data_1V7H
# 
_entry.id   1V7H 
# 
_audit_conform.dict_name       mmcif_pdbx.dic 
_audit_conform.dict_version    4.037 
_audit_conform.dict_location   http://mmcif.pdb.org/dictionaries/ascii/mmcif_pdbx.dic 
# 
loop_
_database_2.database_id 
_database_2.database_code 
PDB  1V7H       
RCSB RCSB006302 
# 
loop_
_database_PDB_rev.num 
_database_PDB_rev.date 
_database_PDB_rev.date_original 
_database_PDB_rev.status 
_database_PDB_rev.replaces 
_database_PDB_rev.mod_type 
1 2004-08-03 2003-12-17 ? 1V7H 0 
2 2004-12-21 ?          ? 1V7H 1 
3 2009-02-24 ?          ? 1V7H 1 
4 2013-12-25 ?          ? 1V7H 1 
# 
loop_
_database_PDB_rev_record.rev_num 
_database_PDB_rev_record.type 
_database_PDB_rev_record.details 
2 JRNL   ? 
3 VERSN  ? 
4 REMARK ? 
4 VERSN  ? 
# 
loop_
_pdbx_database_related.db_name 
_pdbx_database_related.db_id 
_pdbx_database_related.details 
_pdbx_database_related.content_type 
PDB 1CAG 'Similar sequence'                                                             unspecified 
PDB 1V4F 'The same sequence and measured temperature with different chain length'       unspecified 
PDB 1V6Q 'The peptide with the same sequence and different chain length measured at RT' unspecified 
# 
_pdbx_database_status.status_code                    REL 
_pdbx_database_status.entry_id                       1V7H 
_pdbx_database_status.deposit_site                   PDBJ 
_pdbx_database_status.process_site                   PDBJ 
_pdbx_database_status.SG_entry                       . 
_pdbx_database_status.status_code_cs                 ? 
_pdbx_database_status.methods_development_category   ? 
# 
loop_
_audit_author.name 
_audit_author.pdbx_ordinal 
'Okuyama, K.'   1 
'Hongo, C.'     2 
'Fukushima, R.' 3 
'Wu, G.'        4 
'Narita, H.'    5 
'Noguchi, K.'   6 
'Tanaka, Y.'    7 
'Nishino, N.'   8 
# 
_citation.id                        primary 
_citation.title                     
;Crystal structures of collagen model peptides with Pro-Hyp-Gly repeating sequence at 1.26 A resolution: implications for proline ring puckering
;
_citation.journal_abbrev            Biopolymers 
_citation.journal_volume            76 
_citation.page_first                367 
_citation.page_last                 377 
_citation.year                      2004 
_citation.journal_id_ASTM           BIPMAA 
_citation.country                   US 
_citation.journal_id_ISSN           0006-3525 
_citation.journal_id_CSD            0161 
_citation.book_publisher            ? 
_citation.pdbx_database_id_PubMed   15386273 
_citation.pdbx_database_id_DOI      10.1002/bip.20107 
# 
loop_
_citation_author.citation_id 
_citation_author.name 
_citation_author.ordinal 
primary 'Okuyama, K.'   1 
primary 'Hongo, C.'     2 
primary 'Fukushima, R.' 3 
primary 'Wu, G.'        4 
primary 'Narita, H.'    5 
primary 'Noguchi, K.'   6 
primary 'Tanaka, Y.'    7 
primary 'Nishino, N.'   8 
# 
_cell.entry_id           1V7H 
_cell.length_a           13.892 
_cell.length_b           26.115 
_cell.length_c           19.954 
_cell.angle_alpha        90.00 
_cell.angle_beta         105.95 
_cell.angle_gamma        90.00 
_cell.Z_PDB              2 
_cell.pdbx_unique_axis   ? 
_cell.length_a_esd       ? 
_cell.length_b_esd       ? 
_cell.length_c_esd       ? 
_cell.angle_alpha_esd    ? 
_cell.angle_beta_esd     ? 
_cell.angle_gamma_esd    ? 
# 
_symmetry.entry_id                         1V7H 
_symmetry.space_group_name_H-M             'P 1 21 1' 
_symmetry.pdbx_full_space_group_name_H-M   ? 
_symmetry.cell_setting                     ? 
_symmetry.Int_Tables_number                ? 
_symmetry.space_group_name_Hall            ? 
# 
loop_
_entity.id 
_entity.type 
_entity.src_method 
_entity.pdbx_description 
_entity.formula_weight 
_entity.pdbx_number_of_molecules 
_entity.details 
1 polymer syn 'Collagen like peptide' 609.635 1  ? 
2 polymer syn 'Collagen like peptide' 665.699 1  ? 
3 polymer syn 'Collagen like peptide' 649.700 1  ? 
4 water   nat water                   18.015  49 ? 
# 
loop_
_entity_poly.entity_id 
_entity_poly.type 
_entity_poly.nstd_linkage 
_entity_poly.nstd_monomer 
_entity_poly.pdbx_seq_one_letter_code 
_entity_poly.pdbx_seq_one_letter_code_can 
_entity_poly.pdbx_strand_id 
1 'polypeptide(L)' no yes 'GP(HYP)GP(HYP)G'     GPPGPPG A 
2 'polypeptide(L)' no yes '(HYP)GP(HYP)GP(HYP)' PGPPGPP B 
3 'polypeptide(L)' no yes 'P(HYP)GP(HYP)GP'     PPGPPGP C 
# 
loop_
_entity_poly_seq.entity_id 
_entity_poly_seq.num 
_entity_poly_seq.mon_id 
_entity_poly_seq.hetero 
1 1 GLY n 
1 2 PRO n 
1 3 HYP n 
1 4 GLY n 
1 5 PRO n 
1 6 HYP n 
1 7 GLY n 
2 1 HYP n 
2 2 GLY n 
2 3 PRO n 
2 4 HYP n 
2 5 GLY n 
2 6 PRO n 
2 7 HYP n 
3 1 PRO n 
3 2 HYP n 
3 3 GLY n 
3 4 PRO n 
3 5 HYP n 
3 6 GLY n 
3 7 PRO n 
# 
loop_
_pdbx_entity_src_syn.entity_id 
_pdbx_entity_src_syn.organism_scientific 
_pdbx_entity_src_syn.organism_common_name 
_pdbx_entity_src_syn.ncbi_taxonomy_id 
_pdbx_entity_src_syn.details 
1 ? ? ? 'Pro-Hyp-Gly triplet is very popular in collagen sequence' 
2 ? ? ? 'Pro-Hyp-Gly triplet is very popular in collagen sequence' 
3 ? ? ? 'Pro-Hyp-Gly triplet is very popular in collagen sequence' 
# 
loop_
_struct_ref.id 
_struct_ref.entity_id 
_struct_ref.db_name 
_struct_ref.db_code 
_struct_ref.pdbx_db_accession 
_struct_ref.biol_id 
_struct_ref.pdbx_align_begin 
_struct_ref.pdbx_seq_one_letter_code 
1 1 PDB 1V7H 1V7H . ? ? 
2 2 PDB 1V7H 1V7H . ? ? 
3 3 PDB 1V7H 1V7H . ? ? 
# 
loop_
_struct_ref_seq.align_id 
_struct_ref_seq.ref_id 
_struct_ref_seq.pdbx_PDB_id_code 
_struct_ref_seq.pdbx_strand_id 
_struct_ref_seq.seq_align_beg 
_struct_ref_seq.pdbx_seq_align_beg_ins_code 
_struct_ref_seq.seq_align_end 
_struct_ref_seq.pdbx_seq_align_end_ins_code 
_struct_ref_seq.pdbx_db_accession 
_struct_ref_seq.db_align_beg 
_struct_ref_seq.db_align_end 
_struct_ref_seq.pdbx_auth_seq_align_beg 
_struct_ref_seq.pdbx_auth_seq_align_end 
1 1 1V7H A 1 ? 7 ? 1V7H 1 7 1 7 
2 2 1V7H B 1 ? 7 ? 1V7H 1 7 1 7 
3 3 1V7H C 1 ? 7 ? 1V7H 1 7 1 7 
# 
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 
GLY 'PEPTIDE LINKING'   y GLYCINE          ?              'C2 H5 N O2' 75.067  
PRO 'L-peptide linking' y PROLINE          ?              'C5 H9 N O2' 115.132 
HYP 'L-peptide linking' n 4-HYDROXYPROLINE HYDROXYPROLINE 'C5 H9 N O3' 131.131 
HOH NON-POLYMER         . WATER            ?              'H2 O'       18.015  
# 
_exptl.entry_id          1V7H 
_exptl.method            'X-RAY DIFFRACTION' 
_exptl.crystals_number   1 
# 
_exptl_crystal.id                    1 
_exptl_crystal.density_meas          ? 
