
_entity_src_gen.pdbx_end_seq_num                   ? 
_entity_src_gen.gene_src_common_name               'NORWAY RAT' 
_entity_src_gen.gene_src_genus                     ? 
_entity_src_gen.pdbx_gene_src_gene                 ? 
_entity_src_gen.gene_src_species                   ? 
_entity_src_gen.gene_src_strain                    ? 
_entity_src_gen.gene_src_tissue                    ? 
_entity_src_gen.gene_src_tissue_fraction           ? 
_entity_src_gen.gene_src_details                   ? 
_entity_src_gen.pdbx_gene_src_fragment             ? 
_entity_src_gen.pdbx_gene_src_scientific_name      'RATTUS NORVEGICUS' 
_entity_src_gen.pdbx_gene_src_ncbi_taxonomy_id     10116 
_entity_src_gen.pdbx_gene_src_variant              ? 
_entity_src_gen.pdbx_gene_src_cell_line            ? 
_entity_src_gen.pdbx_gene_src_atcc                 ? 
_entity_src_gen.pdbx_gene_src_organ                ? 
_entity_src_gen.pdbx_gene_src_organelle            ? 
_entity_src_gen.pdbx_gene_src_cell                 ? 
_entity_src_gen.pdbx_gene_src_cellular_location    ? 
_entity_src_gen.host_org_common_name               ? 
_entity_src_gen.pdbx_host_org_scientific_name      'ESCHERICHIA COLI' 
_entity_src_gen.pdbx_host_org_ncbi_taxonomy_id     511693 
_entity_src_gen.host_org_genus                     ? 
_entity_src_gen.pdbx_host_org_gene                 ? 
_entity_src_gen.pdbx_host_org_organ                ? 
_entity_src_gen.host_org_species                   ? 
_entity_src_gen.pdbx_host_org_tissue               ? 
_entity_src_gen.pdbx_host_org_tissue_fraction      ? 
_entity_src_gen.pdbx_host_org_strain               BL21 
_entity_src_gen.pdbx_host_org_variant              CODONPLUS 
_entity_src_gen.pdbx_host_org_cell_line            ? 
_entity_src_gen.pdbx_host_org_atcc                 ? 
_entity_src_gen.pdbx_host_org_culture_collection   ? 
_entity_src_gen.pdbx_host_org_cell                 ? 
_entity_src_gen.pdbx_host_org_organelle            ? 
_entity_src_gen.pdbx_host_org_cellular_location    ? 
_entity_src_gen.pdbx_host_org_vector_type          PLASMID 
_entity_src_gen.pdbx_host_org_vector               PET32A 
_entity_src_gen.host_org_details                   ? 
_entity_src_gen.expression_system_id               ? 
_entity_src_gen.plasmid_name                       ? 
_entity_src_gen.plasmid_details                    ? 
_entity_src_gen.pdbx_description                   ? 
# 
_struct_ref.id                         1 
_struct_ref.db_name                    UNP 
_struct_ref.db_code                    PARD3_RAT 
_struct_ref.entity_id                  1 
_struct_ref.pdbx_seq_one_letter_code   ? 
_struct_ref.pdbx_align_begin           ? 
_struct_ref.pdbx_db_accession          Q9Z340 
_struct_ref.pdbx_db_isoform            ? 
# 
_struct_ref_seq.align_id                      1 
_struct_ref_seq.ref_id                        1 
_struct_ref_seq.pdbx_PDB_id_code              3ZEE 
_struct_ref_seq.pdbx_strand_id                A 
_struct_ref_seq.seq_align_beg                 4 
_struct_ref_seq.pdbx_seq_align_beg_ins_code   ? 
_struct_ref_seq.seq_align_end                 84 
_struct_ref_seq.pdbx_seq_align_end_ins_code   ? 
_struct_ref_seq.pdbx_db_accession             Q9Z340 
_struct_ref_seq.db_align_beg                  2 
_struct_ref_seq.pdbx_db_align_beg_ins_code    ? 
_struct_ref_seq.db_align_end                  82 
_struct_ref_seq.pdbx_db_align_end_ins_code    ? 
_struct_ref_seq.pdbx_auth_seq_align_beg       2 
_struct_ref_seq.pdbx_auth_seq_align_end       82 
# 
loop_
_struct_ref_seq_dif.align_id 
_struct_ref_seq_dif.pdbx_pdb_id_code 
_struct_ref_seq_dif.mon_id 
_struct_ref_seq_dif.pdbx_pdb_strand_id 
_struct_ref_seq_dif.seq_num 
_struct_ref_seq_dif.pdbx_pdb_ins_code 
_struct_ref_seq_dif.pdbx_seq_db_name 
_struct_ref_seq_dif.pdbx_seq_db_accession_code 
_struct_ref_seq_dif.db_mon_id 
_struct_ref_seq_dif.pdbx_seq_db_seq_num 
_struct_ref_seq_dif.details 
_struct_ref_seq_dif.pdbx_auth_seq_num 
_struct_ref_seq_dif.pdbx_ordinal 
1 3ZEE SER A 1 ? UNP Q9Z340 ? ? 'expression tag' -1 1 
1 3ZEE GLU A 2 ? UNP Q9Z340 ? ? 'expression tag' 0  2 
1 3ZEE PHE A 3 ? UNP Q9Z340 ? ? 'expression tag' 1  3 
# 
loop_
_chem_comp.id 
_chem_comp.type 
_chem_comp.mon_nstd_flag 
_chem_comp.name 
_chem_comp.pdbx_synonyms 
_chem_comp.formula 
_chem_comp.formula_weight 
ALA 'L-peptide linking' y ALANINE         ? 'C3 H7 N O2'     89.093  
ARG 'L-peptide linking' y ARGININE        ? 'C6 H15 N4 O2 1' 175.209 
ASN 'L-peptide linking' y ASPARAGINE      ? 'C4 H8 N2 O3'    132.118 
ASP 'L-peptide linking' y 'ASPARTIC ACID' ? 'C4 H7 N O4'     133.103 
CYS 'L-peptide linking' y CYSTEINE        ? 'C3 H7 N O2 S'   121.158 
GLN 'L-peptide linking' y GLUTAMINE       ? 'C5 H10 N2 O3'   146.144 
GLU 'L-peptide linking' y 'GLUTAMIC ACID' ? 'C5 H9 N O4'     147.129 
GLY 'peptide linking'   y GLYCINE         ? 'C2 H5 N O2'     75.067  
HIS 'L-peptide linking' y HISTIDINE       ? 'C6 H10 N3 O2 1' 156.162 
ILE 'L-peptide linking' y ISOLEUCINE      ? 'C6 H13 N O2'    131.173 
LEU 'L-peptide linking' y LEUCINE         ? 'C6 H13 N O2'    131.173 
LYS 'L-peptide linking' y LYSINE          ? 'C6 H15 N2 O2 1' 147.195 
MET 'L-peptide linking' y METHIONINE      ? 'C5 H11 N O2 S'  149.211 
PHE 'L-peptide linking' y PHENYLALANINE   ? 'C9 H11 N O2'    165.189 
PRO 'L-peptide linking' y PROLINE         ? 'C5 H9 N O2'     115.130 
SER 'L-peptide linking' y SERINE          ? 'C3 H7 N O3'     105.093 
THR 'L-peptide linking' y THREONINE       ? 'C4 H9 N O3'     119.119 
TRP 'L-peptide linking' y TRYPTOPHAN      ? 'C11 H12 N2 O2'  204.225 
TYR 'L-peptide linking' y TYROSINE        ? 'C9 H11 N O3'    181.189 
VAL 'L-peptide linking' y VALINE          ? 'C5 H11 N O2'    117.146 
# 
_exptl.entry_id          3ZEE 
_exptl.method            'ELECTRON MICROSCOPY' 
_exptl.crystals_number   ? 
# 
_exptl_crystal.id                    1 
_exptl_crystal.density_meas          ? 
_exptl_crystal.density_Matthews      ? 
_exptl_crystal.density_percent_sol   ? 
_exptl_crystal.description           ? 
# 
_diffrn.id                     1 
_diffrn.ambient_temp           ? 
_diffrn.ambient_temp_details   ? 
_diffrn.crystal_id             1 
# 
_diffrn_radiation.diffrn_id                        1 
_diffrn_radiation.wavelength_id                    1 
_diffrn_radiation.pdbx_monochromatic_or_laue_m_l   ? 
_diffrn_radiation.monochromator                    ? 
_diffrn_radiation.pdbx_diffrn_protocol             ? 
_diffrn_radiation.pdbx_scattering_type             ? 
# 
_diffrn_radiation_wavelength.id           1 
_diffrn_radiation_wavelength.wavelength   . 
_diffrn_radiation_wavelength.wt           1.0 
# 
_refine.pdbx_refine_id                           'ELECTRON MICROSCOPY' 
_refine.entry_id                                 3ZEE 
_refine.pdbx_diffrn_id                           1 
_refine.pdbx_TLS_residual_ADP_flag               ? 
_refine.ls_number_reflns_obs                     ? 
_refine.ls_number_reflns_all                     ? 
_refine.pdbx_ls_sigma_I                          ? 
_refine.pdbx_ls_sigma_F                          ? 
_refine.pdbx_data_cutoff_high_absF               ? 
_refine.pdbx_data_cutoff_low_absF                ? 
_refine.pdbx_data_cutoff_high_rms_absF           ? 
_refine.ls_d_res_low                             ? 
_refine.ls_d_res_high                            6.10 
_refine.ls_percent_reflns_obs                    ? 
_refine.ls_R_factor_obs                          ? 
_refine.ls_R_factor_all                          ? 
_refine.ls_R_factor_R_work                       ? 
_refine.ls_R_factor_R_free                       ? 
_refine.ls_R_factor_R_free_error                 ? 
_refine.ls_R_factor_R_free_error_details         ? 
_refine.ls_percent_reflns_R_free                 ? 
_refine.ls_number_reflns_R_free                  ? 
_refine.ls_number_parameters                     ? 
_refine.ls_number_restraints                     ? 
_refine.occupancy_min                            ? 
_refine.occupancy_max                            ? 
_refine.correlation_coeff_Fo_to_Fc               ? 
_refine.correlation_coeff_Fo_to_Fc_free          ? 
_refine.B_iso_mean                               ? 
_refine.aniso_B[1][1]                            ? 
_refine.aniso_B[2][2]                            ? 
_refine.aniso_B[3][3]                            ? 
_refine.aniso_B[1][2]                            ? 
_refine.aniso_B[1][3]                            ? 
_refine.aniso_B[2][3]                            ? 
_refine.solvent_model_details                    ? 
_refine.solvent_model_param_ksol                 ? 
_refine.solvent_model_param_bsol                 ? 
_refine.pdbx_solvent_vdw_probe_radii             ? 
_refine.pdbx_solvent_ion_probe_radii             ? 
_refine.pdbx_solvent_shrinkage_radii             ? 
_refine.pdbx_ls_cross_valid_method               ? 
_refine.details                                  ? 
_refine.pdbx_starting_model                      ? 
_refine.pdbx_method_to_determine_struct          ? 
_refine.pdbx_isotropic_thermal_model             ? 
_refine.pdbx_stereochemistry_target_values       ? 
_refine.pdbx_stereochem_target_val_spec_case     ? 
_refine.pdbx_R_Free_selection_details            ? 
_refine.pdbx_overall_ESU_R                       ? 
_refine.pdbx_overall_ESU_R_Free                  ? 
_refine.overall_SU_ML                            ? 
_refine.pdbx_overall_phase_error                 ? 
_refine.overall_SU_B                             ? 
_refine.overall_SU_R_Cruickshank_DPI             ? 
_refine.pdbx_overall_SU_R_free_Cruickshank_DPI   ? 
_refine.pdbx_overall_SU_R_Blow_DPI               ? 
_refine.pdbx_overall_SU_R_free_Blow_DPI          ? 
# 
_refine_hist.pdbx_refine_id                   'ELECTRON MICROSCOPY' 
_refine_hist.cycle_id                         LAST 
_refine_hist.pdbx_number_atoms_protein        670 
_refine_hist.pdbx_number_atoms_nucleic_acid   0 
_refine_hist.pdbx_number_atoms_ligand         0 
_refine_hist.number_atoms_solvent             0 
_refine_hist.number_atoms_total               670 
_refine_hist.d_res_high                       6.10 
_refine_hist.d_res_low                        . 
# 
_struct.entry_id                  3ZEE 
_struct.title                     'Electron cyro-microscopy helical reconstruction of Par-3 N terminal domain' 
_struct.pdbx_descriptor           'PARTITIONING DEFECTIVE 3 HOMOLOG' 
_struct.pdbx_model_details        ? 
_struct.pdbx_CASP_flag            ? 
_struct.pdbx_model_type_details   ? 
# 
_struct_keywords.entry_id        3ZEE 
_struct_keywords.pdbx_keywords   'CELL CYCLE' 
_struct_keywords.text            'CELL CYCLE' 
# 
_struct_asym.id                            A 
_struct_asym.pdbx_blank_PDB_chainid_flag   N 
_struct_asym.pdbx_modified                 N 
_struct_asym.entity_id                     1 
_struct_asym.details                       ? 
# 
_struct_biol.id   1 
# 
loop_
_struct_conf.conf_type_id 
_struct_conf.id 
_struct_conf.pdbx_PDB_helix_id 
_struct_conf.beg_label_comp_id 
_struct_conf.beg_label_asym_id 
_struct_conf.beg_label_seq_id 
_struct_conf.pdbx_beg_PDB_ins_code 
_struct_conf.end_label_comp_id 
_struct_conf.end_label_asym_id 
_struct_conf.end_label_seq_id 
_struct_conf.pdbx_end_PDB_ins_code 
_struct_conf.beg_auth_comp_id 
_struct_conf.beg_auth_asym_id 
_struct_conf.beg_auth_seq_id 
_struct_conf.end_auth_comp_id 
_struct_conf.end_auth_asym_id 
_struct_conf.end_auth_seq_id 
_struct_conf.pdbx_PDB_helix_class 
_struct_conf.details 
_struct_conf.pdbx_PDB_helix_length 
HELX_P HELX_P1 1 VAL A 25 ? ALA A 41 ? VAL A 23 ALA A 39 1 ? 17 
HELX_P HELX_P2 2 ILE A 66 ? ALA A 71 ? ILE A 64 ALA A 69 1 ? 6  
# 
_struct_conf_type.id          HELX_P 
_struct_conf_type.criteria    ? 
_struct_conf_type.reference   ? 
# 
loop_
_struct_sheet.id 
_struct_sheet.type 
_struct_sheet.number_strands 
_struct_sheet.details 
AA ? 2 ? 
AB ? 2 ? 
# 
loop_
_struct_sheet_order.sheet_id 
_struct_sheet_order.range_id_1 
_struct_sheet_order.range_id_2 
_struct_sheet_order.offset 
_struct_sheet_order.sense 
AA 1 2 ? anti-parallel 
AB 1 2 ? anti-parallel 
# 
loop_
_struct_sheet_range.sheet_id 
_struct_sheet_range.id 
_struct_sheet_range.beg_label_comp_id 
_struct_sheet_range.beg_label_asym_id 
_struct_sheet_range.beg_label_seq_id 
_struct_sheet_range.pdbx_beg_PDB_ins_code 
_struct_sheet_range.end_label_comp_id 
_struct_sheet_range.end_label_asym_id 
_struct_sheet_range.end_label_seq_id 
_struct_sheet_range.pdbx_end_PDB_ins_code 
_struct_sheet_range.beg_auth_comp_id 
_struct_sheet_range.beg_auth_asym_id 
_struct_sheet_range.beg_auth_seq_id 
_struct_sheet_range.end_auth_comp_id 
_struct_sheet_range.end_auth_asym_id 
_struct_sheet_range.end_auth_seq_id 
AA 1 LYS A 4  ? VAL A 7  ? LYS A 2  VAL A 5  
AA 2 VAL A 14 ? PRO A 17 ? VAL A 12 PRO A 15 
AB 1 GLN A 49 ? GLU A 54 ? GLN A 47 GLU A 52 
AB 2 VAL A 78 ? ASP A 82 ? VAL A 76 ASP A 80 
# 
loop_
_pdbx_struct_sheet_hbond.sheet_id 
_pdbx_struct_sheet_hbond.range_id_1 
_pdbx_struct_sheet_hbond.range_id_2 
_pdbx_struct_sheet_hbond.range_1_label_atom_id 
_pdbx_struct_sheet_hbond.range_1_label_comp_id 
_pdbx_struct_sheet_hbond.range_1_label_asym_id 
_pdbx_struct_sheet_hbond.range_1_label_seq_id 
_pdbx_struct_sheet_hbond.range_1_PDB_ins_code 
_pdbx_struct_sheet_hbond.range_1_auth_atom_id 
_pdbx_struct_sheet_hbond.range_1_auth_comp_id 
_pdbx_struct_sheet_hbond.range_1_auth_asym_id 
_pdbx_struct_sheet_hbond.range_1_auth_seq_id 
_pdbx_struct_sheet_hbond.range_2_label_atom_id 
_pdbx_struct_sheet_hbond.range_2_label_comp_id 
_pdbx_struct_sheet_hbond.range_2_label_asym_id 
_pdbx_struct_sheet_hbond.range_2_label_seq_id 
_pdbx_struct_sheet_hbond.range_2_PDB_ins_code 
_pdbx_struct_sheet_hbond.range_2_auth_atom_id 
_pdbx_struct_sheet_hbond.range_2_auth_comp_id 
_pdbx_struct_sheet_hbond.range_2_auth_asym_id 
_pdbx_struct_sheet_hbond.range_2_auth_seq_id 
AA 1 2 N VAL A 7  ? N VAL A 5  O VAL A 14 ? O VAL A 12 
AB 1 2 N GLU A 54 ? N GLU A 52 O VAL A 78 ? O VAL A 76 
# 
_database_PDB_matrix.entry_id          3ZEE 
_database_PDB_matrix.origx[1][1]       1.000000 
_database_PDB_matrix.origx[1][2]       0.000000 
_database_PDB_matrix.origx[1][3]       0.000000 
_database_PDB_matrix.origx[2][1]       0.000000 
_database_PDB_matrix.origx[2][2]       1.000000 
_database_PDB_matrix.origx[2][3]       0.000000 
_database_PDB_matrix.origx[3][1]       0.000000 
_database_PDB_matrix.origx[3][2]       0.000000 
_database_PDB_matrix.origx[3][3]       1.000000 
_database_PDB_matrix.origx_vector[1]   0.00000 
_database_PDB_matrix.origx_vector[2]   0.00000 
_database_PDB_matrix.origx_vector[3]   0.00000 
# 
_atom_sites.entry_id                    3ZEE 
_atom_sites.fract_transf_matrix[1][1]   1.000000 
_atom_sites.fract_transf_matrix[1][2]   0.000000 
_atom_sites.fract_transf_matrix[1][3]   0.000000 
_atom_sites.fract_transf_matrix[2][1]   0.000000 
_atom_sites.fract_transf_matrix[2][2]   1.000000 
_atom_sites.fract_transf_matrix[2][3]   0.000000 
_atom_sites.fract_transf_matrix[3][1]   0.000000 
_atom_sites.fract_transf_matrix[3][2]   0.000000 
_atom_sites.fract_transf_matrix[3][3]   1.000000 
_atom_sites.fract_transf_vector[1]      0.00000 
_atom_sites.fract_transf_vector[2]      0.00000 
_atom_sites.fract_transf_vector[3]      0.00000 
# 
loop_
_atom_type.symbol 
C 
N 
O 
S 
# 
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.pdbx_formal_charge 
_atom_site.auth_seq_id 
_atom_site.auth_comp_id 
_atom_site.auth_asym_id 
_atom_site.auth_atom_id 
_atom_site.pdbx_PDB_model_num 
ATOM 1   N N   . SER A 1 1  ? 20.382 16.896 -34.002 1.00 0.00 ? -1 SER A N   1 
ATOM 2   C CA  . SER A 1 1  ? 19.728 15.758 -34.646 1.00 0.00 ? -1 SER A CA  1 
ATOM 3   C C   . SER A 1 1  ? 18.471 15.425 -33.947 1.00 0.00 ? -1 SER A C   1 
ATOM 4   O O   . SER A 1 1  ? 17.479 16.154 -34.029 1.00 0.00 ? -1 SER A O   1 
ATOM 5   C CB  . SER A 1 1  ? 20.622 14.513 -34.931 1.00 0.00 ? -1 SER A CB  1 
ATOM 6   O OG  . SER A 1 1  ? 21.783 14.909 -35.601 1.00 0.00 ? -1 SER A OG  1 
ATOM 7   N N   . GLU A 1 2  ? 18.487 14.327 -33.084 1.00 0.00 ? 0  GLU A N   1 
ATOM 8   C CA  . GLU A 1 2  ? 17.288 13.983 -32.291 1.00 0.00 ? 0  GLU A CA  1 
ATOM 9   C C   . GLU A 1 2  ? 17.770 13.581 -30.943 1.00 0.00 ? 0  GLU A C   1 
ATOM 10  O O   . GLU A 1 2  ? 16.983 13.807 -30.032 1.00 0.00 ? 0  GLU A O   1 
ATOM 11  C CB  . GLU A 1 2  ? 16.364 12.915 -32.947 1.00 0.00 ? 0  GLU A CB  1 
ATOM 12  C CG  . GLU A 1 2  ? 16.173 13.057 -34.489 1.00 0.00 ? 0  GLU A CG  1 
ATOM 13  C CD  . GLU A 1 2  ? 15.588 14.241 -35.149 1.00 0.00 ? 0  GLU A CD  1 
ATOM 14  O OE1 . GLU A 1 2  ? 14.535 14.779 -34.644 1.00 0.00 ? 0  GLU A OE1 1 
ATOM 15  O OE2 . GLU A 1 2  ? 16.093 14.752 -36.176 1.00 0.00 ? 0  GLU A OE2 1 
ATOM 16  N N   . PHE A 1 3  ? 18.957 13.093 -30.702 1.00 0.00 ? 1  PHE A N   1 
ATOM 17  C CA  . PHE A 1 3  ? 19.586 12.794 -29.422 1.00 0.00 ? 1  PHE A CA  1 
ATOM 18  C C   . PHE A 1 3  ? 19.718 14.023 -28.465 1.00 0.00 ? 1  PHE A C   1 
ATOM 19  O O   . PHE A 1 3  ? 20.241 15.066 -28.884 1.00 0.00 ? 1  PHE A O   1 
ATOM 20  C CB  . PHE A 1 3  ? 20.987 12.333 -29.765 1.00 0.00 ? 1  PHE A CB  1 
ATOM 21  C CG  . PHE A 1 3  ? 21.388 11.213 -28.851 1.00 0.00 ? 1  PHE A CG  1 
ATOM 22  C CD1 . PHE A 1 3  ? 21.012 9.906  -29.172 1.00 0.00 ? 1  PHE A CD1 1 
ATOM 23  C CD2 . PHE A 1 3  ? 22.260 11.415 -27.808 1.00 0.00 ? 1  PHE A CD2 1 
ATOM 24  C CE1 . PHE A 1 3  ? 21.479 8.815  -28.459 1.00 0.00 ? 1  PHE A CE1 1 
ATOM 25  C CE2 . PHE A 1 3  ? 22.730 10.359 -27.057 1.00 0.00 ? 1  PHE A CE2 1 
ATOM 26  C CZ  . PHE A 1 3  ? 22.335 9.044  -27.355 1.00 0.00 ? 1  PHE A CZ  1 
ATOM 27  N N   . LYS A 1 4  ? 19.644 13.811 -27.139 1.00 0.00 ? 2  LYS A N   1 
ATOM 28  C CA  . LYS A 1 4  ? 20.075 14.724 -26.056 1.00 0.00 ? 2  LYS A CA  1 
ATOM 29  C C   . LYS A 1 4  ? 20.223 14.034 -24.690 1.00 0.00 ? 2  LYS A C   1 
ATOM 30  O O   . LYS A 1 4  ? 19.669 12.957 -24.420 1.00 0.00 ? 2  LYS A O   1 
ATOM 31  C CB  . LYS A 1 4  ? 19.030 15.968 -25.850 1.00 0.00 ? 2  LYS A CB  1 
ATOM 32  C CG  . LYS A 1 4  ? 18.779 16.959 -27.008 1.00 0.00 ? 2  LYS A CG  1 
ATOM 33  C CD  . LYS A 1 4  ? 17.830 18.126 -26.793 1.00 0.00 ? 2  LYS A CD  1 
ATOM 34  C CE  . LYS A 1 4  ? 17.612 19.095 -28.049 1.00 0.00 ? 2  LYS A CE  1 
ATOM 35  N NZ  . LYS A 1 4  ? 16.652 20.133 -27.665 1.00 0.00 ? 2  LYS A NZ  1 
ATOM 36  N N   . VAL A 1 5  ? 21.083 14.626 -23.810 1.00 0.00 ? 3  VAL A N   1 
ATOM 37  C CA  . VAL A 1 5  ? 21.387 13.974 -22.505 1.00 0.00 ? 3  VAL A CA  1 
ATOM 38  C C   . VAL A 1 5  ? 21.521 14.975 -21.388 1.00 0.00 ? 3  VAL A C   1 
ATOM 39  O O   . VAL A 1 5  ? 21.386 16.150 -21.610 1.00 0.00 ? 3  VAL A O   1 
ATOM 40  C CB  . VAL A 1 5  ? 22.656 13.153 -22.649 1.00 0.00 ? 3  VAL A CB  1 
ATOM 41  C CG1 . VAL A 1 5  ? 22.679 12.163 -21.506 1.00 0.00 ? 3  VAL A CG1 1 
ATOM 42  C CG2 . VAL A 1 5  ? 22.663 12.441 -24.037 1.00 0.00 ? 3  VAL A CG2 1 
ATOM 43  N N   . THR A 1 6  ? 21.777 14.537 -20.151 1.00 0.00 ? 4  THR A N   1 
ATOM 44  C CA  . THR A 1 6  ? 21.843 15.383 -18.942 1.00 0.00 ? 4  THR A CA  1 
ATOM 45  C C   . THR A 1 6  ? 23.000 15.044 -18.117 1.00 0.00 ? 4  THR A C   1 
ATOM 46  O O   . THR A 1 6  ? 23.151 14.024 -17.584 1.00 0.00 ? 4  THR A O   1 
ATOM 47  C CB  . THR A 1 6  ? 20.563 15.437 -18.062 1.00 0.00 ? 4  THR A CB  1 
ATOM 48  O OG1 . THR A 1 6  ? 19.434 14.762 -18.577 1.00 0.00 ? 4  THR A OG1 1 
ATOM 49  C CG2 . THR A 1 6  ? 20.088 16.887 -17.670 1.00 0.00 ? 4  THR A CG2 1 
ATOM 50  N N   . VAL A 1 7  ? 23.890 16.081 -17.907 1.00 0.00 ? 5  VAL A N   1 
ATOM 51  C CA  . VAL A 1 7  ? 25.037 15.986 -17.031 1.00 0.00 ? 5  VAL A CA  1 
ATOM 52  C C   . VAL A 1 7  ? 24.719 16.681 -15.714 1.00 0.00 ? 5  VAL A C   1 
ATOM 53  O O   . VAL A 1 7  ? 24.176 17.784 -15.837 1.00 0.00 ? 5  VAL A O   1 
ATOM 54  C CB  . VAL A 1 7  ? 26.267 16.647 -17.622 1.00 0.00 ? 5  VAL A CB  1 
ATOM 55  C CG1 . VAL A 1 7  ? 27.418 16.965 -16.643 1.00 0.00 ? 5  VAL A CG1 1 
ATOM 56  C CG2 . VAL A 1 7  ? 26.621 15.576 -18.661 1.00 0.00 ? 5  VAL A CG2 1 
ATOM 57  N N   . CYS A 1 8  ? 25.070 16.122 -14.506 1.00 0.00 ? 6  CYS A N   1 
ATOM 58  C CA  . CYS A 1 8  ? 24.741 16.931 -13.355 1.00 0.00 ? 6  CYS A CA  1 
ATOM 59  C C   . CYS A 1 8  ? 25.987 17.517 -12.778 1.00 0.00 ? 6  CYS A C   1 
ATOM 60  O O   . CYS A 1 8  ? 26.704 16.879 -11.978 1.00 0.00 ? 6  CYS A O   1 
ATOM 61  C CB  . CYS A 1 8  ? 23.939 16.138 -12.284 1.00 0.00 ? 6  CYS A CB  1 
ATOM 62  S SG  . CYS A 1 8  ? 22.796 14.919 -12.832 1.00 0.00 ? 6  CYS A SG  1 
ATOM 63  N N   . PHE A 1 9  ? 26.280 18.754 -13.158 1.00 0.00 ? 7  PHE A N   1 
ATOM 64  C CA  . PHE A 1 9  ? 27.436 19.430 -12.554 1.00 0.00 ? 7  PHE A CA  1 
ATOM 65  C C   . PHE A 1 9  ? 27.035 20.041 -11.185 1.00 0.00 ? 7  PHE A C   1 
ATOM 66  O O   . PHE A 1 9  ? 26.739 21.202 -11.132 1.00 0.00 ? 7  PHE A O   1 
ATOM 67  C CB  . PHE A 1 9  ? 28.120 20.621 -13.291 1.00 0.00 ? 7  PHE A CB  1 
ATOM 68  C CG  . PHE A 1 9  ? 28.826 20.205 -14.553 1.00 0.00 ? 7  PHE A CG  1 
ATOM 69  C CD1 . PHE A 1 9  ? 29.629 19.007 -14.543 1.00 0.00 ? 7  PHE A CD1 1 
ATOM 70  C CD2 . PHE A 1 9  ? 28.932 21.099 -15.638 1.00 0.00 ? 7  PHE A CD2 1 
ATOM 71  C CE1 . PHE A 1 9  ? 30.350 18.710 -15.739 1.00 0.00 ? 7  PHE A CE1 1 
ATOM 72  C CE2 . PHE A 1 9  ? 29.656 20.773 -16.741 1.00 0.00 ? 7  PHE A CE2 1 
ATOM 73  C CZ  . PHE A 1 9  ? 30.420 19.614 -16.772 1.00 0.00 ? 7  PHE A CZ  1 
ATOM 74  N N   . GLY A 1 10 ? 27.071 19.275 -10.086 1.00 0.00 ? 8  GLY A N   1 
ATOM 75  C CA  . GLY A 1 10 ? 26.750 19.861 -8.799  1.00 0.00 ? 8  GLY A CA  1 
ATOM 76  C C   . GLY A 1 10 ? 25.286 20.263 -8.838  1.00 0.00 ? 8  GLY A C   1 
ATOM 77  O O   . GLY A 1 10 ? 24.428 19.548 -9.319  1.00 0.00 ? 8  GLY A O   1 
ATOM 78  N N   . ARG A 1 11 ? 24.954 21.360 -8.200  1.00 0.00 ? 9  ARG A N   1 
ATOM 79  C CA  . ARG A 1 11 ? 23.600 21.877 -7.927  1.00 0.00 ? 9  ARG A CA  1 
ATOM 80  C C   . ARG A 1 11 ? 22.779 22.247 -9.183  1.00 0.00 ? 9  ARG A C   1 
ATOM 81  O O   . ARG A 1 11 ? 21.642 21.979 -9.339  1.00 0.00 ? 9  ARG A O   1 
ATOM 82  C CB  . ARG A 1 11 ? 23.462 23.235 -7.108  1.00 0.00 ? 9  ARG A CB  1 
ATOM 83  C CG  . ARG A 1 11 ? 24.479 23.509 -5.945  1.00 0.00 ? 9  ARG A CG  1 
ATOM 84  C CD  . ARG A 1 11 ? 24.314 22.951 -4.571  1.00 0.00 ? 9  ARG A CD  1 
ATOM 85  N NE  . ARG A 1 11 ? 23.768 21.519 -4.751  1.00 0.00 ? 9  ARG A NE  1 
ATOM 86  C CZ  . ARG A 1 11 ? 24.543 20.461 -5.064  1.00 0.00 ? 9  ARG A CZ  1 
ATOM 87  N NH1 . ARG A 1 11 ? 25.865 20.651 -5.416  1.00 0.00 ? 9  ARG A NH1 1 
ATOM 88  N NH2 . ARG A 1 11 ? 23.957 19.221 -5.058  1.00 0.00 ? 9  ARG A NH2 1 
ATOM 89  N N   . THR A 1 12 ? 23.434 22.729 -10.212 1.00 0.00 ? 10 THR A N   1 
ATOM 90  C CA  . THR A 1 12 ? 22.901 22.939 -11.482 1.00 0.00 ? 10 THR A CA  1 
ATOM 91  C C   . THR A 1 12 ? 23.088 21.736 -12.227 1.00 0.00 ? 10 THR A C   1 
ATOM 92  O O   . THR A 1 12 ? 24.086 21.111 -12.276 1.00 0.00 ? 10 THR A O   1 
ATOM 93  C CB  . THR A 1 12 ? 23.554 24.176 -12.094 1.00 0.00 ? 10 THR A CB  1 
ATOM 94  O OG1 . THR A 1 12 ? 23.222 25.137 -11.190 1.00 0.00 ? 10 THR A OG1 1 
ATOM 95  C CG2 . THR A 1 12 ? 22.813 24.549 -13.446 1.00 0.00 ? 10 THR A CG2 1 
ATOM 96  N N   . ARG A 1 13 ? 22.117 21.318 -12.944 1.00 0.00 ? 11 ARG A N   1 
ATOM 97  C CA  . ARG A 1 13 ? 22.256 20.188 -13.807 1.00 0.00 ? 11 ARG A CA  1 
ATOM 98  C C   . ARG A 1 13 ? 22.209 20.869 -15.033 1.00 0.00 ? 11 ARG A C   1 
ATOM 99  O O   . ARG A 1 13 ? 21.731 21.963 -15.199 1.00 0.00 ? 11 ARG A O   1 
ATOM 100 C CB  . ARG A 1 13 ? 21.095 19.217 -13.884 1.00 0.00 ? 11 ARG A CB  1 
ATOM 101 C CG  . ARG A 1 13 ? 19.638 19.748 -14.030 1.00 0.00 ? 11 ARG A CG  1 
ATOM 102 C CD  . ARG A 1 13 ? 18.841 20.271 -12.759 1.00 0.00 ? 11 ARG A CD  1 
ATOM 103 N NE  . ARG A 1 13 ? 18.809 19.153 -11.785 1.00 0.00 ? 11 ARG A NE  1 