_exptl_crystal.density_Matthews      1.81 
_exptl_crystal.density_percent_sol   31.96 
_exptl_crystal.description           ? 
_exptl_crystal.F_000                 ? 
_exptl_crystal.preparation           ? 
# 
_exptl_crystal_grow.crystal_id      1 
_exptl_crystal_grow.method          'VAPOR DIFFUSION, HANGING DROP' 
_exptl_crystal_grow.temp            283 
_exptl_crystal_grow.temp_details    ? 
_exptl_crystal_grow.pH              ? 
_exptl_crystal_grow.pdbx_details    'PEG200, ACETIC ACID, VAPOR DIFFUSION, HANGING DROP, temperature 283K' 
_exptl_crystal_grow.pdbx_pH_range   . 
# 
_diffrn.id                     1 
_diffrn.ambient_temp           100 
_diffrn.ambient_temp_details   ? 
_diffrn.crystal_id             1 
# 
_diffrn_detector.diffrn_id              1 
_diffrn_detector.detector               CCD 
_diffrn_detector.type                   'OXFORD PX210' 
_diffrn_detector.pdbx_collection_date   2002-06-11 
_diffrn_detector.details                MIRROR-MONOCHROMATOR 
# 
_diffrn_radiation.diffrn_id                        1 
_diffrn_radiation.wavelength_id                    1 
_diffrn_radiation.pdbx_monochromatic_or_laue_m_l   M 
_diffrn_radiation.monochromator                    ? 
_diffrn_radiation.pdbx_diffrn_protocol             'SINGLE WAVELENGTH' 
_diffrn_radiation.pdbx_scattering_type             x-ray 
# 
_diffrn_radiation_wavelength.id           1 
_diffrn_radiation_wavelength.wavelength   0.9 
_diffrn_radiation_wavelength.wt           1.0 
# 
_diffrn_source.diffrn_id                   1 
_diffrn_source.source                      SYNCHROTRON 
_diffrn_source.type                        'SPRING-8 BEAMLINE BL44XU' 
_diffrn_source.pdbx_synchrotron_site       SPRING-8 
_diffrn_source.pdbx_synchrotron_beamline   BL44XU 
_diffrn_source.pdbx_wavelength             ? 
_diffrn_source.pdbx_wavelength_list        0.9 
# 
_reflns.entry_id                     1V7H 
_reflns.observed_criterion_sigma_I   ? 
_reflns.observed_criterion_sigma_F   1.0 
_reflns.d_resolution_low             20.0 
_reflns.d_resolution_high            1.24 
_reflns.number_obs                   3257 
_reflns.number_all                   ? 
_reflns.percent_possible_obs         ? 
_reflns.pdbx_Rmerge_I_obs            0.042 
_reflns.pdbx_Rsym_value              ? 
_reflns.pdbx_netI_over_sigmaI        ? 
_reflns.B_iso_Wilson_estimate        ? 
_reflns.pdbx_redundancy              ? 
_reflns.R_free_details               ? 
_reflns.limit_h_max                  ? 
_reflns.limit_h_min                  ? 
_reflns.limit_k_max                  ? 
_reflns.limit_k_min                  ? 
_reflns.limit_l_max                  ? 
_reflns.limit_l_min                  ? 
_reflns.observed_criterion_F_max     ? 
_reflns.observed_criterion_F_min     ? 
_reflns.pdbx_chi_squared             ? 
_reflns.pdbx_scaling_rejects         ? 
_reflns.pdbx_ordinal                 1 
_reflns.pdbx_diffrn_id               1 
# 
_reflns_shell.d_res_high             1.24 
_reflns_shell.d_res_low              1.28 
_reflns_shell.percent_possible_all   74 
_reflns_shell.Rmerge_I_obs           0.057 
_reflns_shell.pdbx_Rsym_value        ? 
_reflns_shell.meanI_over_sigI_obs    8.2 
_reflns_shell.pdbx_redundancy        ? 
_reflns_shell.percent_possible_obs   ? 
_reflns_shell.number_unique_all      290 
_reflns_shell.number_measured_all    ? 
_reflns_shell.number_measured_obs    ? 
_reflns_shell.number_unique_obs      ? 
_reflns_shell.pdbx_chi_squared       ? 
_reflns_shell.pdbx_ordinal           1 
_reflns_shell.pdbx_diffrn_id         1 
# 
_computing.entry_id                           1V7H 
_computing.pdbx_data_reduction_ii             CRYSTALCLEAR 
_computing.pdbx_data_reduction_ds             'CRYSTALCLEAR (MSC/RIGAKU)' 
_computing.data_collection                    ? 
_computing.structure_solution                 SHELXS 
_computing.structure_refinement               SHELXL-97 
_computing.pdbx_structure_refinement_method   ? 
# 
_refine.entry_id                               1V7H 
_refine.ls_number_reflns_obs                   3173 
_refine.ls_number_reflns_all                   3176 
_refine.pdbx_ls_sigma_I                        ? 
_refine.pdbx_ls_sigma_F                        4.0 
_refine.pdbx_data_cutoff_high_absF             ? 
_refine.pdbx_data_cutoff_low_absF              ? 
_refine.pdbx_data_cutoff_high_rms_absF         ? 
_refine.ls_d_res_low                           10.00 
_refine.ls_d_res_high                          1.25 
_refine.ls_percent_reflns_obs                  78.2 
_refine.ls_R_factor_obs                        ? 
_refine.ls_R_factor_all                        ? 
_refine.ls_R_factor_R_work                     0.1271 
_refine.ls_R_factor_R_free                     0.1828 
_refine.ls_R_factor_R_free_error               ? 
_refine.ls_R_factor_R_free_error_details       ? 
_refine.ls_percent_reflns_R_free               4.7 
_refine.ls_number_reflns_R_free                158 
_refine.ls_number_parameters                   1396 
_refine.ls_number_restraints                   1695 
_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             throughout 
_refine.details                                ? 
_refine.pdbx_starting_model                    
'(PRO-HYP-GLY)10 structure reported in V.NAGARAJAN, S.KAMITORI, K.OKUYAMA, J.BIOCHEM.,125, 310 (1999).' 
_refine.pdbx_method_to_determine_struct        'MOLECULAR REPLACEMENT' 
_refine.pdbx_isotropic_thermal_model           ? 
_refine.pdbx_stereochemistry_target_values     'Engh & Huber' 
_refine.pdbx_stereochem_target_val_spec_case   ? 
_refine.pdbx_R_Free_selection_details          RANDOM 
_refine.pdbx_overall_ESU_R                     ? 
_refine.pdbx_overall_ESU_R_Free                ? 
_refine.overall_SU_ML                          ? 
_refine.overall_SU_B                           ? 
_refine.ls_redundancy_reflns_obs               ? 
_refine.B_iso_min                              ? 
_refine.B_iso_max                              ? 
_refine.overall_SU_R_Cruickshank_DPI           ? 
_refine.overall_SU_R_free                      ? 
_refine.ls_wR_factor_R_free                    ? 
_refine.ls_wR_factor_R_work                    ? 
_refine.overall_FOM_free_R_set                 ? 
_refine.overall_FOM_work_R_set                 ? 
_refine.pdbx_refine_id                         'X-RAY DIFFRACTION' 
_refine.pdbx_overall_phase_error               ? 
_refine.pdbx_diffrn_id                         1 
# 
_refine_analyze.entry_id                        1V7H 
_refine_analyze.Luzzati_coordinate_error_obs    ? 
_refine_analyze.Luzzati_sigma_a_obs             ? 
_refine_analyze.Luzzati_d_res_low_obs           ? 
_refine_analyze.Luzzati_coordinate_error_free   ? 
_refine_analyze.Luzzati_sigma_a_free            ? 
_refine_analyze.Luzzati_d_res_low_free          ? 