ATOM 104 C CZ  . ARG A 1 13 ? 19.643 18.880 -10.729 1.00 0.00 ? 11 ARG A CZ  1 
ATOM 105 N NH1 . ARG A 1 13 ? 20.580 19.776 -10.460 1.00 0.00 ? 11 ARG A NH1 1 
ATOM 106 N NH2 . ARG A 1 13 ? 19.545 17.740 -10.004 1.00 0.00 ? 11 ARG A NH2 1 
ATOM 107 N N   . VAL A 1 14 ? 22.937 20.309 -15.984 1.00 0.00 ? 12 VAL A N   1 
ATOM 108 C CA  . VAL A 1 14 ? 23.104 21.019 -17.170 1.00 0.00 ? 12 VAL A CA  1 
ATOM 109 C C   . VAL A 1 14 ? 22.807 20.017 -18.184 1.00 0.00 ? 12 VAL A C   1 
ATOM 110 O O   . VAL A 1 14 ? 23.327 18.948 -18.198 1.00 0.00 ? 12 VAL A O   1 
ATOM 111 C CB  . VAL A 1 14 ? 24.475 21.513 -17.336 1.00 0.00 ? 12 VAL A CB  1 
ATOM 112 C CG1 . VAL A 1 14 ? 25.542 20.486 -16.920 1.00 0.00 ? 12 VAL A CG1 1 
ATOM 113 C CG2 . VAL A 1 14 ? 24.671 21.991 -18.776 1.00 0.00 ? 12 VAL A CG2 1 
ATOM 114 N N   . VAL A 1 15 ? 21.804 20.490 -18.916 1.00 0.00 ? 13 VAL A N   1 
ATOM 115 C CA  . VAL A 1 15 ? 21.093 19.910 -19.949 1.00 0.00 ? 13 VAL A CA  1 
ATOM 116 C C   . VAL A 1 15 ? 22.124 20.010 -21.006 1.00 0.00 ? 13 VAL A C   1 
ATOM 117 O O   . VAL A 1 15 ? 22.814 20.998 -20.997 1.00 0.00 ? 13 VAL A O   1 
ATOM 118 C CB  . VAL A 1 15 ? 19.923 20.815 -20.347 1.00 0.00 ? 13 VAL A CB  1 
ATOM 119 C CG1 . VAL A 1 15 ? 20.009 22.395 -20.133 1.00 0.00 ? 13 VAL A CG1 1 
ATOM 120 C CG2 . VAL A 1 15 ? 19.415 20.525 -21.805 1.00 0.00 ? 13 VAL A CG2 1 
ATOM 121 N N   . VAL A 1 16 ? 22.314 18.957 -21.813 1.00 0.00 ? 14 VAL A N   1 
ATOM 122 C CA  . VAL A 1 16 ? 23.311 18.959 -22.788 1.00 0.00 ? 14 VAL A CA  1 
ATOM 123 C C   . VAL A 1 16 ? 22.610 18.684 -24.052 1.00 0.00 ? 14 VAL A C   1 
ATOM 124 O O   . VAL A 1 16 ? 22.017 17.677 -24.167 1.00 0.00 ? 14 VAL A O   1 
ATOM 125 C CB  . VAL A 1 16 ? 24.261 17.889 -22.498 1.00 0.00 ? 14 VAL A CB  1 
ATOM 126 C CG1 . VAL A 1 16 ? 25.469 18.097 -23.429 1.00 0.00 ? 14 VAL A CG1 1 
ATOM 127 C CG2 . VAL A 1 16 ? 24.654 18.005 -21.022 1.00 0.00 ? 14 VAL A CG2 1 
ATOM 128 N N   . PRO A 1 17 ? 22.780 19.547 -25.026 1.00 0.00 ? 15 PRO A N   1 
ATOM 129 C CA  . PRO A 1 17 ? 22.295 19.305 -26.336 1.00 0.00 ? 15 PRO A CA  1 
ATOM 130 C C   . PRO A 1 17 ? 23.285 18.338 -26.956 1.00 0.00 ? 15 PRO A C   1 
ATOM 131 O O   . PRO A 1 17 ? 24.477 18.464 -26.567 1.00 0.00 ? 15 PRO A O   1 
ATOM 132 C CB  . PRO A 1 17 ? 22.211 20.700 -27.002 1.00 0.00 ? 15 PRO A CB  1 
ATOM 133 C CG  . PRO A 1 17 ? 23.371 21.413 -26.320 1.00 0.00 ? 15 PRO A CG  1 
ATOM 134 C CD  . PRO A 1 17 ? 23.259 20.895 -24.924 1.00 0.00 ? 15 PRO A CD  1 
ATOM 135 N N   . CYS A 1 18 ? 22.886 17.283 -27.683 1.00 0.00 ? 16 CYS A N   1 
ATOM 136 C CA  . CYS A 1 18 ? 23.913 16.288 -27.912 1.00 0.00 ? 16 CYS A CA  1 
ATOM 137 C C   . CYS A 1 18 ? 24.046 15.995 -29.319 1.00 0.00 ? 16 CYS A C   1 
ATOM 138 O O   . CYS A 1 18 ? 24.697 15.101 -29.836 1.00 0.00 ? 16 CYS A O   1 
ATOM 139 C CB  . CYS A 1 18 ? 23.592 15.072 -27.087 1.00 0.00 ? 16 CYS A CB  1 
ATOM 140 S SG  . CYS A 1 18 ? 23.774 15.475 -25.391 1.00 0.00 ? 16 CYS A SG  1 
ATOM 141 N N   . GLY A 1 19 ? 23.198 16.655 -30.072 1.00 0.00 ? 17 GLY A N   1 
ATOM 142 C CA  . GLY A 1 19 ? 22.889 16.539 -31.426 1.00 0.00 ? 17 GLY A CA  1 
ATOM 143 C C   . GLY A 1 19 ? 22.563 15.113 -31.762 1.00 0.00 ? 17 GLY A C   1 
ATOM 144 O O   . GLY A 1 19 ? 21.363 14.763 -31.632 1.00 0.00 ? 17 GLY A O   1 
ATOM 145 N N   . ASP A 1 20 ? 23.493 14.364 -32.320 1.00 0.00 ? 18 ASP A N   1 
ATOM 146 C CA  . ASP A 1 20 ? 23.142 13.096 -32.883 1.00 0.00 ? 18 ASP A CA  1 
ATOM 147 C C   . ASP A 1 20 ? 23.711 12.072 -31.909 1.00 0.00 ? 18 ASP A C   1 
ATOM 148 O O   . ASP A 1 20 ? 23.337 10.906 -31.947 1.00 0.00 ? 18 ASP A O   1 
ATOM 149 C CB  . ASP A 1 20 ? 23.840 12.798 -34.210 1.00 0.00 ? 18 ASP A CB  1 
ATOM 150 C CG  . ASP A 1 20 ? 23.123 11.768 -35.099 1.00 0.00 ? 18 ASP A CG  1 
ATOM 151 O OD1 . ASP A 1 20 ? 23.021 10.555 -34.669 1.00 0.00 ? 18 ASP A OD1 1 
ATOM 152 O OD2 . ASP A 1 20 ? 22.730 12.128 -36.220 1.00 0.00 ? 18 ASP A OD2 1 
ATOM 153 N N   . GLY A 1 21 ? 24.635 12.453 -30.980 1.00 0.00 ? 19 GLY A N   1 
ATOM 154 C CA  . GLY A 1 21 ? 25.360 11.624 -30.041 1.00 0.00 ? 19 GLY A CA  1 
ATOM 155 C C   . GLY A 1 21 ? 26.498 10.831 -30.624 1.00 0.00 ? 19 GLY A C   1 
ATOM 156 O O   . GLY A 1 21 ? 27.091 9.968  -29.946 1.00 0.00 ? 19 GLY A O   1 
ATOM 157 N N   . ARG A 1 22 ? 26.814 11.090 -31.922 1.00 0.00 ? 20 ARG A N   1 
ATOM 158 C CA  . ARG A 1 22 ? 27.866 10.430 -32.583 1.00 0.00 ? 20 ARG A CA  1 
ATOM 159 C C   . ARG A 1 22 ? 29.042 11.313 -32.322 1.00 0.00 ? 20 ARG A C   1 
ATOM 160 O O   . ARG A 1 22 ? 29.195 12.407 -32.891 1.00 0.00 ? 20 ARG A O   1 
ATOM 161 C CB  . ARG A 1 22 ? 27.512 10.311 -34.069 1.00 0.00 ? 20 ARG A CB  1 
ATOM 162 C CG  . ARG A 1 22 ? 26.302 9.385  -34.236 1.00 0.00 ? 20 ARG A CG  1 
ATOM 163 C CD  . ARG A 1 22 ? 26.560 7.818  -33.953 1.00 0.00 ? 20 ARG A CD  1 
ATOM 164 N NE  . ARG A 1 22 ? 27.301 7.294  -35.139 1.00 0.00 ? 20 ARG A NE  1 
ATOM 165 C CZ  . ARG A 1 22 ? 28.634 7.352  -35.180 1.00 0.00 ? 20 ARG A CZ  1 
ATOM 166 N NH1 . ARG A 1 22 ? 29.409 7.275  -34.037 1.00 0.00 ? 20 ARG A NH1 1 
ATOM 167 N NH2 . ARG A 1 22 ? 29.267 7.341  -36.377 1.00 0.00 ? 20 ARG A NH2 1 
ATOM 168 N N   . MET A 1 23 ? 29.884 10.768 -31.368 1.00 0.00 ? 21 MET A N   1 
ATOM 169 C CA  . MET A 1 23 ? 31.060 11.375 -30.785 1.00 0.00 ? 21 MET A CA  1 
ATOM 170 C C   . MET A 1 23 ? 31.620 10.452 -29.737 1.00 0.00 ? 21 MET A C   1 
ATOM 171 O O   . MET A 1 23 ? 30.895 9.713  -29.100 1.00 0.00 ? 21 MET A O   1 
ATOM 172 C CB  . MET A 1 23 ? 30.643 12.616 -29.966 1.00 0.00 ? 21 MET A CB  1 
ATOM 173 C CG  . MET A 1 23 ? 31.805 13.533 -29.519 1.00 0.00 ? 21 MET A CG  1 
ATOM 174 S SD  . MET A 1 23 ? 31.487 14.278 -27.995 1.00 0.00 ? 21 MET A SD  1 
ATOM 175 C CE  . MET A 1 23 ? 30.422 15.611 -28.629 1.00 0.00 ? 21 MET A CE  1 
ATOM 176 N N   . LYS A 1 24 ? 32.934 10.577 -29.432 1.00 0.00 ? 22 LYS A N   1 
ATOM 177 C CA  . LYS A 1 24 ? 33.558 9.903  -28.288 1.00 0.00 ? 22 LYS A CA  1 
ATOM 178 C C   . LYS A 1 24 ? 33.194 10.771 -27.132 1.00 0.00 ? 22 LYS A C   1 
ATOM 179 O O   . LYS A 1 24 ? 32.696 11.848 -27.287 1.00 0.00 ? 22 LYS A O   1 
ATOM 180 C CB  . LYS A 1 24 ? 35.104 9.762  -28.438 1.00 0.00 ? 22 LYS A CB  1 
ATOM 181 C CG  . LYS A 1 24 ? 35.545 8.391  -28.954 1.00 0.00 ? 22 LYS A CG  1 
ATOM 182 C CD  . LYS A 1 24 ? 37.055 7.950  -28.512 1.00 0.00 ? 22 LYS A CD  1 
ATOM 183 C CE  . LYS A 1 24 ? 37.198 6.415  -28.487 1.00 0.00 ? 22 LYS A CE  1 
ATOM 184 N NZ  . LYS A 1 24 ? 38.220 5.870  -27.482 1.00 0.00 ? 22 LYS A NZ  1 
ATOM 185 N N   . VAL A 1 25 ? 33.404 10.368 -25.869 1.00 0.00 ? 23 VAL A N   1 
ATOM 186 C CA  . VAL A 1 25 ? 33.046 11.113 -24.666 1.00 0.00 ? 23 VAL A CA  1 
ATOM 187 C C   . VAL A 1 25 ? 33.462 12.579 -24.546 1.00 0.00 ? 23 VAL A C   1 
ATOM 188 O O   . VAL A 1 25 ? 32.778 13.473 -23.950 1.00 0.00 ? 23 VAL A O   1 
ATOM 189 C CB  . VAL A 1 25 ? 33.630 10.286 -23.528 1.00 0.00 ? 23 VAL A CB  1 
ATOM 190 C CG1 . VAL A 1 25 ? 33.907 11.103 -22.317 1.00 0.00 ? 23 VAL A CG1 1 
ATOM 191 C CG2 . VAL A 1 25 ? 32.609 9.147  -23.316 1.00 0.00 ? 23 VAL A CG2 1 
ATOM 192 N N   . PHE A 1 26 ? 34.661 12.780 -25.018 1.00 0.00 ? 24 PHE A N   1 
ATOM 193 C CA  . PHE A 1 26 ? 35.257 14.102 -24.874 1.00 0.00 ? 24 PHE A CA  1 
ATOM 194 C C   . PHE A 1 26 ? 34.589 15.323 -25.313 1.00 0.00 ? 24 PHE A C   1 
ATOM 195 O O   . PHE A 1 26 ? 34.519 16.179 -24.413 1.00 0.00 ? 24 PHE A O   1 
ATOM 196 C CB  . PHE A 1 26 ? 36.738 14.007 -25.308 1.00 0.00 ? 24 PHE A CB  1 
ATOM 197 C CG  . PHE A 1 26 ? 37.546 13.740 -24.053 1.00 0.00 ? 24 PHE A CG  1 
ATOM 198 C CD1 . PHE A 1 26 ? 37.316 12.499 -23.453 1.00 0.00 ? 24 PHE A CD1 1 
ATOM 199 C CD2 . PHE A 1 26 ? 38.156 14.829 -23.316 1.00 0.00 ? 24 PHE A CD2 1 
ATOM 200 C CE1 . PHE A 1 26 ? 37.675 12.249 -22.158 1.00 0.00 ? 24 PHE A CE1 1 
ATOM 201 C CE2 . PHE A 1 26 ? 38.567 14.561 -22.007 1.00 0.00 ? 24 PHE A CE2 1 
ATOM 202 C CZ  . PHE A 1 26 ? 38.333 13.280 -21.452 1.00 0.00 ? 24 PHE A CZ  1 
ATOM 203 N N   . SER A 1 27 ? 34.145 15.586 -26.564 1.00 0.00 ? 25 SER A N   1 
ATOM 204 C CA  . SER A 1 27 ? 33.567 16.818 -26.926 1.00 0.00 ? 25 SER A CA  1 
ATOM 205 C C   . SER A 1 27 ? 32.448 17.202 -26.077 1.00 0.00 ? 25 SER A C   1 
ATOM 206 O O   . SER A 1 27 ? 32.385 18.388 -25.811 1.00 0.00 ? 25 SER A O   1 
ATOM 207 C CB  . SER A 1 27 ? 33.263 16.918 -28.434 1.00 0.00 ? 25 SER A CB  1 
ATOM 208 O OG  . SER A 1 27 ? 34.330 17.626 -29.084 1.00 0.00 ? 25 SER A OG  1 
ATOM 209 N N   . LEU A 1 28 ? 31.572 16.289 -25.609 1.00 0.00 ? 26 LEU A N   1 
ATOM 210 C CA  . LEU A 1 28 ? 30.406 16.579 -24.742 1.00 0.00 ? 26 LEU A CA  1 
ATOM 211 C C   . LEU A 1 28 ? 30.810 17.186 -23.501 1.00 0.00 ? 26 LEU A C   1 
ATOM 212 O O   . LEU A 1 28 ? 30.251 18.197 -23.094 1.00 0.00 ? 26 LEU A O   1 
ATOM 213 C CB  . LEU A 1 28 ? 29.607 15.354 -24.441 1.00 0.00 ? 26 LEU A CB  1 
ATOM 214 C CG  . LEU A 1 28 ? 28.370 15.659 -23.588 1.00 0.00 ? 26 LEU A CG  1 
ATOM 215 C CD1 . LEU A 1 28 ? 27.272 14.739 -24.052 1.00 0.00 ? 26 LEU A CD1 1 
ATOM 216 C CD2 . LEU A 1 28 ? 28.707 15.482 -22.042 1.00 0.00 ? 26 LEU A CD2 1 
ATOM 217 N N   . ILE A 1 29 ? 31.809 16.589 -22.843 1.00 0.00 ? 27 ILE A N   1 
ATOM 218 C CA  . ILE A 1 29 ? 32.269 17.079 -21.613 1.00 0.00 ? 27 ILE A CA  1 
ATOM 219 C C   . ILE A 1 29 ? 32.653 18.528 -21.864 1.00 0.00 ? 27 ILE A C   1 
ATOM 220 O O   . ILE A 1 29 ? 32.425 19.331 -21.064 1.00 0.00 ? 27 ILE A O   1 
ATOM 221 C CB  . ILE A 1 29 ? 33.493 16.365 -21.014 1.00 0.00 ? 27 ILE A CB  1 
ATOM 222 C CG1 . ILE A 1 29 ? 33.336 14.826 -20.990 1.00 0.00 ? 27 ILE A CG1 1 
ATOM 223 C CG2 . ILE A 1 29 ? 33.913 16.921 -19.584 1.00 0.00 ? 27 ILE A CG2 1 
ATOM 224 C CD1 . ILE A 1 29 ? 34.683 14.142 -20.888 1.00 0.00 ? 27 ILE A CD1 1 
ATOM 225 N N   . GLN A 1 30 ? 33.220 18.826 -23.042 1.00 0.00 ? 28 GLN A N   1 
ATOM 226 C CA  . GLN A 1 30 ? 33.561 20.222 -23.338 1.00 0.00 ? 28 GLN A CA  1 
ATOM 227 C C   . GLN A 1 30 ? 32.368 21.069 -23.424 1.00 0.00 ? 28 GLN A C   1 
ATOM 228 O O   . GLN A 1 30 ? 32.309 22.141 -22.872 1.00 0.00 ? 28 GLN A O   1 
ATOM 229 C CB  . GLN A 1 30 ? 34.371 20.389 -24.595 1.00 0.00 ? 28 GLN A CB  1 
ATOM 230 C CG  . GLN A 1 30 ? 35.432 19.321 -24.811 1.00 0.00 ? 28 GLN A CG  1 
ATOM 231 C CD  . GLN A 1 30 ? 35.915 19.278 -26.287 1.00 0.00 ? 28 GLN A CD  1 
ATOM 232 O OE1 . GLN A 1 30 ? 35.305 19.579 -27.295 1.00 0.00 ? 28 GLN A OE1 1 
ATOM 233 N NE2 . GLN A 1 30 ? 37.210 18.755 -26.497 1.00 0.00 ? 28 GLN A NE2 1 
ATOM 234 N N   . GLN A 1 31 ? 31.309 20.641 -24.153 1.00 0.00 ? 29 GLN A N   1 
ATOM 235 C CA  . GLN A 1 31 ? 30.112 21.365 -24.385 1.00 0.00 ? 29 GLN A CA  1 
ATOM 236 C C   . GLN A 1 31 ? 29.423 21.763 -23.126 1.00 0.00 ? 29 GLN A C   1 
ATOM 237 O O   . GLN A 1 31 ? 29.091 22.925 -22.873 1.00 0.00 ? 29 GLN A O   1 
ATOM 238 C CB  . GLN A 1 31 ? 29.089 20.531 -25.280 1.00 0.00 ? 29 GLN A CB  1 
ATOM 239 C CG  . GLN A 1 31 ? 29.475 20.299 -26.759 1.00 0.00 ? 29 GLN A CG  1 
ATOM 240 C CD  . GLN A 1 31 ? 28.976 21.596 -27.455 1.00 0.00 ? 29 GLN A CD  1 
ATOM 241 O OE1 . GLN A 1 31 ? 29.602 22.629 -27.459 1.00 0.00 ? 29 GLN A OE1 1 
ATOM 242 N NE2 . GLN A 1 31 ? 27.852 21.322 -28.172 1.00 0.00 ? 29 GLN A NE2 1 
ATOM 243 N N   . ALA A 1 32 ? 29.282 20.827 -22.247 1.00 0.00 ? 30 ALA A N   1 
ATOM 244 C CA  . ALA A 1 32 ? 28.691 21.014 -20.948 1.00 0.00 ? 30 ALA A CA  1 
ATOM 245 C C   . ALA A 1 32 ? 29.371 21.969 -20.185 1.00 0.00 ? 30 ALA A C   1 
ATOM 246 O O   . ALA A 1 32 ? 28.810 22.725 -19.441 1.00 0.00 ? 30 ALA A O   1 
ATOM 247 C CB  . ALA A 1 32 ? 28.646 19.645 -20.220 1.00 0.00 ? 30 ALA A CB  1 
ATOM 248 N N   . VAL A 1 33 ? 30.701 21.805 -20.215 1.00 0.00 ? 31 VAL A N   1 
ATOM 249 C CA  . VAL A 1 33 ? 31.692 22.521 -19.426 1.00 0.00 ? 31 VAL A CA  1 
ATOM 250 C C   . VAL A 1 33 ? 31.528 23.961 -19.775 1.00 0.00 ? 31 VAL A C   1 
ATOM 251 O O   . VAL A 1 33 ? 31.284 24.865 -18.932 1.00 0.00 ? 31 VAL A O   1 