_refine_analyze.number_disordered_residues      0 
_refine_analyze.occupancy_sum_hydrogen          112.00 
_refine_analyze.occupancy_sum_non_hydrogen      182.00 
_refine_analyze.pdbx_refine_id                  'X-RAY DIFFRACTION' 
# 
_refine_hist.pdbx_refine_id                   'X-RAY DIFFRACTION' 
_refine_hist.cycle_id                         LAST 
_refine_hist.pdbx_number_atoms_protein        133 
_refine_hist.pdbx_number_atoms_nucleic_acid   0 
_refine_hist.pdbx_number_atoms_ligand         0 
_refine_hist.number_atoms_solvent             49 
_refine_hist.number_atoms_total               182 
_refine_hist.d_res_high                       1.25 
_refine_hist.d_res_low                        10.00 
# 
loop_
_refine_ls_restr.type 
_refine_ls_restr.dev_ideal 
_refine_ls_restr.dev_ideal_target 
_refine_ls_restr.weight 
_refine_ls_restr.number 
_refine_ls_restr.pdbx_refine_id 
_refine_ls_restr.pdbx_restraint_function 
s_bond_d               0.016  ? ? ? 'X-RAY DIFFRACTION' ? 
s_angle_d              0.026  ? ? ? 'X-RAY DIFFRACTION' ? 
s_similar_dist         0.000  ? ? ? 'X-RAY DIFFRACTION' ? 
s_from_restr_planes    0.0368 ? ? ? 'X-RAY DIFFRACTION' ? 
s_zero_chiral_vol      0.106  ? ? ? 'X-RAY DIFFRACTION' ? 
s_non_zero_chiral_vol  0.029  ? ? ? 'X-RAY DIFFRACTION' ? 
s_anti_bump_dis_restr  0.000  ? ? ? 'X-RAY DIFFRACTION' ? 
s_rigid_bond_adp_cmpnt 0.006  ? ? ? 'X-RAY DIFFRACTION' ? 
s_similar_adp_cmpnt    0.031  ? ? ? 'X-RAY DIFFRACTION' ? 
s_approx_iso_adps      0.000  ? ? ? 'X-RAY DIFFRACTION' ? 
# 
_refine_ls_shell.pdbx_total_number_of_bins_used   ? 
_refine_ls_shell.d_res_high                       1.25 
_refine_ls_shell.d_res_low                        1.30 
_refine_ls_shell.number_reflns_R_work             ? 
_refine_ls_shell.R_factor_R_work                  0.126 
_refine_ls_shell.percent_reflns_obs               ? 
_refine_ls_shell.R_factor_R_free                  ? 
_refine_ls_shell.R_factor_R_free_error            ? 
_refine_ls_shell.percent_reflns_R_free            ? 
_refine_ls_shell.number_reflns_R_free             ? 
_refine_ls_shell.number_reflns_obs                315 
_refine_ls_shell.redundancy_reflns_obs            ? 
_refine_ls_shell.number_reflns_all                ? 
_refine_ls_shell.pdbx_refine_id                   'X-RAY DIFFRACTION' 
_refine_ls_shell.R_factor_all                     ? 
# 
_pdbx_refine.entry_id                                    1V7H 
_pdbx_refine.R_factor_all_no_cutoff                      0.1653 
_pdbx_refine.R_factor_obs_no_cutoff                      0.1271 
_pdbx_refine.free_R_factor_no_cutoff                     0.2296 
_pdbx_refine.free_R_val_test_set_size_perc_no_cutoff     4.7 
_pdbx_refine.free_R_val_test_set_ct_no_cutoff            142 
_pdbx_refine.R_factor_all_4sig_cutoff                    0.1652 
_pdbx_refine.R_factor_obs_4sig_cutoff                    0.1271 
_pdbx_refine.free_R_factor_4sig_cutoff                   0.2296 
_pdbx_refine.free_R_val_test_set_size_perc_4sig_cutoff   4.7 
_pdbx_refine.free_R_val_test_set_ct_4sig_cutoff          142 
_pdbx_refine.number_reflns_obs_4sig_cutoff               3015 
_pdbx_refine.number_reflns_obs_no_cutoff                 ? 
_pdbx_refine.pdbx_refine_id                              'X-RAY DIFFRACTION' 
# 
_struct.entry_id                  1V7H 
_struct.title                     'Crystal Structures of Collagen Model Peptides with Pro-Hyp-Gly Sequence at 1.26 A' 
_struct.pdbx_descriptor           'Collagen like peptide' 
_struct.pdbx_model_details        ? 
_struct.pdbx_CASP_flag            ? 
_struct.pdbx_model_type_details   ? 
# 
_struct_keywords.entry_id        1V7H 
_struct_keywords.pdbx_keywords   'STRUCTURAL PROTEIN' 
_struct_keywords.text            'Collagen, Triple-helix, Model peptide, STRUCTURAL PROTEIN' 
# 
loop_
_struct_asym.id 
_struct_asym.pdbx_blank_PDB_chainid_flag 
_struct_asym.pdbx_modified 
_struct_asym.entity_id 
_struct_asym.details 
A N N 1 ? 
B N N 2 ? 
C N N 3 ? 
D N N 4 ? 
E N N 4 ? 
F N N 4 ? 
# 
_struct_biol.id                    1 
_struct_biol.pdbx_parent_biol_id   ? 
_struct_biol.details               
;THE ENTIRE 30 RESIDUE LONG PEPTIDE CAN BE GENERATED FROM         
THE SUBMITTED ASYMMETRIC UNIT BY APPLYING THE FOLLOWING              
TRANSLATIONS (USING FRACTIONAL COORDINATES):                         

CHAIN A: TRANSLATE RESIDUES 2 - 7 BY (001), AND 
         RESIDUES 1-7 BY (002),(003),(004), AND 
         RESIDUES 1-4 BY (005) 
CHAIN B: TRANSLATE RESIDUES 3 - 7 BY (001), AND 
         RESIDUES 1-7 BY (002),(003),(004) AND 
         RESIDUE 1-2 BY (005).          
CHAIN C: TRANSLATE RESIDUES 1 - 7 BY (001),(002),(003),(004), 
         AND RESIDUES 1-3 BY (005).                       
THIS WILL RESULT IN A MOLECULE WITH A TOTAL OF 90 RESIDUES, 
         30 IN EACH CHAIN.
;
# 
loop_
_struct_conn.id 
_struct_conn.conn_type_id 
_struct_conn.pdbx_PDB_id 
_struct_conn.ptnr1_label_asym_id 
_struct_conn.ptnr1_label_comp_id 
_struct_conn.ptnr1_label_seq_id 
_struct_conn.ptnr1_label_atom_id 
_struct_conn.pdbx_ptnr1_label_alt_id 
_struct_conn.pdbx_ptnr1_PDB_ins_code 
_struct_conn.pdbx_ptnr1_standard_comp_id 
_struct_conn.ptnr1_symmetry 
_struct_conn.ptnr2_label_asym_id 
_struct_conn.ptnr2_label_comp_id 
_struct_conn.ptnr2_label_seq_id 
_struct_conn.ptnr2_label_atom_id 
_struct_conn.pdbx_ptnr2_label_alt_id 
_struct_conn.pdbx_ptnr2_PDB_ins_code 
_struct_conn.ptnr1_auth_asym_id 
_struct_conn.ptnr1_auth_comp_id 
_struct_conn.ptnr1_auth_seq_id 
_struct_conn.ptnr2_auth_asym_id 
_struct_conn.ptnr2_auth_comp_id 
_struct_conn.ptnr2_auth_seq_id 
_struct_conn.ptnr2_symmetry 
_struct_conn.pdbx_ptnr3_label_atom_id 
_struct_conn.pdbx_ptnr3_label_seq_id 
_struct_conn.pdbx_ptnr3_label_comp_id 
_struct_conn.pdbx_ptnr3_label_asym_id 
_struct_conn.pdbx_ptnr3_label_alt_id 
_struct_conn.pdbx_ptnr3_PDB_ins_code 
_struct_conn.details 
_struct_conn.pdbx_dist_value 
_struct_conn.pdbx_value_order 
covale1  covale ? A PRO 2 C ? ? ? 1_555 A HYP 3 N ? ? A PRO 2 A HYP 3 1_555 ? ? ? ? ? ? ? 1.323 ? 
covale2  covale ? A HYP 3 C ? ? ? 1_555 A GLY 4 N ? ? A HYP 3 A GLY 4 1_555 ? ? ? ? ? ? ? 1.331 ? 
covale3  covale ? A PRO 5 C ? ? ? 1_555 A HYP 6 N ? ? A PRO 5 A HYP 6 1_555 ? ? ? ? ? ? ? 1.337 ? 
covale4  covale ? A HYP 6 C ? ? ? 1_555 A GLY 7 N ? ? A HYP 6 A GLY 7 1_555 ? ? ? ? ? ? ? 1.338 ? 
covale5  covale ? B HYP 1 C ? ? ? 1_555 B GLY 2 N ? ? B HYP 1 B GLY 2 1_555 ? ? ? ? ? ? ? 1.323 ? 