ATOM 252 C CB  . VAL A 1 33 ? 33.069 21.994 -19.753 1.00 0.00 ? 31 VAL A CB  1 
ATOM 253 C CG1 . VAL A 1 33 ? 34.190 23.035 -19.747 1.00 0.00 ? 31 VAL A CG1 1 
ATOM 254 C CG2 . VAL A 1 33 ? 33.238 20.889 -18.789 1.00 0.00 ? 31 VAL A CG2 1 
ATOM 255 N N   . THR A 1 34 ? 31.469 24.167 -21.070 1.00 0.00 ? 32 THR A N   1 
ATOM 256 C CA  . THR A 1 34 ? 31.127 25.466 -21.718 1.00 0.00 ? 32 THR A CA  1 
ATOM 257 C C   . THR A 1 34 ? 29.831 25.933 -21.194 1.00 0.00 ? 32 THR A C   1 
ATOM 258 O O   . THR A 1 34 ? 29.684 27.098 -20.900 1.00 0.00 ? 32 THR A O   1 
ATOM 259 C CB  . THR A 1 34 ? 31.332 25.478 -23.195 1.00 0.00 ? 32 THR A CB  1 
ATOM 260 O OG1 . THR A 1 34 ? 30.548 24.645 -23.976 1.00 0.00 ? 32 THR A OG1 1 
ATOM 261 C CG2 . THR A 1 34 ? 32.905 25.279 -23.559 1.00 0.00 ? 32 THR A CG2 1 
ATOM 262 N N   . ARG A 1 35 ? 28.866 25.052 -20.963 1.00 0.00 ? 33 ARG A N   1 
ATOM 263 C CA  . ARG A 1 35 ? 27.578 25.422 -20.500 1.00 0.00 ? 33 ARG A CA  1 
ATOM 264 C C   . ARG A 1 35 ? 27.633 25.652 -19.134 1.00 0.00 ? 33 ARG A C   1 
ATOM 265 O O   . ARG A 1 35 ? 26.925 26.515 -18.700 1.00 0.00 ? 33 ARG A O   1 
ATOM 266 C CB  . ARG A 1 35 ? 26.559 24.342 -20.882 1.00 0.00 ? 33 ARG A CB  1 
ATOM 267 C CG  . ARG A 1 35 ? 26.381 24.289 -22.360 1.00 0.00 ? 33 ARG A CG  1 
ATOM 268 C CD  . ARG A 1 35 ? 26.087 22.886 -22.979 1.00 0.00 ? 33 ARG A CD  1 
ATOM 269 N NE  . ARG A 1 35 ? 25.661 23.172 -24.412 1.00 0.00 ? 33 ARG A NE  1 
ATOM 270 C CZ  . ARG A 1 35 ? 26.518 23.344 -25.470 1.00 0.00 ? 33 ARG A CZ  1 
ATOM 271 N NH1 . ARG A 1 35 ? 27.846 23.482 -25.332 1.00 0.00 ? 33 ARG A NH1 1 
ATOM 272 N NH2 . ARG A 1 35 ? 26.003 23.443 -26.754 1.00 0.00 ? 33 ARG A NH2 1 
ATOM 273 N N   . TYR A 1 36 ? 28.492 25.052 -18.324 1.00 0.00 ? 34 TYR A N   1 
ATOM 274 C CA  . TYR A 1 36 ? 28.512 25.299 -16.930 1.00 0.00 ? 34 TYR A CA  1 
ATOM 275 C C   . TYR A 1 36 ? 29.000 26.670 -16.688 1.00 0.00 ? 34 TYR A C   1 
ATOM 276 O O   . TYR A 1 36 ? 28.475 27.423 -15.877 1.00 0.00 ? 34 TYR A O   1 
ATOM 277 C CB  . TYR A 1 36 ? 29.594 24.380 -16.349 1.00 0.00 ? 34 TYR A CB  1 
ATOM 278 C CG  . TYR A 1 36 ? 29.476 24.213 -14.858 1.00 0.00 ? 34 TYR A CG  1 
ATOM 279 C CD1 . TYR A 1 36 ? 28.582 24.883 -14.025 1.00 0.00 ? 34 TYR A CD1 1 
ATOM 280 C CD2 . TYR A 1 36 ? 30.395 23.316 -14.349 1.00 0.00 ? 34 TYR A CD2 1 
ATOM 281 C CE1 . TYR A 1 36 ? 28.525 24.544 -12.680 1.00 0.00 ? 34 TYR A CE1 1 
ATOM 282 C CE2 . TYR A 1 36 ? 30.360 23.028 -12.974 1.00 0.00 ? 34 TYR A CE2 1 
ATOM 283 C CZ  . TYR A 1 36 ? 29.386 23.621 -12.129 1.00 0.00 ? 34 TYR A CZ  1 
ATOM 284 O OH  . TYR A 1 36 ? 29.142 23.080 -10.847 1.00 0.00 ? 34 TYR A OH  1 
ATOM 285 N N   . ARG A 1 37 ? 30.003 27.025 -17.465 1.00 0.00 ? 35 ARG A N   1 
ATOM 286 C CA  . ARG A 1 37 ? 30.620 28.275 -17.535 1.00 0.00 ? 35 ARG A CA  1 
ATOM 287 C C   . ARG A 1 37 ? 29.757 29.324 -18.130 1.00 0.00 ? 35 ARG A C   1 
ATOM 288 O O   . ARG A 1 37 ? 29.985 30.513 -17.960 1.00 0.00 ? 35 ARG A O   1 
ATOM 289 C CB  . ARG A 1 37 ? 32.106 28.194 -18.071 1.00 0.00 ? 35 ARG A CB  1 
ATOM 290 C CG  . ARG A 1 37 ? 33.170 27.516 -17.139 1.00 0.00 ? 35 ARG A CG  1 
ATOM 291 C CD  . ARG A 1 37 ? 34.575 27.597 -17.779 1.00 0.00 ? 35 ARG A CD  1 
ATOM 292 N NE  . ARG A 1 37 ? 34.542 26.714 -19.003 1.00 0.00 ? 35 ARG A NE  1 
ATOM 293 C CZ  . ARG A 1 37 ? 35.476 26.854 -20.027 1.00 0.00 ? 35 ARG A CZ  1 
ATOM 294 N NH1 . ARG A 1 37 ? 36.550 27.701 -19.906 1.00 0.00 ? 35 ARG A NH1 1 
ATOM 295 N NH2 . ARG A 1 37 ? 35.322 26.078 -21.083 1.00 0.00 ? 35 ARG A NH2 1 
ATOM 296 N N   . LYS A 1 38 ? 28.699 28.954 -18.879 1.00 0.00 ? 36 LYS A N   1 
ATOM 297 C CA  . LYS A 1 38 ? 27.775 29.841 -19.464 1.00 0.00 ? 36 LYS A CA  1 
ATOM 298 C C   . LYS A 1 38 ? 26.629 30.072 -18.514 1.00 0.00 ? 36 LYS A C   1 
ATOM 299 O O   . LYS A 1 38 ? 25.865 30.973 -18.760 1.00 0.00 ? 36 LYS A O   1 
ATOM 300 C CB  . LYS A 1 38 ? 27.189 29.126 -20.703 1.00 0.00 ? 36 LYS A CB  1 
ATOM 301 C CG  . LYS A 1 38 ? 26.407 30.029 -21.774 1.00 0.00 ? 36 LYS A CG  1 
ATOM 302 C CD  . LYS A 1 38 ? 25.543 29.139 -22.672 1.00 0.00 ? 36 LYS A CD  1 
ATOM 303 C CE  . LYS A 1 38 ? 24.876 29.750 -23.920 1.00 0.00 ? 36 LYS A CE  1 
ATOM 304 N NZ  . LYS A 1 38 ? 24.143 28.723 -24.610 1.00 0.00 ? 36 LYS A NZ  1 
ATOM 305 N N   . ALA A 1 39 ? 26.562 29.254 -17.494 1.00 0.00 ? 37 ALA A N   1 
ATOM 306 C CA  . ALA A 1 39 ? 25.585 29.346 -16.478 1.00 0.00 ? 37 ALA A CA  1 
ATOM 307 C C   . ALA A 1 39 ? 25.898 30.284 -15.328 1.00 0.00 ? 37 ALA A C   1 
ATOM 308 O O   . ALA A 1 39 ? 24.954 30.816 -14.719 1.00 0.00 ? 37 ALA A O   1 
ATOM 309 C CB  . ALA A 1 39 ? 25.264 28.024 -15.889 1.00 0.00 ? 37 ALA A CB  1 
ATOM 310 N N   . VAL A 1 40 ? 27.168 30.340 -14.901 1.00 0.00 ? 38 VAL A N   1 
ATOM 311 C CA  . VAL A 1 40 ? 27.461 31.096 -13.714 1.00 0.00 ? 38 VAL A CA  1 
ATOM 312 C C   . VAL A 1 40 ? 28.879 31.737 -13.747 1.00 0.00 ? 38 VAL A C   1 
ATOM 313 O O   . VAL A 1 40 ? 29.134 32.416 -12.751 1.00 0.00 ? 38 VAL A O   1 
ATOM 314 C CB  . VAL A 1 40 ? 27.234 30.112 -12.587 1.00 0.00 ? 38 VAL A CB  1 
ATOM 315 C CG1 . VAL A 1 40 ? 28.256 29.000 -12.688 1.00 0.00 ? 38 VAL A CG1 1 
ATOM 316 C CG2 . VAL A 1 40 ? 27.195 30.897 -11.270 1.00 0.00 ? 38 VAL A CG2 1 
ATOM 317 N N   . ALA A 1 41 ? 29.763 31.532 -14.773 1.00 0.00 ? 39 ALA A N   1 
ATOM 318 C CA  . ALA A 1 41 ? 31.108 32.042 -14.770 1.00 0.00 ? 39 ALA A CA  1 
ATOM 319 C C   . ALA A 1 41 ? 31.144 33.558 -14.549 1.00 0.00 ? 39 ALA A C   1 
ATOM 320 O O   . ALA A 1 41 ? 30.558 34.273 -15.363 1.00 0.00 ? 39 ALA A O   1 
ATOM 321 C CB  . ALA A 1 41 ? 31.877 31.784 -16.110 1.00 0.00 ? 39 ALA A CB  1 
ATOM 322 N N   . LYS A 1 42 ? 31.992 34.014 -13.608 1.00 0.00 ? 40 LYS A N   1 
ATOM 323 C CA  . LYS A 1 42 ? 32.363 35.349 -13.348 1.00 0.00 ? 40 LYS A CA  1 
ATOM 324 C C   . LYS A 1 42 ? 33.532 35.437 -14.266 1.00 0.00 ? 40 LYS A C   1 
ATOM 325 O O   . LYS A 1 42 ? 33.380 35.434 -15.448 1.00 0.00 ? 40 LYS A O   1 
ATOM 326 C CB  . LYS A 1 42 ? 32.681 35.658 -11.837 1.00 0.00 ? 40 LYS A CB  1 
ATOM 327 C CG  . LYS A 1 42 ? 33.490 34.532 -11.096 1.00 0.00 ? 40 LYS A CG  1 
ATOM 328 C CD  . LYS A 1 42 ? 33.322 34.599 -9.593  1.00 0.00 ? 40 LYS A CD  1 
ATOM 329 C CE  . LYS A 1 42 ? 34.341 33.796 -8.751  1.00 0.00 ? 40 LYS A CE  1 
ATOM 330 N NZ  . LYS A 1 42 ? 35.671 34.361 -8.856  1.00 0.00 ? 40 LYS A NZ  1 
ATOM 331 N N   . ASP A 1 43 ? 34.785 35.571 -13.746 1.00 0.00 ? 41 ASP A N   1 
ATOM 332 C CA  . ASP A 1 43 ? 35.984 35.669 -14.542 1.00 0.00 ? 41 ASP A CA  1 
ATOM 333 C C   . ASP A 1 43 ? 36.391 34.271 -14.915 1.00 0.00 ? 41 ASP A C   1 
ATOM 334 O O   . ASP A 1 43 ? 36.256 33.412 -14.056 1.00 0.00 ? 41 ASP A O   1 
ATOM 335 C CB  . ASP A 1 43 ? 37.114 36.333 -13.807 1.00 0.00 ? 41 ASP A CB  1 
ATOM 336 C CG  . ASP A 1 43 ? 37.464 35.710 -12.453 1.00 0.00 ? 41 ASP A CG  1 
ATOM 337 O OD1 . ASP A 1 43 ? 36.724 35.855 -11.454 1.00 0.00 ? 41 ASP A OD1 1 
ATOM 338 O OD2 . ASP A 1 43 ? 38.576 35.127 -12.353 1.00 0.00 ? 41 ASP A OD2 1 
ATOM 339 N N   . PRO A 1 44 ? 37.008 33.925 -16.046 1.00 0.00 ? 42 PRO A N   1 
ATOM 340 C CA  . PRO A 1 44 ? 37.334 32.552 -16.278 1.00 0.00 ? 42 PRO A CA  1 
ATOM 341 C C   . PRO A 1 44 ? 38.659 32.336 -15.700 1.00 0.00 ? 42 PRO A C   1 
ATOM 342 O O   . PRO A 1 44 ? 39.666 32.929 -16.146 1.00 0.00 ? 42 PRO A O   1 
ATOM 343 C CB  . PRO A 1 44 ? 37.439 32.426 -17.794 1.00 0.00 ? 42 PRO A CB  1 
ATOM 344 C CG  . PRO A 1 44 ? 36.452 33.563 -18.245 1.00 0.00 ? 42 PRO A CG  1 
ATOM 345 C CD  . PRO A 1 44 ? 36.911 34.673 -17.271 1.00 0.00 ? 42 PRO A CD  1 
ATOM 346 N N   . ASN A 1 45 ? 38.646 31.539 -14.641 1.00 0.00 ? 43 ASN A N   1 
ATOM 347 C CA  . ASN A 1 45 ? 39.790 31.216 -13.844 1.00 0.00 ? 43 ASN A CA  1 
ATOM 348 C C   . ASN A 1 45 ? 39.125 30.336 -12.849 1.00 0.00 ? 43 ASN A C   1 
ATOM 349 O O   . ASN A 1 45 ? 38.169 30.719 -12.215 1.00 0.00 ? 43 ASN A O   1 
ATOM 350 C CB  . ASN A 1 45 ? 40.685 32.334 -13.312 1.00 0.00 ? 43 ASN A CB  1 
ATOM 351 C CG  . ASN A 1 45 ? 41.936 31.558 -12.785 1.00 0.00 ? 43 ASN A CG  1 
ATOM 352 O OD1 . ASN A 1 45 ? 41.860 30.870 -11.784 1.00 0.00 ? 43 ASN A OD1 1 
ATOM 353 N ND2 . ASN A 1 45 ? 43.066 31.753 -13.449 1.00 0.00 ? 43 ASN A ND2 1 
ATOM 354 N N   . TYR A 1 46 ? 39.626 29.055 -12.922 1.00 0.00 ? 44 TYR A N   1 
ATOM 355 C CA  . TYR A 1 46 ? 38.977 28.006 -12.255 1.00 0.00 ? 44 TYR A CA  1 
ATOM 356 C C   . TYR A 1 46 ? 39.827 26.909 -12.759 1.00 0.00 ? 44 TYR A C   1 
ATOM 357 O O   . TYR A 1 46 ? 40.945 27.065 -13.291 1.00 0.00 ? 44 TYR A O   1 
ATOM 358 C CB  . TYR A 1 46 ? 37.546 27.691 -12.713 1.00 0.00 ? 44 TYR A CB  1 
ATOM 359 C CG  . TYR A 1 46 ? 36.415 28.583 -12.317 1.00 0.00 ? 44 TYR A CG  1 
ATOM 360 C CD1 . TYR A 1 46 ? 36.281 29.036 -10.989 1.00 0.00 ? 44 TYR A CD1 1 
ATOM 361 C CD2 . TYR A 1 46 ? 35.407 28.811 -13.263 1.00 0.00 ? 44 TYR A CD2 1 
ATOM 362 C CE1 . TYR A 1 46 ? 35.082 29.475 -10.503 1.00 0.00 ? 44 TYR A CE1 1 
ATOM 363 C CE2 . TYR A 1 46 ? 34.156 29.169 -12.750 1.00 0.00 ? 44 TYR A CE2 1 
ATOM 364 C CZ  . TYR A 1 46 ? 33.988 29.519 -11.411 1.00 0.00 ? 44 TYR A CZ  1 
ATOM 365 O OH  . TYR A 1 46 ? 32.818 29.865 -10.792 1.00 0.00 ? 44 TYR A OH  1 
ATOM 366 N N   . TRP A 1 47 ? 39.358 25.616 -12.611 1.00 0.00 ? 45 TRP A N   1 
ATOM 367 C CA  . TRP A 1 47 ? 39.841 24.312 -13.026 1.00 0.00 ? 45 TRP A CA  1 
ATOM 368 C C   . TRP A 1 47 ? 38.725 23.635 -13.774 1.00 0.00 ? 45 TRP A C   1 
ATOM 369 O O   . TRP A 1 47 ? 37.575 24.039 -13.664 1.00 0.00 ? 45 TRP A O   1 
ATOM 370 C CB  . TRP A 1 47 ? 40.231 23.381 -11.926 1.00 0.00 ? 45 TRP A CB  1 
ATOM 371 C CG  . TRP A 1 47 ? 40.695 24.053 -10.691 1.00 0.00 ? 45 TRP A CG  1 
ATOM 372 C CD1 . TRP A 1 47 ? 41.557 25.116 -10.586 1.00 0.00 ? 45 TRP A CD1 1 
ATOM 373 C CD2 . TRP A 1 47 ? 40.402 23.651 -9.363  1.00 0.00 ? 45 TRP A CD2 1 
ATOM 374 N NE1 . TRP A 1 47 ? 41.846 25.369 -9.310  1.00 0.00 ? 45 TRP A NE1 1 
ATOM 375 C CE2 . TRP A 1 47 ? 41.200 24.413 -8.465  1.00 0.00 ? 45 TRP A CE2 1 
ATOM 376 C CE3 . TRP A 1 47 ? 39.599 22.639 -8.859  1.00 0.00 ? 45 TRP A CE3 1 
ATOM 377 C CZ2 . TRP A 1 47 ? 41.081 24.260 -7.081  1.00 0.00 ? 45 TRP A CZ2 1 
ATOM 378 C CZ3 . TRP A 1 47 ? 39.487 22.489 -7.449  1.00 0.00 ? 45 TRP A CZ3 1 
ATOM 379 C CH2 . TRP A 1 47 ? 40.175 23.301 -6.569  1.00 0.00 ? 45 TRP A CH2 1 
ATOM 380 N N   . ILE A 1 48 ? 38.934 22.575 -14.545 1.00 0.00 ? 46 ILE A N   1 
ATOM 381 C CA  . ILE A 1 48 ? 37.829 21.842 -15.145 1.00 0.00 ? 46 ILE A CA  1 
ATOM 382 C C   . ILE A 1 48 ? 38.076 20.440 -15.236 1.00 0.00 ? 46 ILE A C   1 
ATOM 383 O O   . ILE A 1 48 ? 37.960 19.847 -16.315 1.00 0.00 ? 46 ILE A O   1 
ATOM 384 C CB  . ILE A 1 48 ? 37.387 22.380 -16.562 1.00 0.00 ? 46 ILE A CB  1 
ATOM 385 C CG1 . ILE A 1 48 ? 37.296 23.917 -16.616 1.00 0.00 ? 46 ILE A CG1 1 
ATOM 386 C CG2 . ILE A 1 48 ? 36.058 21.747 -16.942 1.00 0.00 ? 46 ILE A CG2 1 
ATOM 387 C CD1 . ILE A 1 48 ? 37.042 24.461 -17.999 1.00 0.00 ? 46 ILE A CD1 1 
ATOM 388 N N   . GLN A 1 49 ? 38.508 19.786 -14.165 1.00 0.00 ? 47 GLN A N   1 
ATOM 389 C CA  . GLN A 1 49 ? 38.830 18.359 -14.345 1.00 0.00 ? 47 GLN A CA  1 
ATOM 390 C C   . GLN A 1 49 ? 37.673 17.607 -13.711 1.00 0.00 ? 47 GLN A C   1 
ATOM 391 O O   . GLN A 1 49 ? 37.655 17.218 -12.576 1.00 0.00 ? 47 GLN A O   1 
ATOM 392 C CB  . GLN A 1 49 ? 40.180 17.885 -13.667 1.00 0.00 ? 47 GLN A CB  1 
ATOM 393 C CG  . GLN A 1 49 ? 40.426 18.257 -12.178 1.00 0.00 ? 47 GLN A CG  1 
ATOM 394 C CD  . GLN A 1 49 ? 40.589 19.769 -12.018 1.00 0.00 ? 47 GLN A CD  1 
ATOM 395 O OE1 . GLN A 1 49 ? 41.041 20.456 -12.960 1.00 0.00 ? 47 GLN A OE1 1 
ATOM 396 N NE2 . GLN A 1 49 ? 40.137 20.279 -10.841 1.00 0.00 ? 47 GLN A NE2 1 
ATOM 397 N N   . VAL A 1 50 ? 36.799 17.306 -14.593 1.00 0.00 ? 48 VAL A N   1 
ATOM 398 C CA  . VAL A 1 50 ? 35.737 16.467 -14.310 1.00 0.00 ? 48 VAL A CA  1 
ATOM 399 C C   . VAL A 1 50 ? 36.216 15.019 -14.384 1.00 0.00 ? 48 VAL A C   1 