covale6  covale ? B PRO 3 C ? ? ? 1_555 B HYP 4 N ? ? B PRO 3 B HYP 4 1_555 ? ? ? ? ? ? ? 1.334 ? 
covale7  covale ? B HYP 4 C ? ? ? 1_555 B GLY 5 N ? ? B HYP 4 B GLY 5 1_555 ? ? ? ? ? ? ? 1.335 ? 
covale8  covale ? B PRO 6 C ? ? ? 1_555 B HYP 7 N ? ? B PRO 6 B HYP 7 1_555 ? ? ? ? ? ? ? 1.314 ? 
covale9  covale ? C PRO 1 C ? ? ? 1_555 C HYP 2 N ? ? C PRO 1 C HYP 2 1_555 ? ? ? ? ? ? ? 1.338 ? 
covale10 covale ? C HYP 2 C ? ? ? 1_555 C GLY 3 N ? ? C HYP 2 C GLY 3 1_555 ? ? ? ? ? ? ? 1.317 ? 
covale11 covale ? C PRO 4 C ? ? ? 1_555 C HYP 5 N ? ? C PRO 4 C HYP 5 1_555 ? ? ? ? ? ? ? 1.350 ? 
covale12 covale ? C HYP 5 C ? ? ? 1_555 C GLY 6 N ? ? C HYP 5 C GLY 6 1_555 ? ? ? ? ? ? ? 1.319 ? 
covale13 covale ? B HYP 7 C ? ? ? 1_555 A GLY 1 N ? ? B HYP 7 A GLY 1 1_556 ? ? ? ? ? ? ? 1.332 ? 
covale14 covale ? C PRO 7 C ? ? ? 1_554 B HYP 1 N ? ? C PRO 7 B HYP 1 1_555 ? ? ? ? ? ? ? 1.329 ? 
# 
_struct_conn_type.id          covale 
_struct_conn_type.criteria    ? 
_struct_conn_type.reference   ? 
# 
_database_PDB_matrix.entry_id          1V7H 
_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]   0.000000 
_database_PDB_matrix.origx_vector[2]   0.000000 
_database_PDB_matrix.origx_vector[3]   0.000000 
# 
_atom_sites.entry_id                    1V7H 
_atom_sites.Cartn_transform_axes        ? 
_atom_sites.fract_transf_matrix[1][1]   0.071983 
_atom_sites.fract_transf_matrix[1][2]   0.000000 
_atom_sites.fract_transf_matrix[1][3]   0.020578 
_atom_sites.fract_transf_matrix[2][1]   0.000000 
_atom_sites.fract_transf_matrix[2][2]   0.038292 
_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]   0.052123 
_atom_sites.fract_transf_vector[1]      0.000000 
_atom_sites.fract_transf_vector[2]      0.000000 
_atom_sites.fract_transf_vector[3]      0.000000 
# 
loop_
_atom_type.symbol 
C 
N 
O 
# 
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.Cartn_x_esd 
_atom_site.Cartn_y_esd 
_atom_site.Cartn_z_esd 
_atom_site.occupancy_esd 
_atom_site.B_iso_or_equiv_esd 
_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   . GLY A 1 1 ? 4.954  -0.924 -5.684 1.00 4.90  ? ? ? ? ? ? 1  GLY A N   1 
ATOM   2   C CA  . GLY A 1 1 ? 5.427  0.193  -4.880 1.00 4.21  ? ? ? ? ? ? 1  GLY A CA  1 
ATOM   3   C C   . GLY A 1 1 ? 5.873  -0.251 -3.503 1.00 4.62  ? ? ? ? ? ? 1  GLY A C   1 
ATOM   4   O O   . GLY A 1 1 ? 5.756  -1.417 -3.054 1.00 5.04  ? ? ? ? ? ? 1  GLY A O   1 
ATOM   5   N N   . PRO A 1 2 ? 6.388  0.747  -2.766 1.00 5.10  ? ? ? ? ? ? 2  PRO A N   1 
ATOM   6   C CA  . PRO A 1 2 ? 6.812  0.513  -1.379 1.00 4.62  ? ? ? ? ? ? 2  PRO A CA  1 
ATOM   7   C C   . PRO A 1 2 ? 5.655  0.132  -0.479 1.00 4.24  ? ? ? ? ? ? 2  PRO A C   1 
ATOM   8   O O   . PRO A 1 2 ? 4.485  0.388  -0.757 1.00 5.07  ? ? ? ? ? ? 2  PRO A O   1 
ATOM   9   C CB  . PRO A 1 2 ? 7.376  1.875  -0.954 1.00 8.72  ? ? ? ? ? ? 2  PRO A CB  1 
ATOM   10  C CG  . PRO A 1 2 ? 7.496  2.711  -2.172 1.00 9.40  ? ? ? ? ? ? 2  PRO A CG  1 
ATOM   11  C CD  . PRO A 1 2 ? 6.633  2.133  -3.238 1.00 6.68  ? ? ? ? ? ? 2  PRO A CD  1 
ATOM   12  N N   . HYP A 1 3 ? 5.936  -0.488 0.655  1.00 4.40  ? ? ? ? ? ? 3  HYP A N   1 
ATOM   13  C CA  . HYP A 1 3 ? 4.891  -0.712 1.678  1.00 4.51  ? ? ? ? ? ? 3  HYP A CA  1 
ATOM   14  C C   . HYP A 1 3 ? 4.219  0.587  2.124  1.00 2.60  ? ? ? ? ? ? 3  HYP A C   1 
ATOM   15  O O   . HYP A 1 3 ? 4.822  1.645  2.151  1.00 4.61  ? ? ? ? ? ? 3  HYP A O   1 
ATOM   16  C CB  . HYP A 1 3 ? 5.698  -1.296 2.839  1.00 6.35  ? ? ? ? ? ? 3  HYP A CB  1 
ATOM   17  C CG  . HYP A 1 3 ? 6.862  -1.970 2.196  1.00 6.31  ? ? ? ? ? ? 3  HYP A CG  1 
ATOM   18  C CD  . HYP A 1 3 ? 7.203  -1.039 1.065  1.00 5.51  ? ? ? ? ? ? 3  HYP A CD  1 
ATOM   19  O OD1 . HYP A 1 3 ? 6.505  -3.219 1.609  1.00 7.13  ? ? ? ? ? ? 3  HYP A OD1 1 
ATOM   20  N N   . GLY A 1 4 ? 2.937  0.413  2.437  1.00 3.94  ? ? ? ? ? ? 4  GLY A N   1 
ATOM   21  C CA  . GLY A 1 4 ? 2.239  1.546  3.034  1.00 3.55  ? ? ? ? ? ? 4  GLY A CA  1 
ATOM   22  C C   . GLY A 1 4 ? 2.757  1.851  4.440  1.00 4.94  ? ? ? ? ? ? 4  GLY A C   1 
ATOM   23  O O   . GLY A 1 4 ? 3.556  1.145  5.073  1.00 5.45  ? ? ? ? ? ? 4  GLY A O   1 
ATOM   24  N N   . PRO A 1 5 ? 2.297  3.007  4.954  1.00 5.52  ? ? ? ? ? ? 5  PRO A N   1 
ATOM   25  C CA  . PRO A 1 5 ? 2.594  3.394  6.329  1.00 5.92  ? ? ? ? ? ? 5  PRO A CA  1 
ATOM   26  C C   . PRO A 1 5 ? 2.139  2.381  7.388  1.00 3.77  ? ? ? ? ? ? 5  PRO A C   1 
ATOM   27  O O   . PRO A 1 5 ? 1.103  1.701  7.150  1.00 5.17  ? ? ? ? ? ? 5  PRO A O   1 
ATOM   28  C CB  . PRO A 1 5 ? 1.765  4.697  6.523  1.00 7.16  ? ? ? ? ? ? 5  PRO A CB  1 
ATOM   29  C CG  . PRO A 1 5 ? 1.570  5.215  5.152  1.00 7.48  ? ? ? ? ? ? 5  PRO A CG  1 
ATOM   30  C CD  . PRO A 1 5 ? 1.450  4.012  4.288  1.00 6.46  ? ? ? ? ? ? 5  PRO A CD  1 
ATOM   31  N N   . HYP A 1 6 ? 2.830  2.364  8.532  1.00 5.48  ? ? ? ? ? ? 6  HYP A N   1 
ATOM   32  C CA  . HYP A 1 6 ? 2.256  1.625  9.676  1.00 5.93  ? ? ? ? ? ? 6  HYP A CA  1 
ATOM   33  C C   . HYP A 1 6 ? 0.853  2.118  9.986  1.00 6.38  ? ? ? ? ? ? 6  HYP A C   1 
ATOM   34  O O   . HYP A 1 6 ? 0.529  3.272  9.773  1.00 5.72  ? ? ? ? ? ? 6  HYP A O   1 
ATOM   35  C CB  . HYP A 1 6 ? 3.210  1.964  10.821 1.00 10.24 ? ? ? ? ? ? 6  HYP A CB  1 
ATOM   36  C CG  . HYP A 1 6 ? 4.499  2.325  10.170 1.00 10.36 ? ? ? ? ? ? 6  HYP A CG  1 
ATOM   37  C CD  . HYP A 1 6 ? 4.105  3.028  8.896  1.00 7.25  ? ? ? ? ? ? 6  HYP A CD  1 
ATOM   38  O OD1 . HYP A 1 6 ? 5.261  1.207  9.916  1.00 16.44 ? ? ? ? ? ? 6  HYP A OD1 1 
ATOM   39  N N   . GLY A 1 7 ? -0.038 1.250  10.479 1.00 6.28  ? ? ? ? ? ? 7  GLY A N   1 
ATOM   40  C CA  . GLY A 1 7 ? -1.408 1.661  10.790 1.00 5.12  ? ? ? ? ? ? 7  GLY A CA  1 
ATOM   41  C C   . GLY A 1 7 ? -1.475 2.535  12.024 1.00 6.35  ? ? ? ? ? ? 7  GLY A C   1 
ATOM   42  O O   . GLY A 1 7 ? -0.495 2.787  12.707 1.00 7.06  ? ? ? ? ? ? 7  GLY A O   1 
ATOM   43  N N   . HYP B 2 1 ? 0.188  -1.163 -6.875 1.00 4.55  ? ? ? ? ? ? 1  HYP B N   1 
ATOM   44  C CA  . HYP B 2 1 ? 0.387  -0.662 -5.497 1.00 5.27  ? ? ? ? ? ? 1  HYP B CA  1 
ATOM   45  C C   . HYP B 2 1 ? 1.233  -1.633 -4.665 1.00 2.85  ? ? ? ? ? ? 1  HYP B C   1 
ATOM   46  O O   . HYP B 2 1 ? 1.196  -2.844 -4.834 1.00 4.25  ? ? ? ? ? ? 1  HYP B O   1 
ATOM   47  C CB  . HYP B 2 1 ? -1.044 -0.581 -4.987 1.00 6.78  ? ? ? ? ? ? 1  HYP B CB  1 
ATOM   48  C CG  . HYP B 2 1 ? -1.910 -0.430 -6.190 1.00 7.19  ? ? ? ? ? ? 1  HYP B CG  1 
ATOM   49  C CD  . HYP B 2 1 ? -1.215 -1.313 -7.223 1.00 6.37  ? ? ? ? ? ? 1  HYP B CD  1 
ATOM   50  O OD1 . HYP B 2 1 ? -1.858 0.881  -6.693 1.00 8.77  ? ? ? ? ? ? 1  HYP B OD1 1 
ATOM   51  N N   . GLY B 2 2 ? 1.916  -1.034 -3.703 1.00 3.67  ? ? ? ? ? ? 2  GLY B N   1 
ATOM   52  C CA  . GLY B 2 2 ? 2.674  -1.811 -2.757 1.00 2.95  ? ? ? ? ? ? 2  GLY B CA  1 
ATOM   53  C C   . GLY B 2 2 ? 1.796  -2.517 -1.745 1.00 4.05  ? ? ? ? ? ? 2  GLY B C   1 
ATOM   54  O O   . GLY B 2 2 ? 0.568  -2.299 -1.686 1.00 3.87  ? ? ? ? ? ? 2  GLY B O   1 
ATOM   55  N N   . PRO B 2 3 ? 2.382  -3.317 -0.856 1.00 4.98  ? ? ? ? ? ? 3  PRO B N   1 
ATOM   56  C CA  . PRO B 2 3 ? 1.596  -3.977 0.206  1.00 5.64  ? ? ? ? ? ? 3  PRO B CA  1 
ATOM   57  C C   . PRO B 2 3 ? 1.166  -3.014 1.295  1.00 4.28  ? ? ? ? ? ? 3  PRO B C   1 
ATOM   58  O O   . PRO B 2 3 ? 1.761  -1.960 1.469  1.00 4.17  ? ? ? ? ? ? 3  PRO B O   1 
ATOM   59  C CB  . PRO B 2 3 ? 2.559  -4.995 0.800  1.00 7.61  ? ? ? ? ? ? 3  PRO B CB  1 
ATOM   60  C CG  . PRO B 2 3 ? 3.884  -4.567 0.332  1.00 14.54 ? ? ? ? ? ? 3  PRO B CG  1 
ATOM   61  C CD  . PRO B 2 3 ? 3.801  -3.651 -0.838 1.00 8.02  ? ? ? ? ? ? 3  PRO B CD  1 
ATOM   62  N N   . HYP B 2 4 ? 0.152  -3.416 2.063  1.00 5.52  ? ? ? ? ? ? 4  HYP B N   1 
ATOM   63  C CA  . HYP B 2 4 ? -0.186 -2.644 3.255  1.00 4.82  ? ? ? ? ? ? 4  HYP B CA  1 
ATOM   64  C C   . HYP B 2 4 ? 0.980  -2.540 4.207  1.00 5.18  ? ? ? ? ? ? 4  HYP B C   1 
ATOM   65  O O   . HYP B 2 4 ? 1.821  -3.408 4.353  1.00 6.32  ? ? ? ? ? ? 4  HYP B O   1 
ATOM   66  C CB  . HYP B 2 4 ? -1.265 -3.487 3.932  1.00 5.57  ? ? ? ? ? ? 4  HYP B CB  1 
ATOM   67  C CG  . HYP B 2 4 ? -1.823 -4.388 2.846  1.00 5.84  ? ? ? ? ? ? 4  HYP B CG  1 
ATOM   68  C CD  . HYP B 2 4 ? -0.671 -4.635 1.929  1.00 6.21  ? ? ? ? ? ? 4  HYP B CD  1 
ATOM   69  O OD1 . HYP B 2 4 ? -2.818 -3.657 2.150  1.00 7.14  ? ? ? ? ? ? 4  HYP B OD1 1 
ATOM   70  N N   . GLY B 2 5 ? 0.907  -1.442 4.963  1.00 5.11  ? ? ? ? ? ? 5  GLY B N   1 
ATOM   71  C CA  . GLY B 2 5 ? 1.809  -1.313 6.083  1.00 5.69  ? ? ? ? ? ? 5  GLY B CA  1 
ATOM   72  C C   . GLY B 2 5 ? 1.406  -2.316 7.159  1.00 5.13  ? ? ? ? ? ? 5  GLY B C   1 
ATOM   73  O O   . GLY B 2 5 ? 0.355  -2.958 7.127  1.00 6.61  ? ? ? ? ? ? 5  GLY B O   1 
ATOM   74  N N   . PRO B 2 6 ? 2.250  -2.485 8.166  1.00 5.25  ? ? ? ? ? ? 6  PRO B N   1 
ATOM   75  C CA  . PRO B 2 6 ? 1.997  -3.381 9.305  1.00 5.55  ? ? ? ? ? ? 6  PRO B CA  1 
ATOM   76  C C   . PRO B 2 6 ? 1.025  -2.723 10.284 1.00 4.84  ? ? ? ? ? ? 6  PRO B C   1 
ATOM   77  O O   . PRO B 2 6 ? 0.709  -1.534 10.187 1.00 5.63  ? ? ? ? ? ? 6  PRO B O   1 
ATOM   78  C CB  . PRO B 2 6 ? 3.400  -3.536 9.903  1.00 7.48  ? ? ? ? ? ? 6  PRO B CB  1 
ATOM   79  C CG  . PRO B 2 6 ? 4.027  -2.193 9.651  1.00 8.76  ? ? ? ? ? ? 6  PRO B CG  1 
ATOM   80  C CD  . PRO B 2 6 ? 3.573  -1.791 8.262  1.00 7.54  ? ? ? ? ? ? 6  PRO B CD  1 
ATOM   81  N N   . HYP B 2 7 ? 0.499  -3.518 11.188 1.00 5.68  ? ? ? ? ? ? 7  HYP B N   1 