ATOM 400 O O   . VAL A 1 50 ? 36.795 14.547 -15.373 1.00 0.00 ? 48 VAL A O   1 
ATOM 401 C CB  . VAL A 1 50 ? 34.544 16.747 -15.235 1.00 0.00 ? 48 VAL A CB  1 
ATOM 402 C CG1 . VAL A 1 50 ? 33.256 16.318 -14.555 1.00 0.00 ? 48 VAL A CG1 1 
ATOM 403 C CG2 . VAL A 1 50 ? 34.433 18.199 -15.536 1.00 0.00 ? 48 VAL A CG2 1 
ATOM 404 N N   . HIS A 1 51 ? 36.022 14.201 -13.360 1.00 0.00 ? 49 HIS A N   1 
ATOM 405 C CA  . HIS A 1 51 ? 36.440 12.835 -13.380 1.00 0.00 ? 49 HIS A CA  1 
ATOM 406 C C   . HIS A 1 51 ? 35.526 11.889 -14.079 1.00 0.00 ? 49 HIS A C   1 
ATOM 407 O O   . HIS A 1 51 ? 36.087 11.251 -15.027 1.00 0.00 ? 49 HIS A O   1 
ATOM 408 C CB  . HIS A 1 51 ? 37.021 12.451 -12.060 1.00 0.00 ? 49 HIS A CB  1 
ATOM 409 C CG  . HIS A 1 51 ? 38.259 13.245 -11.944 1.00 0.00 ? 49 HIS A CG  1 
ATOM 410 N ND1 . HIS A 1 51 ? 39.229 13.372 -12.946 1.00 0.00 ? 49 HIS A ND1 1 
ATOM 411 C CD2 . HIS A 1 51 ? 38.569 14.188 -11.038 1.00 0.00 ? 49 HIS A CD2 1 
ATOM 412 C CE1 . HIS A 1 51 ? 40.033 14.441 -12.507 1.00 0.00 ? 49 HIS A CE1 1 
ATOM 413 N NE2 . HIS A 1 51 ? 39.584 14.995 -11.421 1.00 0.00 ? 49 HIS A NE2 1 
ATOM 414 N N   . ARG A 1 52 ? 34.194 11.678 -13.794 1.00 0.00 ? 50 ARG A N   1 
ATOM 415 C CA  . ARG A 1 52 ? 33.407 10.735 -14.641 1.00 0.00 ? 50 ARG A CA  1 
ATOM 416 C C   . ARG A 1 52 ? 31.902 10.882 -14.377 1.00 0.00 ? 50 ARG A C   1 
ATOM 417 O O   . ARG A 1 52 ? 31.492 11.628 -13.484 1.00 0.00 ? 50 ARG A O   1 
ATOM 418 C CB  . ARG A 1 52 ? 33.722 9.189  -14.495 1.00 0.00 ? 50 ARG A CB  1 
ATOM 419 C CG  . ARG A 1 52 ? 33.884 8.730  -13.012 1.00 0.00 ? 50 ARG A CG  1 
ATOM 420 C CD  . ARG A 1 52 ? 35.379 8.648  -12.556 1.00 0.00 ? 50 ARG A CD  1 
ATOM 421 N NE  . ARG A 1 52 ? 35.468 8.134  -11.201 1.00 0.00 ? 50 ARG A NE  1 
ATOM 422 C CZ  . ARG A 1 52 ? 35.090 8.890  -10.129 1.00 0.00 ? 50 ARG A CZ  1 
ATOM 423 N NH1 . ARG A 1 52 ? 34.923 10.264 -10.283 1.00 0.00 ? 50 ARG A NH1 1 
ATOM 424 N NH2 . ARG A 1 52 ? 34.869 8.370  -8.871  1.00 0.00 ? 50 ARG A NH2 1 
ATOM 425 N N   . LEU A 1 53 ? 31.124 10.357 -15.318 1.00 0.00 ? 51 LEU A N   1 
ATOM 426 C CA  . LEU A 1 53 ? 29.736 10.488 -15.409 1.00 0.00 ? 51 LEU A CA  1 
ATOM 427 C C   . LEU A 1 53 ? 29.210 9.269  -14.756 1.00 0.00 ? 51 LEU A C   1 
ATOM 428 O O   . LEU A 1 53 ? 29.806 8.205  -14.889 1.00 0.00 ? 51 LEU A O   1 
ATOM 429 C CB  . LEU A 1 53 ? 29.213 10.406 -16.850 1.00 0.00 ? 51 LEU A CB  1 
ATOM 430 C CG  . LEU A 1 53 ? 29.352 11.662 -17.781 1.00 0.00 ? 51 LEU A CG  1 
ATOM 431 C CD1 . LEU A 1 53 ? 30.828 12.072 -18.049 1.00 0.00 ? 51 LEU A CD1 1 
ATOM 432 C CD2 . LEU A 1 53 ? 28.693 11.417 -19.112 1.00 0.00 ? 51 LEU A CD2 1 
ATOM 433 N N   . GLU A 1 54 ? 28.083 9.397  -14.068 1.00 0.00 ? 52 GLU A N   1 
ATOM 434 C CA  . GLU A 1 54 ? 27.418 8.269  -13.420 1.00 0.00 ? 52 GLU A CA  1 
ATOM 435 C C   . GLU A 1 54 ? 25.963 8.392  -13.653 1.00 0.00 ? 52 GLU A C   1 
ATOM 436 O O   . GLU A 1 54 ? 25.425 9.518  -13.700 1.00 0.00 ? 52 GLU A O   1 
ATOM 437 C CB  . GLU A 1 54 ? 27.635 8.213  -11.923 1.00 0.00 ? 52 GLU A CB  1 
ATOM 438 C CG  . GLU A 1 54 ? 29.088 8.432  -11.509 1.00 0.00 ? 52 GLU A CG  1 
ATOM 439 C CD  . GLU A 1 54 ? 29.996 7.156  -11.814 1.00 0.00 ? 52 GLU A CD  1 
ATOM 440 O OE1 . GLU A 1 54 ? 29.809 6.087  -11.215 1.00 0.00 ? 52 GLU A OE1 1 
ATOM 441 O OE2 . GLU A 1 54 ? 30.942 7.376  -12.595 1.00 0.00 ? 52 GLU A OE2 1 
ATOM 442 N N   . HIS A 1 55 ? 25.285 7.142  -13.547 1.00 0.00 ? 53 HIS A N   1 
ATOM 443 C CA  . HIS A 1 55 ? 23.891 6.834  -13.303 1.00 0.00 ? 53 HIS A CA  1 
ATOM 444 C C   . HIS A 1 55 ? 23.707 6.943  -11.867 1.00 0.00 ? 53 HIS A C   1 
ATOM 445 O O   . HIS A 1 55 ? 24.663 7.144  -11.076 1.00 0.00 ? 53 HIS A O   1 
ATOM 446 C CB  . HIS A 1 55 ? 23.359 5.422  -13.817 1.00 0.00 ? 53 HIS A CB  1 
ATOM 447 C CG  . HIS A 1 55 ? 24.151 4.897  -14.865 1.00 0.00 ? 53 HIS A CG  1 
ATOM 448 N ND1 . HIS A 1 55 ? 25.454 4.432  -14.751 1.00 0.00 ? 53 HIS A ND1 1 
ATOM 449 C CD2 . HIS A 1 55 ? 23.789 4.882  -16.126 1.00 0.00 ? 53 HIS A CD2 1 
ATOM 450 C CE1 . HIS A 1 55 ? 25.754 4.025  -16.016 1.00 0.00 ? 53 HIS A CE1 1 
ATOM 451 N NE2 . HIS A 1 55 ? 24.801 4.227  -16.890 1.00 0.00 ? 53 HIS A NE2 1 
ATOM 452 N N   . GLY A 1 56 ? 22.456 7.003  -11.354 1.00 0.00 ? 54 GLY A N   1 
ATOM 453 C CA  . GLY A 1 56 ? 22.133 7.258  -9.937  1.00 0.00 ? 54 GLY A CA  1 
ATOM 454 C C   . GLY A 1 56 ? 22.873 6.466  -8.879  1.00 0.00 ? 54 GLY A C   1 
ATOM 455 O O   . GLY A 1 56 ? 23.524 7.064  -8.030  1.00 0.00 ? 54 GLY A O   1 
ATOM 456 N N   . ASP A 1 57 ? 22.791 5.118  -9.026  1.00 0.00 ? 55 ASP A N   1 
ATOM 457 C CA  . ASP A 1 57 ? 23.589 4.263  -8.248  1.00 0.00 ? 55 ASP A CA  1 
ATOM 458 C C   . ASP A 1 57 ? 24.369 3.551  -9.257  1.00 0.00 ? 55 ASP A C   1 
ATOM 459 O O   . ASP A 1 57 ? 25.264 2.750  -8.901  1.00 0.00 ? 55 ASP A O   1 
ATOM 460 C CB  . ASP A 1 57 ? 22.958 3.174  -7.364  1.00 0.00 ? 55 ASP A CB  1 
ATOM 461 C CG  . ASP A 1 57 ? 22.406 3.919  -6.085  1.00 0.00 ? 55 ASP A CG  1 
ATOM 462 O OD1 . ASP A 1 57 ? 22.713 5.079  -5.751  1.00 0.00 ? 55 ASP A OD1 1 
ATOM 463 O OD2 . ASP A 1 57 ? 21.791 3.156  -5.268  1.00 0.00 ? 55 ASP A OD2 1 
ATOM 464 N N   . GLY A 1 58 ? 24.118 3.806  -10.596 1.00 0.00 ? 56 GLY A N   1 
ATOM 465 C CA  . GLY A 1 58 ? 24.784 3.022  -11.574 1.00 0.00 ? 56 GLY A CA  1 
ATOM 466 C C   . GLY A 1 58 ? 26.203 3.539  -11.712 1.00 0.00 ? 56 GLY A C   1 
ATOM 467 O O   . GLY A 1 58 ? 26.399 4.733  -11.541 1.00 0.00 ? 56 GLY A O   1 
ATOM 468 N N   . GLY A 1 59 ? 27.133 2.632  -11.860 1.00 0.00 ? 57 GLY A N   1 
ATOM 469 C CA  . GLY A 1 59 ? 28.557 2.757  -11.929 1.00 0.00 ? 57 GLY A CA  1 
ATOM 470 C C   . GLY A 1 59 ? 29.046 3.625  -12.985 1.00 0.00 ? 57 GLY A C   1 
ATOM 471 O O   . GLY A 1 59 ? 28.348 4.383  -13.593 1.00 0.00 ? 57 GLY A O   1 
ATOM 472 N N   . ILE A 1 60 ? 30.384 3.588  -13.005 1.00 0.00 ? 58 ILE A N   1 
ATOM 473 C CA  . ILE A 1 60 ? 31.142 4.490  -13.840 1.00 0.00 ? 58 ILE A CA  1 
ATOM 474 C C   . ILE A 1 60 ? 30.998 4.075  -15.258 1.00 0.00 ? 58 ILE A C   1 
ATOM 475 O O   . ILE A 1 60 ? 31.350 2.960  -15.644 1.00 0.00 ? 58 ILE A O   1 
ATOM 476 C CB  . ILE A 1 60 ? 32.696 4.432  -13.534 1.00 0.00 ? 58 ILE A CB  1 
ATOM 477 C CG1 . ILE A 1 60 ? 32.987 4.821  -12.061 1.00 0.00 ? 58 ILE A CG1 1 
ATOM 478 C CG2 . ILE A 1 60 ? 33.497 5.246  -14.512 1.00 0.00 ? 58 ILE A CG2 1 
ATOM 479 C CD1 . ILE A 1 60 ? 32.365 4.082  -10.941 1.00 0.00 ? 58 ILE A CD1 1 
ATOM 480 N N   . LEU A 1 61 ? 30.594 5.043  -16.162 1.00 0.00 ? 59 LEU A N   1 
ATOM 481 C CA  . LEU A 1 61 ? 30.605 4.818  -17.555 1.00 0.00 ? 59 LEU A CA  1 
ATOM 482 C C   . LEU A 1 61 ? 31.865 5.097  -17.999 1.00 0.00 ? 59 LEU A C   1 
ATOM 483 O O   . LEU A 1 61 ? 32.327 6.177  -17.740 1.00 0.00 ? 59 LEU A O   1 
ATOM 484 C CB  . LEU A 1 61 ? 29.549 5.619  -18.312 1.00 0.00 ? 59 LEU A CB  1 
ATOM 485 C CG  . LEU A 1 61 ? 28.879 4.742  -19.334 1.00 0.00 ? 59 LEU A CG  1 
ATOM 486 C CD1 . LEU A 1 61 ? 27.332 4.715  -19.340 1.00 0.00 ? 59 LEU A CD1 1 
ATOM 487 C CD2 . LEU A 1 61 ? 29.314 5.160  -20.716 1.00 0.00 ? 59 LEU A CD2 1 
ATOM 488 N N   . ASP A 1 62 ? 32.461 4.203  -18.763 1.00 0.00 ? 60 ASP A N   1 
ATOM 489 C CA  . ASP A 1 62 ? 33.744 4.396  -19.409 1.00 0.00 ? 60 ASP A CA  1 
ATOM 490 C C   . ASP A 1 62 ? 33.581 5.713  -20.228 1.00 0.00 ? 60 ASP A C   1 
ATOM 491 O O   . ASP A 1 62 ? 32.476 6.118  -20.554 1.00 0.00 ? 60 ASP A O   1 
ATOM 492 C CB  . ASP A 1 62 ? 34.265 3.146  -20.255 1.00 0.00 ? 60 ASP A CB  1 
ATOM 493 C CG  . ASP A 1 62 ? 35.671 3.324  -20.718 1.00 0.00 ? 60 ASP A CG  1 
ATOM 494 O OD1 . ASP A 1 62 ? 36.452 4.070  -20.048 1.00 0.00 ? 60 ASP A OD1 1 
ATOM 495 O OD2 . ASP A 1 62 ? 36.000 2.705  -21.762 1.00 0.00 ? 60 ASP A OD2 1 
ATOM 496 N N   . LEU A 1 63 ? 34.697 6.406  -20.156 1.00 0.00 ? 61 LEU A N   1 
ATOM 497 C CA  . LEU A 1 63 ? 34.798 7.775  -20.330 1.00 0.00 ? 61 LEU A CA  1 
ATOM 498 C C   . LEU A 1 63 ? 35.478 8.113  -21.647 1.00 0.00 ? 61 LEU A C   1 
ATOM 499 O O   . LEU A 1 63 ? 36.214 9.097  -21.780 1.00 0.00 ? 61 LEU A O   1 
ATOM 500 C CB  . LEU A 1 63 ? 35.569 8.469  -19.163 1.00 0.00 ? 61 LEU A CB  1 
ATOM 501 C CG  . LEU A 1 63 ? 36.413 7.568  -18.265 1.00 0.00 ? 61 LEU A CG  1 
ATOM 502 C CD1 . LEU A 1 63 ? 37.715 7.067  -18.972 1.00 0.00 ? 61 LEU A CD1 1 
ATOM 503 C CD2 . LEU A 1 63 ? 36.781 8.337  -16.986 1.00 0.00 ? 61 LEU A CD2 1 
ATOM 504 N N   . ASP A 1 64 ? 35.255 7.325  -22.667 1.00 0.00 ? 62 ASP A N   1 
ATOM 505 C CA  . ASP A 1 64 ? 35.876 7.574  -23.952 1.00 0.00 ? 62 ASP A CA  1 
ATOM 506 C C   . ASP A 1 64 ? 34.967 7.166  -24.966 1.00 0.00 ? 62 ASP A C   1 
ATOM 507 O O   . ASP A 1 64 ? 35.000 7.829  -26.025 1.00 0.00 ? 62 ASP A O   1 
ATOM 508 C CB  . ASP A 1 64 ? 37.220 6.800  -24.179 1.00 0.00 ? 62 ASP A CB  1 
ATOM 509 C CG  . ASP A 1 64 ? 37.142 5.515  -23.505 1.00 0.00 ? 62 ASP A CG  1 
ATOM 510 O OD1 . ASP A 1 64 ? 37.455 5.491  -22.314 1.00 0.00 ? 62 ASP A OD1 1 
ATOM 511 O OD2 . ASP A 1 64 ? 36.648 4.526  -24.153 1.00 0.00 ? 62 ASP A OD2 1 
ATOM 512 N N   . ASP A 1 65 ? 34.219 6.121  -24.842 1.00 0.00 ? 63 ASP A N   1 
ATOM 513 C CA  . ASP A 1 65 ? 33.392 5.524  -25.891 1.00 0.00 ? 63 ASP A CA  1 
ATOM 514 C C   . ASP A 1 65 ? 32.441 6.393  -26.556 1.00 0.00 ? 63 ASP A C   1 
ATOM 515 O O   . ASP A 1 65 ? 32.199 7.502  -26.100 1.00 0.00 ? 63 ASP A O   1 
ATOM 516 C CB  . ASP A 1 65 ? 32.669 4.182  -25.393 1.00 0.00 ? 63 ASP A CB  1 
ATOM 517 C CG  . ASP A 1 65 ? 33.532 2.998  -25.589 1.00 0.00 ? 63 ASP A CG  1 
ATOM 518 O OD1 . ASP A 1 65 ? 34.508 2.848  -24.796 1.00 0.00 ? 63 ASP A OD1 1 
ATOM 519 O OD2 . ASP A 1 65 ? 33.315 2.236  -26.553 1.00 0.00 ? 63 ASP A OD2 1 
ATOM 520 N N   . ILE A 1 66 ? 31.885 5.907  -27.711 1.00 0.00 ? 64 ILE A N   1 
ATOM 521 C CA  . ILE A 1 66 ? 30.868 6.530  -28.464 1.00 0.00 ? 64 ILE A CA  1 
ATOM 522 C C   . ILE A 1 66 ? 29.773 6.465  -27.532 1.00 0.00 ? 64 ILE A C   1 
ATOM 523 O O   . ILE A 1 66 ? 29.323 5.347  -27.247 1.00 0.00 ? 64 ILE A O   1 
ATOM 524 C CB  . ILE A 1 66 ? 30.379 5.867  -29.787 1.00 0.00 ? 64 ILE A CB  1 
ATOM 525 C CG1 . ILE A 1 66 ? 31.399 6.114  -30.932 1.00 0.00 ? 64 ILE A CG1 1 
ATOM 526 C CG2 . ILE A 1 66 ? 28.989 6.383  -30.221 1.00 0.00 ? 64 ILE A CG2 1 
ATOM 527 C CD1 . ILE A 1 66 ? 31.920 7.637  -31.145 1.00 0.00 ? 64 ILE A CD1 1 
ATOM 528 N N   . LEU A 1 67 ? 29.344 7.627  -27.006 1.00 0.00 ? 65 LEU A N   1 
ATOM 529 C CA  . LEU A 1 67 ? 28.434 7.702  -25.922 1.00 0.00 ? 65 LEU A CA  1 
ATOM 530 C C   . LEU A 1 67 ? 27.162 7.023  -26.349 1.00 0.00 ? 65 LEU A C   1 
ATOM 531 O O   . LEU A 1 67 ? 26.583 6.278  -25.577 1.00 0.00 ? 65 LEU A O   1 
ATOM 532 C CB  . LEU A 1 67 ? 28.211 9.119  -25.370 1.00 0.00 ? 65 LEU A CB  1 
ATOM 533 C CG  . LEU A 1 67 ? 27.803 10.338 -26.284 1.00 0.00 ? 65 LEU A CG  1 
ATOM 534 C CD1 . LEU A 1 67 ? 28.769 10.629 -27.427 1.00 0.00 ? 65 LEU A CD1 1 
ATOM 535 C CD2 . LEU A 1 67 ? 26.309 10.477 -26.618 1.00 0.00 ? 65 LEU A CD2 1 
ATOM 536 N N   . CYS A 1 68 ? 26.644 7.352  -27.509 1.00 0.00 ? 66 CYS A N   1 
ATOM 537 C CA  . CYS A 1 68 ? 25.301 6.905  -27.879 1.00 0.00 ? 66 CYS A CA  1 
ATOM 538 C C   . CYS A 1 68 ? 25.270 5.428  -28.008 1.00 0.00 ? 66 CYS A C   1 
ATOM 539 O O   . CYS A 1 68 ? 24.159 4.914  -28.037 1.00 0.00 ? 66 CYS A O   1 
ATOM 540 C CB  . CYS A 1 68 ? 24.779 7.512  -29.190 1.00 0.00 ? 66 CYS A CB  1 
ATOM 541 S SG  . CYS A 1 68 ? 25.861 7.048  -30.603 1.00 0.00 ? 66 CYS A SG  1 
ATOM 542 N N   . ASP A 1 69 ? 26.357 4.644  -28.071 1.00 0.00 ? 67 ASP A N   1 
ATOM 543 C CA  . ASP A 1 69 ? 26.115 3.241  -28.203 1.00 0.00 ? 67 ASP A CA  1 
ATOM 544 C C   . ASP A 1 69 ? 26.161 2.545  -26.871 1.00 0.00 ? 67 ASP A C   1 
ATOM 545 O O   . ASP A 1 69 ? 25.856 1.370  -26.757 1.00 0.00 ? 67 ASP A O   1 
ATOM 546 C CB  . ASP A 1 69 ? 27.249 2.658  -29.138 1.00 0.00 ? 67 ASP A CB  1 
ATOM 547 C CG  . ASP A 1 69 ? 26.887 1.277  -29.658 1.00 0.00 ? 67 ASP A CG  1 