ATOM   82  C CA  . HYP B 2 7 ? -0.393 -2.974 12.204 1.00 4.08  ? ? ? ? ? ? 7  HYP B CA  1 
ATOM   83  C C   . HYP B 2 7 ? 0.273  -1.845 12.970 1.00 4.10  ? ? ? ? ? ? 7  HYP B C   1 
ATOM   84  O O   . HYP B 2 7 ? 1.501  -1.827 13.182 1.00 5.90  ? ? ? ? ? ? 7  HYP B O   1 
ATOM   85  C CB  . HYP B 2 7 ? -0.661 -4.162 13.148 1.00 4.55  ? ? ? ? ? ? 7  HYP B CB  1 
ATOM   86  C CG  . HYP B 2 7 ? -0.522 -5.330 12.229 1.00 5.83  ? ? ? ? ? ? 7  HYP B CG  1 
ATOM   87  C CD  . HYP B 2 7 ? 0.660  -4.984 11.363 1.00 6.04  ? ? ? ? ? ? 7  HYP B CD  1 
ATOM   88  O OD1 . HYP B 2 7 ? -1.686 -5.458 11.423 1.00 7.19  ? ? ? ? ? ? 7  HYP B OD1 1 
ATOM   89  N N   . PRO C 3 1 ? 2.796  2.940  -6.821 1.00 6.06  ? ? ? ? ? ? 1  PRO C N   1 
ATOM   90  C CA  . PRO C 3 1 ? 2.584  3.820  -5.665 1.00 6.83  ? ? ? ? ? ? 1  PRO C CA  1 
ATOM   91  C C   . PRO C 3 1 ? 2.661  3.006  -4.381 1.00 5.67  ? ? ? ? ? ? 1  PRO C C   1 
ATOM   92  O O   . PRO C 3 1 ? 2.566  1.783  -4.314 1.00 5.44  ? ? ? ? ? ? 1  PRO C O   1 
ATOM   93  C CB  . PRO C 3 1 ? 1.165  4.330  -5.864 1.00 9.85  ? ? ? ? ? ? 1  PRO C CB  1 
ATOM   94  C CG  . PRO C 3 1 ? 0.507  3.284  -6.686 1.00 9.09  ? ? ? ? ? ? 1  PRO C CG  1 
ATOM   95  C CD  . PRO C 3 1 ? 1.565  2.584  -7.520 1.00 6.00  ? ? ? ? ? ? 1  PRO C CD  1 
ATOM   96  N N   . HYP C 3 2 ? 2.812  3.718  -3.258 1.00 3.87  ? ? ? ? ? ? 2  HYP C N   1 
ATOM   97  C CA  . HYP C 3 2 ? 2.820  3.057  -1.943 1.00 3.96  ? ? ? ? ? ? 2  HYP C CA  1 
ATOM   98  C C   . HYP C 3 2 ? 1.540  2.278  -1.698 1.00 4.41  ? ? ? ? ? ? 2  HYP C C   1 
ATOM   99  O O   . HYP C 3 2 ? 0.468  2.620  -2.131 1.00 5.64  ? ? ? ? ? ? 2  HYP C O   1 
ATOM   100 C CB  . HYP C 3 2 ? 2.924  4.227  -0.977 1.00 3.43  ? ? ? ? ? ? 2  HYP C CB  1 
ATOM   101 C CG  . HYP C 3 2 ? 3.578  5.323  -1.740 1.00 5.86  ? ? ? ? ? ? 2  HYP C CG  1 
ATOM   102 C CD  . HYP C 3 2 ? 2.973  5.173  -3.117 1.00 4.67  ? ? ? ? ? ? 2  HYP C CD  1 
ATOM   103 O OD1 . HYP C 3 2 ? 4.969  5.122  -1.815 1.00 5.49  ? ? ? ? ? ? 2  HYP C OD1 1 
ATOM   104 N N   . GLY C 3 3 ? 1.701  1.228  -0.920 1.00 4.83  ? ? ? ? ? ? 3  GLY C N   1 
ATOM   105 C CA  . GLY C 3 3 ? 0.589  0.488  -0.356 1.00 3.21  ? ? ? ? ? ? 3  GLY C CA  1 
ATOM   106 C C   . GLY C 3 3 ? -0.176 1.336  0.622  1.00 4.42  ? ? ? ? ? ? 3  GLY C C   1 
ATOM   107 O O   . GLY C 3 3 ? 0.157  2.456  0.978  1.00 5.62  ? ? ? ? ? ? 3  GLY C O   1 
ATOM   108 N N   . PRO C 3 4 ? -1.296 0.780  1.069  1.00 4.32  ? ? ? ? ? ? 4  PRO C N   1 
ATOM   109 C CA  . PRO C 3 4 ? -2.175 1.523  1.988  1.00 5.69  ? ? ? ? ? ? 4  PRO C CA  1 
ATOM   110 C C   . PRO C 3 4 ? -1.632 1.525  3.421  1.00 4.80  ? ? ? ? ? ? 4  PRO C C   1 
ATOM   111 O O   . PRO C 3 4 ? -0.855 0.650  3.803  1.00 5.17  ? ? ? ? ? ? 4  PRO C O   1 
ATOM   112 C CB  . PRO C 3 4 ? -3.462 0.741  1.887  1.00 8.64  ? ? ? ? ? ? 4  PRO C CB  1 
ATOM   113 C CG  . PRO C 3 4 ? -3.157 -0.604 1.373  1.00 10.36 ? ? ? ? ? ? 4  PRO C CG  1 
ATOM   114 C CD  . PRO C 3 4 ? -1.855 -0.517 0.637  1.00 5.31  ? ? ? ? ? ? 4  PRO C CD  1 
ATOM   115 N N   . HYP C 3 5 ? -2.149 2.478  4.226  1.00 5.40  ? ? ? ? ? ? 5  HYP C N   1 
ATOM   116 C CA  . HYP C 3 5 ? -1.894 2.439  5.669  1.00 6.31  ? ? ? ? ? ? 5  HYP C CA  1 
ATOM   117 C C   . HYP C 3 5 ? -2.313 1.078  6.197  1.00 4.81  ? ? ? ? ? ? 5  HYP C C   1 
ATOM   118 O O   . HYP C 3 5 ? -3.306 0.463  5.785  1.00 6.02  ? ? ? ? ? ? 5  HYP C O   1 
ATOM   119 C CB  . HYP C 3 5 ? -2.807 3.528  6.199  1.00 7.89  ? ? ? ? ? ? 5  HYP C CB  1 
ATOM   120 C CG  . HYP C 3 5 ? -3.007 4.506  5.080  1.00 6.44  ? ? ? ? ? ? 5  HYP C CG  1 
ATOM   121 C CD  . HYP C 3 5 ? -3.043 3.582  3.872  1.00 5.93  ? ? ? ? ? ? 5  HYP C CD  1 
ATOM   122 O OD1 . HYP C 3 5 ? -1.834 5.258  4.881  1.00 7.01  ? ? ? ? ? ? 5  HYP C OD1 1 
ATOM   123 N N   . GLY C 3 6 ? -1.561 0.633  7.185  1.00 5.18  ? ? ? ? ? ? 6  GLY C N   1 
ATOM   124 C CA  . GLY C 3 6 ? -1.790 -0.629 7.826  1.00 4.74  ? ? ? ? ? ? 6  GLY C CA  1 
ATOM   125 C C   . GLY C 3 6 ? -2.966 -0.639 8.761  1.00 4.71  ? ? ? ? ? ? 6  GLY C C   1 
ATOM   126 O O   . GLY C 3 6 ? -3.591 0.390  8.986  1.00 5.03  ? ? ? ? ? ? 6  GLY C O   1 
ATOM   127 N N   . PRO C 3 7 ? -3.301 -1.818 9.280  1.00 5.43  ? ? ? ? ? ? 7  PRO C N   1 
ATOM   128 C CA  . PRO C 3 7 ? -4.446 -1.968 10.201 1.00 4.48  ? ? ? ? ? ? 7  PRO C CA  1 
ATOM   129 C C   . PRO C 3 7 ? -4.214 -1.347 11.561 1.00 5.26  ? ? ? ? ? ? 7  PRO C C   1 
ATOM   130 O O   . PRO C 3 7 ? -3.074 -1.054 11.919 1.00 3.56  ? ? ? ? ? ? 7  PRO C O   1 
ATOM   131 C CB  . PRO C 3 7 ? -4.598 -3.495 10.369 1.00 7.53  ? ? ? ? ? ? 7  PRO C CB  1 
ATOM   132 C CG  . PRO C 3 7 ? -3.825 -4.067 9.261  1.00 9.42  ? ? ? ? ? ? 7  PRO C CG  1 