ATOM 548 O OD1 . ASP A 1 69 ? 25.764 0.810  -29.365 1.00 0.00 ? 67 ASP A OD1 1 
ATOM 549 O OD2 . ASP A 1 69 ? 27.736 0.569  -30.282 1.00 0.00 ? 67 ASP A OD2 1 
ATOM 550 N N   . VAL A 1 70 ? 26.605 3.259  -25.835 1.00 0.00 ? 68 VAL A N   1 
ATOM 551 C CA  . VAL A 1 70 ? 26.768 2.689  -24.540 1.00 0.00 ? 68 VAL A CA  1 
ATOM 552 C C   . VAL A 1 70 ? 25.583 3.152  -23.852 1.00 0.00 ? 68 VAL A C   1 
ATOM 553 O O   . VAL A 1 70 ? 24.579 2.496  -23.715 1.00 0.00 ? 68 VAL A O   1 
ATOM 554 C CB  . VAL A 1 70 ? 28.060 3.157  -23.890 1.00 0.00 ? 68 VAL A CB  1 
ATOM 555 C CG1 . VAL A 1 70 ? 28.098 2.300  -22.592 1.00 0.00 ? 68 VAL A CG1 1 
ATOM 556 C CG2 . VAL A 1 70 ? 29.189 2.687  -24.820 1.00 0.00 ? 68 VAL A CG2 1 
ATOM 557 N N   . ALA A 1 71 ? 25.720 4.424  -23.528 1.00 0.00 ? 69 ALA A N   1 
ATOM 558 C CA  . ALA A 1 71 ? 24.664 5.223  -22.997 1.00 0.00 ? 69 ALA A CA  1 
ATOM 559 C C   . ALA A 1 71 ? 23.617 5.478  -23.989 1.00 0.00 ? 69 ALA A C   1 
ATOM 560 O O   . ALA A 1 71 ? 23.860 5.520  -25.221 1.00 0.00 ? 69 ALA A O   1 
ATOM 561 C CB  . ALA A 1 71 ? 25.352 6.514  -22.425 1.00 0.00 ? 69 ALA A CB  1 
ATOM 562 N N   . ASP A 1 72 ? 22.380 5.464  -23.480 1.00 0.00 ? 70 ASP A N   1 
ATOM 563 C CA  . ASP A 1 72 ? 21.122 5.525  -24.134 1.00 0.00 ? 70 ASP A CA  1 
ATOM 564 C C   . ASP A 1 72 ? 20.777 6.988  -24.106 1.00 0.00 ? 70 ASP A C   1 
ATOM 565 O O   . ASP A 1 72 ? 21.659 7.757  -24.111 1.00 0.00 ? 70 ASP A O   1 
ATOM 566 C CB  . ASP A 1 72 ? 20.150 4.519  -23.498 1.00 0.00 ? 70 ASP A CB  1 
ATOM 567 C CG  . ASP A 1 72 ? 20.534 4.438  -22.016 1.00 0.00 ? 70 ASP A CG  1 
ATOM 568 O OD1 . ASP A 1 72 ? 20.573 5.518  -21.451 1.00 0.00 ? 70 ASP A OD1 1 
ATOM 569 O OD2 . ASP A 1 72 ? 20.818 3.315  -21.517 1.00 0.00 ? 70 ASP A OD2 1 
ATOM 570 N N   . ASP A 1 73 ? 19.463 7.394  -24.211 1.00 0.00 ? 71 ASP A N   1 
ATOM 571 C CA  . ASP A 1 73 ? 19.184 8.836  -24.334 1.00 0.00 ? 71 ASP A CA  1 
ATOM 572 C C   . ASP A 1 73 ? 18.184 9.321  -23.380 1.00 0.00 ? 71 ASP A C   1 
ATOM 573 O O   . ASP A 1 73 ? 17.411 8.558  -22.857 1.00 0.00 ? 71 ASP A O   1 
ATOM 574 C CB  . ASP A 1 73 ? 18.713 9.211  -25.822 1.00 0.00 ? 71 ASP A CB  1 
ATOM 575 C CG  . ASP A 1 73 ? 18.926 10.711 -26.198 1.00 0.00 ? 71 ASP A CG  1 
ATOM 576 O OD1 . ASP A 1 73 ? 20.103 11.208 -26.061 1.00 0.00 ? 71 ASP A OD1 1 
ATOM 577 O OD2 . ASP A 1 73 ? 18.016 11.389 -26.594 1.00 0.00 ? 71 ASP A OD2 1 
ATOM 578 N N   . LYS A 1 74 ? 18.304 10.608 -23.127 1.00 0.00 ? 72 LYS A N   1 
ATOM 579 C CA  . LYS A 1 74 ? 17.452 11.397 -22.277 1.00 0.00 ? 72 LYS A CA  1 
ATOM 580 C C   . LYS A 1 74 ? 17.611 10.971 -20.879 1.00 0.00 ? 72 LYS A C   1 
ATOM 581 O O   . LYS A 1 74 ? 16.753 10.784 -20.085 1.00 0.00 ? 72 LYS A O   1 
ATOM 582 C CB  . LYS A 1 74 ? 15.946 11.398 -22.586 1.00 0.00 ? 72 LYS A CB  1 
ATOM 583 C CG  . LYS A 1 74 ? 15.701 11.521 -24.129 1.00 0.00 ? 72 LYS A CG  1 
ATOM 584 C CD  . LYS A 1 74 ? 16.151 12.820 -24.801 1.00 0.00 ? 72 LYS A CD  1 
ATOM 585 C CE  . LYS A 1 74 ? 15.548 14.034 -24.063 1.00 0.00 ? 72 LYS A CE  1 
ATOM 586 N NZ  . LYS A 1 74 ? 14.046 14.055 -23.976 1.00 0.00 ? 72 LYS A NZ  1 
ATOM 587 N N   . ASP A 1 75 ? 18.887 10.724 -20.568 1.00 0.00 ? 73 ASP A N   1 
ATOM 588 C CA  . ASP A 1 75 ? 19.239 10.270 -19.263 1.00 0.00 ? 73 ASP A CA  1 
ATOM 589 C C   . ASP A 1 75 ? 19.849 11.391 -18.473 1.00 0.00 ? 73 ASP A C   1 
ATOM 590 O O   . ASP A 1 75 ? 20.637 12.170 -19.019 1.00 0.00 ? 73 ASP A O   1 
ATOM 591 C CB  . ASP A 1 75 ? 20.073 9.057  -19.272 1.00 0.00 ? 73 ASP A CB  1 
ATOM 592 C CG  . ASP A 1 75 ? 19.642 8.243  -20.425 1.00 0.00 ? 73 ASP A CG  1 
ATOM 593 O OD1 . ASP A 1 75 ? 18.601 7.549  -20.212 1.00 0.00 ? 73 ASP A OD1 1 
ATOM 594 O OD2 . ASP A 1 75 ? 20.389 8.311  -21.396 1.00 0.00 ? 73 ASP A OD2 1 
ATOM 595 N N   . ARG A 1 76 ? 19.601 11.344 -17.179 1.00 0.00 ? 74 ARG A N   1 
ATOM 596 C CA  . ARG A 1 76 ? 20.370 12.107 -16.197 1.00 0.00 ? 74 ARG A CA  1 
ATOM 597 C C   . ARG A 1 76 ? 21.532 11.314 -15.651 1.00 0.00 ? 74 ARG A C   1 
ATOM 598 O O   . ARG A 1 76 ? 21.284 10.395 -14.835 1.00 0.00 ? 74 ARG A O   1 
ATOM 599 C CB  . ARG A 1 76 ? 19.456 12.576 -15.013 1.00 0.00 ? 74 ARG A CB  1 
ATOM 600 C CG  . ARG A 1 76 ? 18.506 13.661 -15.441 1.00 0.00 ? 74 ARG A CG  1 
ATOM 601 C CD  . ARG A 1 76 ? 17.497 14.050 -14.323 1.00 0.00 ? 74 ARG A CD  1 
ATOM 602 N NE  . ARG A 1 76 ? 18.097 14.054 -12.878 1.00 0.00 ? 74 ARG A NE  1 
ATOM 603 C CZ  . ARG A 1 76 ? 17.586 14.594 -11.792 1.00 0.00 ? 74 ARG A CZ  1 
ATOM 604 N NH1 . ARG A 1 76 ? 16.686 15.592 -11.857 1.00 0.00 ? 74 ARG A NH1 1 
ATOM 605 N NH2 . ARG A 1 76 ? 18.071 14.256 -10.529 1.00 0.00 ? 74 ARG A NH2 1 
ATOM 606 N N   . LEU A 1 77 ? 22.758 11.786 -15.961 1.00 0.00 ? 75 LEU A N   1 
ATOM 607 C CA  . LEU A 1 77 ? 24.065 11.389 -15.434 1.00 0.00 ? 75 LEU A CA  1 
ATOM 608 C C   . LEU A 1 77 ? 24.545 12.535 -14.660 1.00 0.00 ? 75 LEU A C   1 
ATOM 609 O O   . LEU A 1 77 ? 24.201 13.622 -15.110 1.00 0.00 ? 75 LEU A O   1 
ATOM 610 C CB  . LEU A 1 77 ? 25.068 11.048 -16.496 1.00 0.00 ? 75 LEU A CB  1 
ATOM 611 C CG  . LEU A 1 77 ? 24.660 9.975  -17.557 1.00 0.00 ? 75 LEU A CG  1 
ATOM 612 C CD1 . LEU A 1 77 ? 24.050 8.639  -17.015 1.00 0.00 ? 75 LEU A CD1 1 
ATOM 613 C CD2 . LEU A 1 77 ? 23.706 10.639 -18.548 1.00 0.00 ? 75 LEU A CD2 1 
ATOM 614 N N   . VAL A 1 78 ? 25.332 12.301 -13.594 1.00 0.00 ? 76 VAL A N   1 
ATOM 615 C CA  . VAL A 1 78 ? 25.898 13.306 -12.733 1.00 0.00 ? 76 VAL A CA  1 
ATOM 616 C C   . VAL A 1 78 ? 27.321 13.416 -13.183 1.00 0.00 ? 76 VAL A C   1 
ATOM 617 O O   . VAL A 1 78 ? 27.760 12.427 -13.758 1.00 0.00 ? 76 VAL A O   1 
ATOM 618 C CB  . VAL A 1 78 ? 25.862 12.907 -11.244 1.00 0.00 ? 76 VAL A CB  1 
ATOM 619 C CG1 . VAL A 1 78 ? 24.414 12.469 -10.947 1.00 0.00 ? 76 VAL A CG1 1 
ATOM 620 C CG2 . VAL A 1 78 ? 26.874 11.713 -11.009 1.00 0.00 ? 76 VAL A CG2 1 
ATOM 621 N N   . ALA A 1 79 ? 27.962 14.476 -12.733 1.00 0.00 ? 77 ALA A N   1 
ATOM 622 C CA  . ALA A 1 79 ? 29.335 14.642 -12.948 1.00 0.00 ? 77 ALA A CA  1 
ATOM 623 C C   . ALA A 1 79 ? 30.039 15.089 -11.678 1.00 0.00 ? 77 ALA A C   1 
ATOM 624 O O   . ALA A 1 79 ? 29.712 16.124 -11.087 1.00 0.00 ? 77 ALA A O   1 
ATOM 625 C CB  . ALA A 1 79 ? 29.610 15.803 -13.992 1.00 0.00 ? 77 ALA A CB  1 
ATOM 626 N N   . VAL A 1 80 ? 31.035 14.238 -11.314 1.00 0.00 ? 78 VAL A N   1 
ATOM 627 C CA  . VAL A 1 80 ? 32.053 14.152 -10.326 1.00 0.00 ? 78 VAL A CA  1 
ATOM 628 C C   . VAL A 1 80 ? 33.323 14.669 -10.789 1.00 0.00 ? 78 VAL A C   1 
ATOM 629 O O   . VAL A 1 80 ? 33.865 14.199 -11.746 1.00 0.00 ? 78 VAL A O   1 
ATOM 630 C CB  . VAL A 1 80 ? 32.340 12.815 -9.678  1.00 0.00 ? 78 VAL A CB  1 
ATOM 631 C CG1 . VAL A 1 80 ? 33.202 12.953 -8.450  1.00 0.00 ? 78 VAL A CG1 1 
ATOM 632 C CG2 . VAL A 1 80 ? 30.999 12.191 -9.260  1.00 0.00 ? 78 VAL A CG2 1 
ATOM 633 N N   . PHE A 1 81 ? 33.712 15.808 -10.178 1.00 0.00 ? 79 PHE A N   1 
ATOM 634 C CA  . PHE A 1 81 ? 34.615 16.779 -10.617 1.00 0.00 ? 79 PHE A CA  1 
ATOM 635 C C   . PHE A 1 81 ? 35.436 17.381 -9.451  1.00 0.00 ? 79 PHE A C   1 
ATOM 636 O O   . PHE A 1 81 ? 34.961 17.417 -8.339  1.00 0.00 ? 79 PHE A O   1 
ATOM 637 C CB  . PHE A 1 81 ? 33.727 17.982 -10.949 1.00 0.00 ? 79 PHE A CB  1 
ATOM 638 C CG  . PHE A 1 81 ? 32.850 18.555 -9.748  1.00 0.00 ? 79 PHE A CG  1 
ATOM 639 C CD1 . PHE A 1 81 ? 31.754 17.934 -9.255  1.00 0.00 ? 79 PHE A CD1 1 
ATOM 640 C CD2 . PHE A 1 81 ? 33.293 19.747 -9.091  1.00 0.00 ? 79 PHE A CD2 1 
ATOM 641 C CE1 . PHE A 1 81 ? 30.977 18.575 -8.288  1.00 0.00 ? 79 PHE A CE1 1 
ATOM 642 C CE2 . PHE A 1 81 ? 32.604 20.260 -7.981  1.00 0.00 ? 79 PHE A CE2 1 
ATOM 643 C CZ  . PHE A 1 81 ? 31.348 19.791 -7.722  1.00 0.00 ? 79 PHE A CZ  1 
ATOM 644 N N   . ASP A 1 82 ? 36.434 18.188 -9.891  1.00 0.00 ? 80 ASP A N   1 
ATOM 645 C CA  . ASP A 1 82 ? 36.955 19.347 -9.170  1.00 0.00 ? 80 ASP A CA  1 
ATOM 646 C C   . ASP A 1 82 ? 36.892 20.368 -10.256 1.00 0.00 ? 80 ASP A C   1 
ATOM 647 O O   . ASP A 1 82 ? 37.183 19.987 -11.411 1.00 0.00 ? 80 ASP A O   1 
ATOM 648 C CB  . ASP A 1 82 ? 38.258 19.010 -8.426  1.00 0.00 ? 80 ASP A CB  1 
ATOM 649 C CG  . ASP A 1 82 ? 37.781 18.140 -7.311  1.00 0.00 ? 80 ASP A CG  1 
ATOM 650 O OD1 . ASP A 1 82 ? 37.761 16.939 -7.524  1.00 0.00 ? 80 ASP A OD1 1 
ATOM 651 O OD2 . ASP A 1 82 ? 37.542 18.694 -6.187  1.00 0.00 ? 80 ASP A OD2 1 
ATOM 652 N N   . GLU A 1 83 ? 36.595 21.621 -9.963  1.00 0.00 ? 81 GLU A N   1 
ATOM 653 C CA  . GLU A 1 83 ? 36.562 22.655 -10.987 1.00 0.00 ? 81 GLU A CA  1 
ATOM 654 C C   . GLU A 1 83 ? 36.645 23.966 -10.327 1.00 0.00 ? 81 GLU A C   1 
ATOM 655 O O   . GLU A 1 83 ? 36.541 25.006 -10.921 1.00 0.00 ? 81 GLU A O   1 
ATOM 656 C CB  . GLU A 1 83 ? 35.337 22.525 -12.002 1.00 0.00 ? 81 GLU A CB  1 
ATOM 657 C CG  . GLU A 1 83 ? 34.001 23.197 -11.604 1.00 0.00 ? 81 GLU A CG  1 
ATOM 658 C CD  . GLU A 1 83 ? 33.336 22.690 -10.352 1.00 0.00 ? 81 GLU A CD  1 
ATOM 659 O OE1 . GLU A 1 83 ? 34.046 22.863 -9.324  1.00 0.00 ? 81 GLU A OE1 1 
ATOM 660 O OE2 . GLU A 1 83 ? 32.201 22.187 -10.317 1.00 0.00 ? 81 GLU A OE2 1 
ATOM 661 N N   . GLN A 1 84 ? 36.882 23.923 -9.005  1.00 0.00 ? 82 GLN A N   1 
ATOM 662 C CA  . GLN A 1 84 ? 36.884 25.145 -8.132  1.00 0.00 ? 82 GLN A CA  1 
ATOM 663 C C   . GLN A 1 84 ? 38.250 25.877 -8.289  1.00 0.00 ? 82 GLN A C   1 
ATOM 664 O O   . GLN A 1 84 ? 38.899 26.309 -7.341  1.00 0.00 ? 82 GLN A O   1 
ATOM 665 C CB  . GLN A 1 84 ? 36.649 24.772 -6.682  1.00 0.00 ? 82 GLN A CB  1 
ATOM 666 C CG  . GLN A 1 84 ? 35.430 23.831 -6.496  1.00 0.00 ? 82 GLN A CG  1 
ATOM 667 C CD  . GLN A 1 84 ? 34.956 23.772 -5.031  1.00 0.00 ? 82 GLN A CD  1 
ATOM 668 O OE1 . GLN A 1 84 ? 33.774 23.491 -4.844  1.00 0.00 ? 82 GLN A OE1 1 
ATOM 669 N NE2 . GLN A 1 84 ? 35.841 23.813 -4.035  1.00 0.00 ? 82 GLN A NE2 1 
ATOM 670 O OXT . GLN A 1 84 ? 38.667 25.998 -9.526  1.00 0.00 ? 82 GLN A OXT 1 
# 
loop_
_pdbx_poly_seq_scheme.asym_id 
_pdbx_poly_seq_scheme.entity_id 
_pdbx_poly_seq_scheme.seq_id 
_pdbx_poly_seq_scheme.mon_id 
_pdbx_poly_seq_scheme.ndb_seq_num 
_pdbx_poly_seq_scheme.pdb_seq_num 
_pdbx_poly_seq_scheme.auth_seq_num 
_pdbx_poly_seq_scheme.pdb_mon_id 
_pdbx_poly_seq_scheme.auth_mon_id 
_pdbx_poly_seq_scheme.pdb_strand_id 
_pdbx_poly_seq_scheme.pdb_ins_code 
_pdbx_poly_seq_scheme.hetero 
A 1 1  SER 1  -1 -1 SER SER A . n 
A 1 2  GLU 2  0  0  GLU GLU A . n 
A 1 3  PHE 3  1  1  PHE PHE A . n 
A 1 4  LYS 4  2  2  LYS LYS A . n 
A 1 5  VAL 5  3  3  VAL VAL A . n 
A 1 6  THR 6  4  4  THR THR A . n 
A 1 7  VAL 7  5  5  VAL VAL A . n 
A 1 8  CYS 8  6  6  CYS CYS A . n 
A 1 9  PHE 9  7  7  PHE PHE A . n 
A 1 10 GLY 10 8  8  GLY GLY A . n 
A 1 11 ARG 11 9  9  ARG ARG A . n 
A 1 12 THR 12 10 10 THR THR A . n 
A 1 13 ARG 13 11 11 ARG ARG A . n 
A 1 14 VAL 14 12 12 VAL VAL A . n 
A 1 15 VAL 15 13 13 VAL VAL A . n 
A 1 16 VAL 16 14 14 VAL VAL A . n 
A 1 17 PRO 17 15 15 PRO PRO A . n 
A 1 18 CYS 18 16 16 CYS CYS A . n 
A 1 19 GLY 19 17 17 GLY GLY A . n 
A 1 20 ASP 20 18 18 ASP ASP A . n 
A 1 21 GLY 21 19 19 GLY GLY A . n 
A 1 22 ARG 22 20 20 ARG ARG A . n 
A 1 23 MET 23 21 21 MET MET A . n 
A 1 24 LYS 24 22 22 LYS LYS A . n 
A 1 25 VAL 25 23 23 VAL VAL A . n 
A 1 26 PHE 26 24 24 PHE PHE A . n 
A 1 27 SER 27 25 25 SER SER A . n 
A 1 28 LEU 28 26 26 LEU LEU A . n 
A 1 29 ILE 29 27 27 ILE ILE A . n 
A 1 30 GLN 30 28 28 GLN GLN A . n 
A 1 31 GLN 31 29 29 GLN GLN A . n 
A 1 32 ALA 32 30 30 ALA ALA A . n 
A 1 33 VAL 33 31 31 VAL VAL A . n 
A 1 34 THR 34 32 32 THR THR A . n 
A 1 35 ARG 35 33 33 ARG ARG A . n 
A 1 36 TYR 36 34 34 TYR TYR A . n 
A 1 37 ARG 37 35 35 ARG ARG A . n 
A 1 38 LYS 38 36 36 LYS LYS A . n 
A 1 39 ALA 39 37 37 ALA ALA A . n 
A 1 40 VAL 40 38 38 VAL VAL A . n 
A 1 41 ALA 41 39 39 ALA ALA A . n 
A 1 42 LYS 42 40 40 LYS LYS A . n 
A 1 43 ASP 43 41 41 ASP ASP A . n 
A 1 44 PRO 44 42 42 PRO PRO A . n 
A 1 45 ASN 45 43 43 ASN ASN A . n 
A 1 46 TYR 46 44 44 TYR TYR A . n 
A 1 47 TRP 47 45 45 TRP TRP A . n 
A 1 48 ILE 48 46 46 ILE ILE A . n 
A 1 49 GLN 49 47 47 GLN GLN A . n 
A 1 50 VAL 50 48 48 VAL VAL A . n 
A 1 51 HIS 51 49 49 HIS HIS A . n 
A 1 52 ARG 52 50 50 ARG ARG A . n 
A 1 53 LEU 53 51 51 LEU LEU A . n 
A 1 54 GLU 54 52 52 GLU GLU A . n 
A 1 55 HIS 55 53 53 HIS HIS A . n 
A 1 56 GLY 56 54 54 GLY GLY A . n 
A 1 57 ASP 57 55 55 ASP ASP A . n 
A 1 58 GLY 58 56 56 GLY GLY A . n 
A 1 59 GLY 59 57 57 GLY GLY A . n 
A 1 60 ILE 60 58 58 ILE ILE A . n 
A 1 61 LEU 61 59 59 LEU LEU A . n 
A 1 62 ASP 62 60 60 ASP ASP A . n 
A 1 63 LEU 63 61 61 LEU LEU A . n 
A 1 64 ASP 64 62 62 ASP ASP A . n 
A 1 65 ASP 65 63 63 ASP ASP A . n 
A 1 66 ILE 66 64 64 ILE ILE A . n 
A 1 67 LEU 67 65 65 LEU LEU A . n 
A 1 68 CYS 68 66 66 CYS CYS A . n 
A 1 69 ASP 69 67 67 ASP ASP A . n 
A 1 70 VAL 70 68 68 VAL VAL A . n 
A 1 71 ALA 71 69 69 ALA ALA A . n 
A 1 72 ASP 72 70 70 ASP ASP A . n 
A 1 73 ASP 73 71 71 ASP ASP A . n 
A 1 74 LYS 74 72 72 LYS LYS A . n 
A 1 75 ASP 75 73 73 ASP ASP A . n 
A 1 76 ARG 76 74 74 ARG ARG A . n 
A 1 77 LEU 77 75 75 LEU LEU A . n 
A 1 78 VAL 78 76 76 VAL VAL A . n 
A 1 79 ALA 79 77 77 ALA ALA A . n 
A 1 80 VAL 80 78 78 VAL VAL A . n 
A 1 81 PHE 81 79 79 PHE PHE A . n 
A 1 82 ASP 82 80 80 ASP ASP A . n 
A 1 83 GLU 83 81 81 GLU GLU A . n 
A 1 84 GLN 84 82 82 GLN GLN A . n 
# 
loop_
_pdbx_struct_assembly.id 
_pdbx_struct_assembly.details 
_pdbx_struct_assembly.method_details 
_pdbx_struct_assembly.oligomeric_details 
_pdbx_struct_assembly.oligomeric_count 
1 'representative helical assembly'            ? helical   49 
2 'helical asymmetric unit'                    ? monomeric 1  
3 'helical asymmetric unit, std helical frame' ? monomeric 1  
# 
loop_
_pdbx_struct_assembly_gen.assembly_id 
_pdbx_struct_assembly_gen.oper_expression 
_pdbx_struct_assembly_gen.asym_id_list 
1 '(1-49)' A 
2 25       A 
3 H        A 
# 
loop_
_pdbx_struct_oper_list.id 
_pdbx_struct_oper_list.type 
_pdbx_struct_oper_list.name 
_pdbx_struct_oper_list.symmetry_operation 
_pdbx_struct_oper_list.matrix[1][1] 
_pdbx_struct_oper_list.matrix[1][2] 
_pdbx_struct_oper_list.matrix[1][3] 
_pdbx_struct_oper_list.vector[1] 
_pdbx_struct_oper_list.matrix[2][1] 
_pdbx_struct_oper_list.matrix[2][2] 
_pdbx_struct_oper_list.matrix[2][3] 
_pdbx_struct_oper_list.vector[2] 
_pdbx_struct_oper_list.matrix[3][1] 
_pdbx_struct_oper_list.matrix[3][2] 
_pdbx_struct_oper_list.matrix[3][3] 
_pdbx_struct_oper_list.vector[3] 
H  'transform to helical frame' ? ? 1.00000000  0.00000000  0.00000000 0.00000 0.00000000  1.00000000  0.00000000 0.00000 
0.00000000 0.00000000 1.00000000 0.00000   
1  'helical symmetry operation' ? ? 0.88327513  0.46885503  0.00000000 0.00000 -0.46885503 0.88327513  0.00000000 0.00000 
0.00000000 0.00000000 1.00000000 -84.76800 
2  'helical symmetry operation' ? ? 0.31241782  0.94994479  0.00000000 0.00000 -0.94994479 0.31241782  0.00000000 0.00000 
0.00000000 0.00000000 1.00000000 -81.23600 
3  'helical symmetry operation' ? ? -0.43255789 0.90160616  0.00000000 0.00000 -0.90160616 -0.43255789 0.00000000 0.00000 
0.00000000 0.00000000 1.00000000 -77.70400 
4  'helical symmetry operation' ? ? -0.93645808 0.35077950  0.00000000 0.00000 -0.35077950 -0.93645808 0.00000000 0.00000 
0.00000000 0.00000000 1.00000000 -74.17200 
5  'helical symmetry operation' ? ? -0.91844638 -0.39554550 0.00000000 0.00000 0.39554550  -0.91844638 0.00000000 0.00000 
0.00000000 0.00000000 1.00000000 -70.64000 
6  'helical symmetry operation' ? ? -0.38856116 -0.92142294 0.00000000 0.00000 0.92142294  -0.38856116 0.00000000 0.00000 
0.00000000 0.00000000 1.00000000 -67.10800 
7  'helical symmetry operation' ? ? 0.35787908  -0.93376794 0.00000000 0.00000 0.93376794  0.35787908  0.00000000 0.00000 
0.00000000 0.00000000 1.00000000 -63.57600 
8  'helical symmetry operation' ? ? 0.90486421  -0.42570033 0.00000000 0.00000 0.42570033  0.90486421  0.00000000 0.00000 
0.00000000 0.00000000 1.00000000 -60.04400 
9  'helical symmetry operation' ? ? 0.94754550  0.31962090  0.00000000 0.00000 -0.31962090 0.94754550  0.00000000 0.00000 
0.00000000 0.00000000 1.00000000 -56.51200 
10 'helical symmetry operation' ? ? 0.46213560  0.88680927  0.00000000 0.00000 -0.88680927 0.46213560  0.00000000 0.00000 
0.00000000 0.00000000 1.00000000 -52.98000 
11 'helical symmetry operation' ? ? -0.28083422 0.95975629  0.00000000 0.00000 -0.95975629 -0.28083422 0.00000000 0.00000 
0.00000000 0.00000000 1.00000000 -49.44800 
12 'helical symmetry operation' ? ? -0.86728799 0.49780673  0.00000000 0.00000 -0.49780673 -0.86728799 0.00000000 0.00000 
0.00000000 0.00000000 1.00000000 -45.91600 
13 'helical symmetry operation' ? ? -0.97038011 -0.24158318 0.00000000 0.00000 0.24158318  -0.97038011 0.00000000 0.00000 
0.00000000 0.00000000 1.00000000 -42.38400 
14 'helical symmetry operation' ? ? -0.53265472 -0.84633264 0.00000000 0.00000 0.84633264  -0.53265472 0.00000000 0.00000 
0.00000000 0.00000000 1.00000000 -38.85200 
15 'helical symmetry operation' ? ? 0.20193269  -0.97939940 0.00000000 0.00000 0.97939940  0.20193269  0.00000000 0.00000 
0.00000000 0.00000000 1.00000000 -35.32000 
16 'helical symmetry operation' ? ? 0.82397788  -0.56662197 0.00000000 0.00000 0.56662197  0.82397788  0.00000000 0.00000 
0.00000000 0.00000000 1.00000000 -31.78800 
17 'helical symmetry operation' ? ? 0.98679925  0.16194829  0.00000000 0.00000 -0.16194829 0.98679925  0.00000000 0.00000 
0.00000000 0.00000000 1.00000000 -28.25600 
18 'helical symmetry operation' ? ? 0.59965231  0.80026065  0.00000000 0.00000 -0.80026065 0.59965231  0.00000000 0.00000 
0.00000000 0.00000000 1.00000000 -24.72400 
19 'helical symmetry operation' ? ? -0.12169611 0.99256741  0.00000000 0.00000 -0.99256741 -0.12169611 0.00000000 0.00000 
0.00000000 0.00000000 1.00000000 -21.19200 
20 'helical symmetry operation' ? ? -0.77522019 0.63169111  0.00000000 0.00000 -0.63169111 -0.77522019 0.00000000 0.00000 
0.00000000 0.00000000 1.00000000 -17.66000 
21 'helical symmetry operation' ? ? -0.99669435 -0.08124270 0.00000000 0.00000 0.08124270  -0.99669435 0.00000000 0.00000 
0.00000000 0.00000000 1.00000000 -14.12800 
22 'helical symmetry operation' ? ? -0.66268540 -0.74889789 0.00000000 0.00000 0.74889789  -0.66268540 0.00000000 0.00000 
0.00000000 0.00000000 1.00000000 -10.59600 
23 'helical symmetry operation' ? ? 0.04065496  -0.99917325 0.00000000 0.00000 0.99917325  0.04065496  0.00000000 0.00000 
0.00000000 0.00000000 1.00000000 -7.06400  
24 'helical symmetry operation' ? ? 0.72133729  -0.69258394 0.00000000 0.00000 0.69258394  0.72133729  0.00000000 0.00000 
0.00000000 0.00000000 1.00000000 -3.53200  
25 'helical symmetry operation' ? ? 1.00000000  0.00000000  0.00000000 0.00000 0.00000000  1.00000000  0.00000000 0.00000 
0.00000000 0.00000000 1.00000000 0.00000   
26 'helical symmetry operation' ? ? 0.72133729  0.69258394  0.00000000 0.00000 -0.69258394 0.72133729  0.00000000 0.00000 
0.00000000 0.00000000 1.00000000 3.53200   
27 'helical symmetry operation' ? ? 0.04065496  0.99917325  0.00000000 0.00000 -0.99917325 0.04065496  0.00000000 0.00000 
0.00000000 0.00000000 1.00000000 7.06400   
28 'helical symmetry operation' ? ? -0.66268540 0.74889789  0.00000000 0.00000 -0.74889789 -0.66268540 0.00000000 0.00000 
0.00000000 0.00000000 1.00000000 10.59600  
29 'helical symmetry operation' ? ? -0.99669435 0.08124270  0.00000000 0.00000 -0.08124270 -0.99669435 0.00000000 0.00000 
0.00000000 0.00000000 1.00000000 14.12800  
30 'helical symmetry operation' ? ? -0.77522019 -0.63169111 0.00000000 0.00000 0.63169111  -0.77522019 0.00000000 0.00000 
0.00000000 0.00000000 1.00000000 17.66000  
31 'helical symmetry operation' ? ? -0.12169611 -0.99256741 0.00000000 0.00000 0.99256741  -0.12169611 0.00000000 0.00000 
0.00000000 0.00000000 1.00000000 21.19200  
32 'helical symmetry operation' ? ? 0.59965231  -0.80026065 0.00000000 0.00000 0.80026065  0.59965231  0.00000000 0.00000 
0.00000000 0.00000000 1.00000000 24.72400  
33 'helical symmetry operation' ? ? 0.98679925  -0.16194829 0.00000000 0.00000 0.16194829  0.98679925  0.00000000 0.00000 
0.00000000 0.00000000 1.00000000 28.25600  
34 'helical symmetry operation' ? ? 0.82397788  0.56662197  0.00000000 0.00000 -0.56662197 0.82397788  0.00000000 0.00000 
0.00000000 0.00000000 1.00000000 31.78800  
35 'helical symmetry operation' ? ? 0.20193269  0.97939940  0.00000000 0.00000 -0.97939940 0.20193269  0.00000000 0.00000 
0.00000000 0.00000000 1.00000000 35.32000  
36 'helical symmetry operation' ? ? -0.53265472 0.84633264  0.00000000 0.00000 -0.84633264 -0.53265472 0.00000000 0.00000 
0.00000000 0.00000000 1.00000000 38.85200  
37 'helical symmetry operation' ? ? -0.97038011 0.24158318  0.00000000 0.00000 -0.24158318 -0.97038011 0.00000000 0.00000 
0.00000000 0.00000000 1.00000000 42.38400  
38 'helical symmetry operation' ? ? -0.86728799 -0.49780673 0.00000000 0.00000 0.49780673  -0.86728799 0.00000000 0.00000 
0.00000000 0.00000000 1.00000000 45.91600  
39 'helical symmetry operation' ? ? -0.28083422 -0.95975629 0.00000000 0.00000 0.95975629  -0.28083422 0.00000000 0.00000 
0.00000000 0.00000000 1.00000000 49.44800  
40 'helical symmetry operation' ? ? 0.46213560  -0.88680927 0.00000000 0.00000 0.88680927  0.46213560  0.00000000 0.00000 
0.00000000 0.00000000 1.00000000 52.98000  
41 'helical symmetry operation' ? ? 0.94754550  -0.31962090 0.00000000 0.00000 0.31962090  0.94754550  0.00000000 0.00000 
0.00000000 0.00000000 1.00000000 56.51200  
42 'helical symmetry operation' ? ? 0.90486421  0.42570033  0.00000000 0.00000 -0.42570033 0.90486421  0.00000000 0.00000 
0.00000000 0.00000000 1.00000000 60.04400  
43 'helical symmetry operation' ? ? 0.35787908  0.93376794  0.00000000 0.00000 -0.93376794 0.35787908  0.00000000 0.00000 
0.00000000 0.00000000 1.00000000 63.57600  
44 'helical symmetry operation' ? ? -0.38856116 0.92142294  0.00000000 0.00000 -0.92142294 -0.38856116 0.00000000 0.00000 
0.00000000 0.00000000 1.00000000 67.10800  
45 'helical symmetry operation' ? ? -0.91844638 0.39554550  0.00000000 0.00000 -0.39554550 -0.91844638 0.00000000 0.00000 
0.00000000 0.00000000 1.00000000 70.64000  
46 'helical symmetry operation' ? ? -0.93645808 -0.35077950 0.00000000 0.00000 0.35077950  -0.93645808 0.00000000 0.00000 
0.00000000 0.00000000 1.00000000 74.17200  
47 'helical symmetry operation' ? ? -0.43255789 -0.90160616 0.00000000 0.00000 0.90160616  -0.43255789 0.00000000 0.00000 
0.00000000 0.00000000 1.00000000 77.70400  
48 'helical symmetry operation' ? ? 0.31241782  -0.94994479 0.00000000 0.00000 0.94994479  0.31241782  0.00000000 0.00000 
0.00000000 0.00000000 1.00000000 81.23600  
49 'helical symmetry operation' ? ? 0.88327513  -0.46885503 0.00000000 0.00000 0.46885503  0.88327513  0.00000000 0.00000 
0.00000000 0.00000000 1.00000000 84.76800  
# 
_pdbx_helical_symmetry.entry_id                  3ZEE 
_pdbx_helical_symmetry.number_of_operations      49 
_pdbx_helical_symmetry.rotation_per_n_subunits   -43.835000 
_pdbx_helical_symmetry.rise_per_n_subunits       3.532000 
_pdbx_helical_symmetry.n_subunits_divisor        1 
_pdbx_helical_symmetry.dyad_axis                 no 
_pdbx_helical_symmetry.circular_symmetry         1 
# 
loop_
_pdbx_audit_revision_history.ordinal 
_pdbx_audit_revision_history.data_content_type 
_pdbx_audit_revision_history.major_revision 
_pdbx_audit_revision_history.minor_revision 
_pdbx_audit_revision_history.revision_date 
1 'Structure model' 1 0 2013-10-16 
2 'Structure model' 2 0 2017-08-30 
# 
_pdbx_audit_revision_details.ordinal             1 
_pdbx_audit_revision_details.revision_ordinal    1 
_pdbx_audit_revision_details.data_content_type   'Structure model' 
_pdbx_audit_revision_details.provider            repository 
_pdbx_audit_revision_details.type                'Initial release' 
_pdbx_audit_revision_details.description         ? 