ATOM   133 C CD  . PRO C 3 7 ? -2.709 -3.114 8.969  1.00 6.53  ? ? ? ? ? ? 7  PRO C CD  1 
HETATM 134 O O   . HOH D 4 . ? 8.473  -4.154 -5.162 1.00 32.34 ? ? ? ? ? ? 8  HOH A O   1 
HETATM 135 O O   . HOH D 4 . ? 7.777  4.249  8.957  1.00 12.30 ? ? ? ? ? ? 9  HOH A O   1 
HETATM 136 O O   . HOH D 4 . ? 7.492  2.215  2.576  1.00 6.32  ? ? ? ? ? ? 10 HOH A O   1 
HETATM 137 O O   . HOH D 4 . ? 6.794  -4.006 -2.941 1.00 10.35 ? ? ? ? ? ? 11 HOH A O   1 
HETATM 138 O O   . HOH D 4 . ? -1.214 5.289  9.503  1.00 11.89 ? ? ? ? ? ? 12 HOH A O   1 
HETATM 139 O O   . HOH D 4 . ? 5.793  0.468  6.551  1.00 11.64 ? ? ? ? ? ? 13 HOH A O   1 
HETATM 140 O O   . HOH D 4 . ? 7.754  -4.584 -0.483 1.00 6.34  ? ? ? ? ? ? 14 HOH A O   1 
HETATM 141 O O   . HOH D 4 . ? 11.220 -6.537 -2.145 1.00 10.59 ? ? ? ? ? ? 15 HOH A O   1 
HETATM 142 O O   . HOH D 4 . ? 8.045  1.612  5.211  1.00 9.55  ? ? ? ? ? ? 16 HOH A O   1 
HETATM 143 O O   . HOH D 4 . ? 4.553  4.467  2.529  1.00 6.91  ? ? ? ? ? ? 17 HOH A O   1 
HETATM 144 O O   . HOH D 4 . ? 11.270 -4.567 -4.164 1.00 15.03 ? ? ? ? ? ? 18 HOH A O   1 
HETATM 145 O O   . HOH D 4 . ? 7.133  -1.776 7.614  1.00 11.41 ? ? ? ? ? ? 19 HOH A O   1 
HETATM 146 O O   . HOH D 4 . ? 11.742 -2.788 -2.126 1.00 6.97  ? ? ? ? ? ? 20 HOH A O   1 
HETATM 147 O O   . HOH D 4 . ? 5.679  5.450  4.970  1.00 14.20 ? ? ? ? ? ? 21 HOH A O   1 
HETATM 148 O O   . HOH D 4 . ? 5.819  6.145  9.626  1.00 14.44 ? ? ? ? ? ? 22 HOH A O   1 
HETATM 149 O O   . HOH D 4 . ? 7.432  4.055  6.303  1.00 14.46 ? ? ? ? ? ? 23 HOH A O   1 
HETATM 150 O O   . HOH D 4 . ? 7.718  1.558  9.294  1.00 21.59 ? ? ? ? ? ? 24 HOH A O   1 
HETATM 151 O O   . HOH E 4 . ? 4.270  -4.101 5.562  1.00 13.12 ? ? ? ? ? ? 8  HOH B O   1 
HETATM 152 O O   . HOH E 4 . ? -0.813 -5.404 7.207  1.00 7.98  ? ? ? ? ? ? 9  HOH B O   1 
HETATM 153 O O   . HOH E 4 . ? -4.644 -3.854 4.233  1.00 10.04 ? ? ? ? ? ? 10 HOH B O   1 
HETATM 154 O O   . HOH E 4 . ? -3.373 -5.633 6.003  1.00 12.63 ? ? ? ? ? ? 11 HOH B O   1 
HETATM 155 O O   . HOH E 4 . ? 4.145  -7.439 2.737  1.00 9.90  ? ? ? ? ? ? 12 HOH B O   1 
HETATM 156 O O   . HOH E 4 . ? -3.481 2.000  -4.797 1.00 13.06 ? ? ? ? ? ? 13 HOH B O   1 
HETATM 157 O O   . HOH E 4 . ? -4.974 -0.207 -4.688 1.00 12.91 ? ? ? ? ? ? 14 HOH B O   1 
HETATM 158 O O   . HOH E 4 . ? -0.586 -4.578 -5.972 1.00 8.00  ? ? ? ? ? ? 15 HOH B O   1 
HETATM 159 O O   . HOH E 4 . ? 4.594  -8.665 5.281  1.00 14.51 ? ? ? ? ? ? 16 HOH B O   1 
HETATM 160 O O   . HOH E 4 . ? -3.423 -4.426 -0.262 1.00 7.70  ? ? ? ? ? ? 17 HOH B O   1 
HETATM 161 O O   . HOH E 4 . ? -1.425 -7.163 9.329  1.00 7.70  ? ? ? ? ? ? 18 HOH B O   1 
HETATM 162 O O   . HOH E 4 . ? -2.269 -4.949 -8.144 1.00 15.47 ? ? ? ? ? ? 19 HOH B O   1 
HETATM 163 O O   . HOH E 4 . ? -3.818 -0.398 -2.369 1.00 12.71 ? ? ? ? ? ? 20 HOH B O   1 
HETATM 164 O O   . HOH E 4 . ? -4.437 -6.498 -7.234 1.00 15.96 ? ? ? ? ? ? 21 HOH B O   1 
HETATM 165 O O   . HOH E 4 . ? 1.098  -5.925 5.379  1.00 20.76 ? ? ? ? ? ? 22 HOH B O   1 
HETATM 166 O O   . HOH E 4 . ? 3.294  -6.645 6.697  1.00 34.69 ? ? ? ? ? ? 23 HOH B O   1 
HETATM 167 O O   . HOH F 4 . ? -1.279 6.683  7.177  1.00 8.41  ? ? ? ? ? ? 8  HOH C O   1 
HETATM 168 O O   . HOH F 4 . ? -2.037 7.710  3.411  1.00 7.92  ? ? ? ? ? ? 9  HOH C O   1 
HETATM 169 O O   . HOH F 4 . ? -0.922 4.864  0.303  1.00 7.85  ? ? ? ? ? ? 10 HOH C O   1 
HETATM 170 O O   . HOH F 4 . ? -0.408 5.262  -2.553 1.00 9.64  ? ? ? ? ? ? 11 HOH C O   1 
HETATM 171 O O   . HOH F 4 . ? 6.180  6.557  -3.904 1.00 15.33 ? ? ? ? ? ? 12 HOH C O   1 
HETATM 172 O O   . HOH F 4 . ? -3.456 4.100  -0.560 1.00 5.70  ? ? ? ? ? ? 13 HOH C O   1 
HETATM 173 O O   . HOH F 4 . ? -2.350 1.966  -2.109 1.00 7.12  ? ? ? ? ? ? 14 HOH C O   1 
HETATM 174 O O   . HOH F 4 . ? 0.009  6.859  1.700  1.00 7.32  ? ? ? ? ? ? 15 HOH C O   1 
HETATM 175 O O   . HOH F 4 . ? -4.506 -2.021 6.135  1.00 8.30  ? ? ? ? ? ? 16 HOH C O   1 
HETATM 176 O O   . HOH F 4 . ? 8.419  4.567  1.413  1.00 5.66  ? ? ? ? ? ? 17 HOH C O   1 
HETATM 177 O O   . HOH F 4 . ? 5.612  6.734  -7.519 1.00 11.53 ? ? ? ? ? ? 18 HOH C O   1 
HETATM 178 O O   . HOH F 4 . ? 6.751  4.803  -5.954 1.00 8.45  ? ? ? ? ? ? 19 HOH C O   1 
HETATM 179 O O   . HOH F 4 . ? 6.142  5.705  0.541  1.00 6.75  ? ? ? ? ? ? 20 HOH C O   1 
HETATM 180 O O   . HOH F 4 . ? 8.887  6.601  3.357  1.00 17.97 ? ? ? ? ? ? 21 HOH C O   1 
HETATM 181 O O   . HOH F 4 . ? 7.415  8.440  -8.370 1.00 12.53 ? ? ? ? ? ? 22 HOH C O   1 
HETATM 182 O O   . HOH F 4 . ? 8.364  7.804  -3.331 1.00 14.81 ? ? ? ? ? ? 23 HOH C O   1 
# 
loop_
_atom_site_anisotrop.id 
_atom_site_anisotrop.type_symbol 
_atom_site_anisotrop.pdbx_label_atom_id 
_atom_site_anisotrop.pdbx_label_alt_id 