# 
loop_
_pdbx_audit_revision_group.ordinal 
_pdbx_audit_revision_group.revision_ordinal 
_pdbx_audit_revision_group.data_content_type 
_pdbx_audit_revision_group.group 
1 2 'Structure model' Advisory          
2 2 'Structure model' 'Atomic model'    
3 2 'Structure model' 'Data collection' 
# 
loop_
_pdbx_audit_revision_category.ordinal 
_pdbx_audit_revision_category.revision_ordinal 
_pdbx_audit_revision_category.data_content_type 
_pdbx_audit_revision_category.category 
1 2 'Structure model' atom_site                    
2 2 'Structure model' em_software                  
3 2 'Structure model' pdbx_unobs_or_zero_occ_atoms 
# 
loop_
_pdbx_audit_revision_item.ordinal 
_pdbx_audit_revision_item.revision_ordinal 
_pdbx_audit_revision_item.data_content_type 
_pdbx_audit_revision_item.item 
1 2 'Structure model' '_atom_site.auth_atom_id'          
2 2 'Structure model' '_atom_site.label_atom_id'         
3 2 'Structure model' '_em_software.fitting_id'          
4 2 'Structure model' '_em_software.image_processing_id' 
# 
_em_3d_fitting.id                1 
_em_3d_fitting.entry_id          3ZEE 
_em_3d_fitting.ref_protocol      OTHER 
_em_3d_fitting.ref_space         REAL 
_em_3d_fitting.overall_b_value   ? 
_em_3d_fitting.target_criteria   'ENERGY FUNCTION IN NAMD2' 
_em_3d_fitting.details           'METHOD--CROSS CORRELATION REFINEMENT PROTOCOL--X-RAY' 
_em_3d_fitting.method            ? 
# 
_em_3d_fitting_list.3d_fitting_id   1 
_em_3d_fitting_list.id              1 
_em_3d_fitting_list.pdb_entry_id    4I6P 
_em_3d_fitting_list.pdb_chain_id    ? 
_em_3d_fitting_list.details         ? 
# 
_em_3d_reconstruction.entry_id                    3ZEE 
_em_3d_reconstruction.id                          1 
_em_3d_reconstruction.resolution_method           'FSC 0.5 CUT-OFF' 
_em_3d_reconstruction.refinement_type             'HALF-MAPS REFINED INDEPENDENTLY' 
_em_3d_reconstruction.symmetry_type               HELICAL 
_em_3d_reconstruction.num_particles               84000 
_em_3d_reconstruction.image_processing_id         1 
_em_3d_reconstruction.method                      
'THE INITIAL MODEL WAS OBTAINED USING IHRSR. THEN THE FINAL RECONSTRUCTION WERE OBTAINED BY PROJECTION MATCHING IN EMAN.' 
_em_3d_reconstruction.nominal_pixel_size          ? 
_em_3d_reconstruction.actual_pixel_size           0.933 
_em_3d_reconstruction.resolution                  6.1 
_em_3d_reconstruction.magnification_calibration   ? 
_em_3d_reconstruction.details                     
;THE INITIAL MODEL WAS OBTAINED USING IHRSR. THEN THE FINAL RECONSTRUCTION WERE OBTAINED BY PROJECTION MATCHING IN EMAN. THE RESOLUTION CRITERIA USED WAS GOLDEN CRITERIA FSC 0.5. SUBMISSION BASED ON EXPERIMENTAL DATA FROM EMDB EMD-2237. (DEPOSITION ID: 11249).
;
_em_3d_reconstruction.num_class_averages          ? 
_em_3d_reconstruction.algorithm                   ? 
# 
_em_buffer.id            1 
_em_buffer.specimen_id   1 
_em_buffer.name          '50 MM TRIS, 100 MM NACL, 1 MM DTT AND 1 MM EDTA' 
_em_buffer.pH            8 
_em_buffer.details       '50 MM TRIS, 100 MM NACL, 1 MM DTT AND 1 MM EDTA' 
# 
_em_entity_assembly.id                   1 
_em_entity_assembly.name                 'PAR-3 N-TERMINAL DUF3534 DOMAIN' 
_em_entity_assembly.type                 COMPLEX 
_em_entity_assembly.parent_id            0 
_em_entity_assembly.synonym              ? 
_em_entity_assembly.details              'SUPPORTING FILM IS GIG HOLELY GRID.' 
_em_entity_assembly.oligomeric_details   ? 
# 
_em_image_scans.entry_id                3ZEE 
_em_image_scans.id                      1 
_em_image_scans.image_recording_id      1 
_em_image_scans.number_digital_images   6460 
_em_image_scans.citation_id             ? 
_em_image_scans.od_range                ? 
_em_image_scans.quant_bit_size          ? 
_em_image_scans.sampling_size           ? 
_em_image_scans.scanner_model           ? 
_em_image_scans.details                 ? 
# 
_em_imaging.entry_id                        3ZEE 
_em_imaging.id                              1 
_em_imaging.microscope_model                'FEI TITAN KRIOS' 
_em_imaging.illumination_mode               'FLOOD BEAM' 
_em_imaging.specimen_id                     1 
_em_imaging.date                            2010-12-01 
_em_imaging.temperature                     95 
_em_imaging.nominal_defocus_min             1800 
_em_imaging.nominal_defocus_max             2500 
_em_imaging.tilt_angle_min                  ? 
_em_imaging.tilt_angle_max                  ? 
_em_imaging.nominal_cs                      2.7 
_em_imaging.mode                            'BRIGHT FIELD' 
_em_imaging.nominal_magnification           96000 
_em_imaging.calibrated_magnification        ? 
_em_imaging.electron_source                 'FIELD EMISSION GUN' 
_em_imaging.accelerating_voltage            300 
_em_imaging.details                         
;THE MICROSCOPE MODEL IS FEI TITAN KRIOS. 6460 RAW IMAGES WERE COLLECTED AUTOMATICALLY USING THE PACKAGE LEGINON. GOOD MICROGRAPHS WERE SELECTED ONE BY ONE
;
_em_imaging.specimen_holder_type            . 
_em_imaging.specimen_holder_model           . 
_em_imaging.citation_id                     ? 
_em_imaging.astigmatism                     ? 
_em_imaging.detector_distance               ? 
_em_imaging.electron_beam_tilt_params       ? 
_em_imaging.recording_temperature_maximum   ? 
_em_imaging.recording_temperature_minimum   ? 
# 
_em_sample_support.id               1 
_em_sample_support.specimen_id      1 
_em_sample_support.details          CARBON 
_em_sample_support.method           ? 
_em_sample_support.film_material    ? 
_em_sample_support.grid_material    ? 
_em_sample_support.grid_mesh_size   ? 
_em_sample_support.grid_type        ? 
# 
_em_vitrification.entry_id              3ZEE 
_em_vitrification.id                    1 
_em_vitrification.instrument            'FEI VITROBOT MARK IV' 
_em_vitrification.cryogen_name          ETHANE 
_em_vitrification.specimen_id           1 
_em_vitrification.details               'LIQUID ETHANE' 
_em_vitrification.citation_id           ? 
_em_vitrification.humidity              ? 
_em_vitrification.method                ? 
_em_vitrification.temp                  ? 
_em_vitrification.time_resolved_state   ? 
# 
_em_experiment.entry_id                3ZEE 
_em_experiment.id                      1 
_em_experiment.aggregation_state       FILAMENT 
_em_experiment.entity_assembly_id      1 
_em_experiment.reconstruction_method   HELICAL 
# 
loop_
_pdbx_validate_rmsd_bond.id 
_pdbx_validate_rmsd_bond.PDB_model_num 
_pdbx_validate_rmsd_bond.auth_atom_id_1 
_pdbx_validate_rmsd_bond.auth_asym_id_1 
_pdbx_validate_rmsd_bond.auth_comp_id_1 
_pdbx_validate_rmsd_bond.auth_seq_id_1 
_pdbx_validate_rmsd_bond.PDB_ins_code_1 
_pdbx_validate_rmsd_bond.label_alt_id_1 
_pdbx_validate_rmsd_bond.auth_atom_id_2 
_pdbx_validate_rmsd_bond.auth_asym_id_2 
_pdbx_validate_rmsd_bond.auth_comp_id_2 
_pdbx_validate_rmsd_bond.auth_seq_id_2 
_pdbx_validate_rmsd_bond.PDB_ins_code_2 
_pdbx_validate_rmsd_bond.label_alt_id_2 
_pdbx_validate_rmsd_bond.bond_value 
_pdbx_validate_rmsd_bond.bond_target_value 
_pdbx_validate_rmsd_bond.bond_deviation 
_pdbx_validate_rmsd_bond.bond_standard_deviation 
_pdbx_validate_rmsd_bond.linker_flag 
1 1 CA A LEU 59 ? ? C  A LEU 59 ? ? 1.365 1.525 -0.160 0.026 N 
2 1 CD A ARG 74 ? ? NE A ARG 74 ? ? 1.565 1.460 0.105  0.017 N 
# 
loop_
_pdbx_validate_rmsd_angle.id 
_pdbx_validate_rmsd_angle.PDB_model_num 
_pdbx_validate_rmsd_angle.auth_atom_id_1 
_pdbx_validate_rmsd_angle.auth_asym_id_1 
_pdbx_validate_rmsd_angle.auth_comp_id_1 
_pdbx_validate_rmsd_angle.auth_seq_id_1 
_pdbx_validate_rmsd_angle.PDB_ins_code_1 
_pdbx_validate_rmsd_angle.label_alt_id_1 
_pdbx_validate_rmsd_angle.auth_atom_id_2 
_pdbx_validate_rmsd_angle.auth_asym_id_2 
_pdbx_validate_rmsd_angle.auth_comp_id_2 
_pdbx_validate_rmsd_angle.auth_seq_id_2 
_pdbx_validate_rmsd_angle.PDB_ins_code_2 
_pdbx_validate_rmsd_angle.label_alt_id_2 
_pdbx_validate_rmsd_angle.auth_atom_id_3 
_pdbx_validate_rmsd_angle.auth_asym_id_3 
_pdbx_validate_rmsd_angle.auth_comp_id_3 
_pdbx_validate_rmsd_angle.auth_seq_id_3 
_pdbx_validate_rmsd_angle.PDB_ins_code_3 
_pdbx_validate_rmsd_angle.label_alt_id_3 
_pdbx_validate_rmsd_angle.angle_value 
_pdbx_validate_rmsd_angle.angle_target_value 
_pdbx_validate_rmsd_angle.angle_deviation 
_pdbx_validate_rmsd_angle.angle_standard_deviation 
_pdbx_validate_rmsd_angle.linker_flag 
1  1 CA A VAL 5  ? ? CB  A VAL 5  ? ? CG2 A VAL 5  ? ? 98.45  110.90 -12.45 1.50 N 
2  1 NE A ARG 11 ? ? CZ  A ARG 11 ? ? NH1 A ARG 11 ? ? 116.84 120.30 -3.46  0.50 N 
3  1 CA A VAL 13 ? ? CB  A VAL 13 ? ? CG1 A VAL 13 ? ? 120.57 110.90 9.67   1.50 N 
4  1 CB A PHE 24 ? ? CG  A PHE 24 ? ? CD1 A PHE 24 ? ? 115.09 120.80 -5.71  0.70 N 
5  1 NE A ARG 33 ? ? CZ  A ARG 33 ? ? NH1 A ARG 33 ? ? 123.47 120.30 3.17   0.50 N 
6  1 CB A TYR 34 ? ? CG  A TYR 34 ? ? CD2 A TYR 34 ? ? 112.64 121.00 -8.36  0.60 N 
7  1 CB A TYR 34 ? ? CG  A TYR 34 ? ? CD1 A TYR 34 ? ? 126.10 121.00 5.10   0.60 N 
8  1 NE A ARG 35 ? ? CZ  A ARG 35 ? ? NH2 A ARG 35 ? ? 116.80 120.30 -3.50  0.50 N 
9  1 CG A TYR 44 ? ? CD2 A TYR 44 ? ? CE2 A TYR 44 ? ? 115.94 121.30 -5.36  0.80 N 
10 1 NE A ARG 50 ? ? CZ  A ARG 50 ? ? NH2 A ARG 50 ? ? 123.50 120.30 3.20   0.50 N 
11 1 CB A ASP 55 ? ? CG  A ASP 55 ? ? OD1 A ASP 55 ? ? 124.76 118.30 6.46   0.90 N 
12 1 C  A ALA 77 ? ? N   A VAL 78 ? ? CA  A VAL 78 ? ? 138.48 121.70 16.78  2.50 Y 
13 1 CB A ASP 80 ? ? CA  A ASP 80 ? ? C   A ASP 80 ? ? 122.54 110.40 12.14  2.00 N 
# 
loop_
_pdbx_validate_torsion.id 
_pdbx_validate_torsion.PDB_model_num 
_pdbx_validate_torsion.auth_comp_id 
_pdbx_validate_torsion.auth_asym_id 
_pdbx_validate_torsion.auth_seq_id 
_pdbx_validate_torsion.PDB_ins_code 
_pdbx_validate_torsion.label_alt_id 
_pdbx_validate_torsion.phi 
_pdbx_validate_torsion.psi 
1  1 MET A 21 ? ? 176.89  156.27  
2  1 VAL A 38 ? ? -148.23 -3.24   
3  1 LYS A 40 ? ? -89.41  -112.69 
4  1 ASN A 43 ? ? 179.22  116.90  
5  1 TYR A 44 ? ? 175.14  -164.72 
6  1 ILE A 46 ? ? -145.30 49.43   
7  1 ASP A 62 ? ? -146.38 -37.49  
8  1 VAL A 68 ? ? -100.87 -76.01  
9  1 ASP A 70 ? ? -94.38  -157.07 
10 1 GLU A 81 ? ? -161.67 7.25    
# 
_pdbx_validate_peptide_omega.id               1 
_pdbx_validate_peptide_omega.PDB_model_num    1 
_pdbx_validate_peptide_omega.auth_comp_id_1   PHE 
_pdbx_validate_peptide_omega.auth_asym_id_1   A 
_pdbx_validate_peptide_omega.auth_seq_id_1    79 
_pdbx_validate_peptide_omega.PDB_ins_code_1   ? 
_pdbx_validate_peptide_omega.label_alt_id_1   ? 
_pdbx_validate_peptide_omega.auth_comp_id_2   ASP 
_pdbx_validate_peptide_omega.auth_asym_id_2   A 
_pdbx_validate_peptide_omega.auth_seq_id_2    80 
_pdbx_validate_peptide_omega.PDB_ins_code_2   ? 
_pdbx_validate_peptide_omega.label_alt_id_2   ? 
_pdbx_validate_peptide_omega.omega            149.42 
# 
loop_
_pdbx_validate_main_chain_plane.id 
_pdbx_validate_main_chain_plane.PDB_model_num 
_pdbx_validate_main_chain_plane.auth_comp_id 
_pdbx_validate_main_chain_plane.auth_asym_id 
_pdbx_validate_main_chain_plane.auth_seq_id 
_pdbx_validate_main_chain_plane.PDB_ins_code 
_pdbx_validate_main_chain_plane.label_alt_id 
_pdbx_validate_main_chain_plane.improper_torsion_angle 
1 1 PHE A 1  ? ? -10.75 
2 1 PHE A 79 ? ? -10.34 
# 
loop_
_pdbx_validate_planes.id 
_pdbx_validate_planes.PDB_model_num 
_pdbx_validate_planes.auth_comp_id 
_pdbx_validate_planes.auth_asym_id 
_pdbx_validate_planes.auth_seq_id 
_pdbx_validate_planes.PDB_ins_code 
_pdbx_validate_planes.label_alt_id 
_pdbx_validate_planes.rmsd 
_pdbx_validate_planes.type 
1 1 ARG A 20 ? ? 0.133 'SIDE CHAIN' 
2 1 PHE A 24 ? ? 0.090 'SIDE CHAIN' 
3 1 TYR A 34 ? ? 0.104 'SIDE CHAIN' 
4 1 TYR A 44 ? ? 0.160 'SIDE CHAIN' 
5 1 ARG A 50 ? ? 0.080 'SIDE CHAIN' 
6 1 ARG A 74 ? ? 0.082 'SIDE CHAIN' 
# 
_em_ctf_correction.id        1 
_em_ctf_correction.details   'INDIVIDUAL MICROGRAPHS' 
_em_ctf_correction.type      ? 
# 
_em_image_processing.id                   1 
_em_image_processing.image_recording_id   1 
_em_image_processing.details              ? 
# 
_em_image_recording.details                       ? 
_em_image_recording.id                            1 
_em_image_recording.avg_electron_dose_per_image   20 
_em_image_recording.film_or_detector_model        'GATAN ULTRASCAN 4000 (4k x 4k)' 
_em_image_recording.imaging_id                    1 
_em_image_recording.detector_mode                 ? 
_em_image_recording.average_exposure_time         ? 
_em_image_recording.num_diffraction_images        ? 
_em_image_recording.num_grids_imaged              ? 
_em_image_recording.num_real_images               ? 
# 
loop_
_em_software.id 
_em_software.name 
_em_software.version 
_em_software.category 
_em_software.details 
_em_software.image_processing_id 
_em_software.imaging_id 
_em_software.fitting_id 
1 NAMD   2 'MODEL FITTING' ? ? ? 1 
2 VMD    ? 'MODEL FITTING' ? ? ? 1 
3 IMAGIC ? RECONSTRUCTION  ? 1 ? ? 
# 
_em_specimen.experiment_id           1 
_em_specimen.id                      1 
_em_specimen.concentration           2 
_em_specimen.vitrification_applied   YES 
_em_specimen.staining_applied        NO 
_em_specimen.embedding_applied       NO 
_em_specimen.shadowing_applied       NO 
_em_specimen.details                 ? 
#