_atom_site_anisotrop.pdbx_label_comp_id 
_atom_site_anisotrop.pdbx_label_asym_id 
_atom_site_anisotrop.pdbx_label_seq_id 
_atom_site_anisotrop.U[1][1] 
_atom_site_anisotrop.U[2][2] 
_atom_site_anisotrop.U[3][3] 
_atom_site_anisotrop.U[1][2] 
_atom_site_anisotrop.U[1][3] 
_atom_site_anisotrop.U[2][3] 
_atom_site_anisotrop.U[1][1]_esd 
_atom_site_anisotrop.U[2][2]_esd 
_atom_site_anisotrop.U[3][3]_esd 
_atom_site_anisotrop.U[1][2]_esd 
_atom_site_anisotrop.U[1][3]_esd 
_atom_site_anisotrop.U[2][3]_esd 
_atom_site_anisotrop.pdbx_auth_seq_id 
_atom_site_anisotrop.pdbx_auth_comp_id 
_atom_site_anisotrop.pdbx_auth_asym_id 
_atom_site_anisotrop.pdbx_auth_atom_id 
1   N N   . GLY A 1 0.0545 0.0886 0.0429 -0.0057 0.0194  -0.0140 ? ? ? ? ? ? 1 GLY A N   
2   C CA  . GLY A 1 0.0371 0.0869 0.0359 -0.0158 0.0023  0.0070  ? ? ? ? ? ? 1 GLY A CA  
3   C C   . GLY A 1 0.0552 0.0996 0.0208 -0.0251 0.0179  0.0159  ? ? ? ? ? ? 1 GLY A C   
4   O O   . GLY A 1 0.0461 0.0970 0.0484 -0.0176 0.0155  0.0176  ? ? ? ? ? ? 1 GLY A O   
5   N N   . PRO A 2 0.0483 0.1016 0.0439 -0.0081 -0.0254 0.0123  ? ? ? ? ? ? 2 PRO A N   
6   C CA  . PRO A 2 0.0452 0.0900 0.0402 -0.0003 0.0044  -0.0171 ? ? ? ? ? ? 2 PRO A CA  
7   C C   . PRO A 2 0.0603 0.0536 0.0472 0.0029  0.0159  -0.0132 ? ? ? ? ? ? 2 PRO A C   
8   O O   . PRO A 2 0.0523 0.0897 0.0508 -0.0158 0.0063  -0.0084 ? ? ? ? ? ? 2 PRO A O   
9   C CB  . PRO A 2 0.1279 0.1436 0.0598 -0.0817 0.0077  -0.0296 ? ? ? ? ? ? 2 PRO A CB  
10  C CG  . PRO A 2 0.1600 0.0717 0.1256 -0.0044 -0.0373 0.0053  ? ? ? ? ? ? 2 PRO A CG  
11  C CD  . PRO A 2 0.1148 0.0868 0.0522 -0.0021 0.0267  -0.0111 ? ? ? ? ? ? 2 PRO A CD  
12  N N   . HYP A 3 0.0653 0.0432 0.0586 0.0132  0.0234  -0.0100 ? ? ? ? ? ? 3 HYP A N   
13  C CA  . HYP A 3 0.0536 0.0492 0.0687 -0.0127 0.0168  0.0110  ? ? ? ? ? ? 3 HYP A CA  
14  C C   . HYP A 3 0.0297 0.0550 0.0140 -0.0212 0.0060  -0.0067 ? ? ? ? ? ? 3 HYP A C   
15  O O   . HYP A 3 0.0603 0.0507 0.0641 -0.0123 0.0219  0.0104  ? ? ? ? ? ? 3 HYP A O   
16  C CB  . HYP A 3 0.0830 0.0858 0.0725 0.0238  0.0245  0.0246  ? ? ? ? ? ? 3 HYP A CB  
17  C CG  . HYP A 3 0.0855 0.0872 0.0669 0.0222  0.0228  0.0057  ? ? ? ? ? ? 3 HYP A CG  
18  C CD  . HYP A 3 0.0830 0.0744 0.0521 0.0448  0.0276  -0.0101 ? ? ? ? ? ? 3 HYP A CD  
19  O OD1 . HYP A 3 0.0625 0.0919 0.1165 0.0241  -0.0129 -0.0011 ? ? ? ? ? ? 3 HYP A OD1 
20  N N   . GLY A 4 0.0407 0.0739 0.0351 -0.0124 0.0179  -0.0044 ? ? ? ? ? ? 4 GLY A N   
21  C CA  . GLY A 4 0.0406 0.0416 0.0527 -0.0149 0.0123  0.0032  ? ? ? ? ? ? 4 GLY A CA  
22  C C   . GLY A 4 0.0822 0.0600 0.0454 0.0224  0.0123  -0.0039 ? ? ? ? ? ? 4 GLY A C   
23  O O   . GLY A 4 0.0514 0.0815 0.0744 -0.0006 -0.0049 0.0097  ? ? ? ? ? ? 4 GLY A O   
24  N N   . PRO A 5 0.0986 0.0585 0.0528 0.0002  0.0395  -0.0142 ? ? ? ? ? ? 5 PRO A N   
25  C CA  . PRO A 5 0.1087 0.0491 0.0670 -0.0200 0.0222  -0.0233 ? ? ? ? ? ? 5 PRO A CA  
26  C C   . PRO A 5 0.0339 0.0492 0.0603 0.0177  0.0032  -0.0131 ? ? ? ? ? ? 5 PRO A C   
27  O O   . PRO A 5 0.0564 0.0695 0.0707 -0.0151 0.0083  -0.0094 ? ? ? ? ? ? 5 PRO A O   
28  C CB  . PRO A 5 0.1692 0.0227 0.0800 -0.0210 0.0478  -0.0182 ? ? ? ? ? ? 5 PRO A CB  
29  C CG  . PRO A 5 0.1046 0.0906 0.0892 0.0300  -0.0162 -0.0421 ? ? ? ? ? ? 5 PRO A CG  
30  C CD  . PRO A 5 0.1126 0.0616 0.0714 0.0359  0.0471  -0.0239 ? ? ? ? ? ? 5 PRO A CD  
31  N N   . HYP A 6 0.0833 0.0689 0.0560 -0.0298 0.0025  -0.0198 ? ? ? ? ? ? 6 HYP A N   
32  C CA  . HYP A 6 0.0983 0.0605 0.0664 0.0146  0.0046  0.0161  ? ? ? ? ? ? 6 HYP A CA  
33  C C   . HYP A 6 0.1072 0.0787 0.0564 0.0328  0.0186  0.0490  ? ? ? ? ? ? 6 HYP A C   
34  O O   . HYP A 6 0.1114 0.0578 0.0480 0.0161  0.0059  0.0082  ? ? ? ? ? ? 6 HYP A O   
35  C CB  . HYP A 6 0.1343 0.1686 0.0861 0.0263  -0.0291 0.0291  ? ? ? ? ? ? 6 HYP A CB  
36  C CG  . HYP A 6 0.0843 0.1719 0.1373 0.0473  -0.0440 0.0085  ? ? ? ? ? ? 6 HYP A CG  
37  C CD  . HYP A 6 0.0957 0.0918 0.0881 -0.0317 -0.0259 -0.0219 ? ? ? ? ? ? 6 HYP A CD  
38  O OD1 . HYP A 6 0.1227 0.1350 0.3669 0.0408  0.0227  0.0649  ? ? ? ? ? ? 6 HYP A OD1 
39  N N   . GLY A 7 0.1068 0.0836 0.0484 0.0218  0.0022  0.0490  ? ? ? ? ? ? 7 GLY A N   
40  C CA  . GLY A 7 0.0894 0.0586 0.0465 -0.0275 -0.0193 0.0189  ? ? ? ? ? ? 7 GLY A CA  
41  C C   . GLY A 7 0.1091 0.0839 0.0481 -0.0121 -0.0060 0.0124  ? ? ? ? ? ? 7 GLY A C   
42  O O   . GLY A 7 0.1226 0.0872 0.0583 -0.0401 -0.0103 -0.0024 ? ? ? ? ? ? 7 GLY A O   
43  N N   . HYP B 1 0.0341 0.0888 0.0500 -0.0156 0.0015  0.0089  ? ? ? ? ? ? 1 HYP B N   
44  C CA  . HYP B 1 0.0941 0.0584 0.0477 0.0075  -0.0038 0.0121  ? ? ? ? ? ? 1 HYP B CA  
45  C C   . HYP B 1 0.0368 0.0395 0.0321 0.0085  0.0159  -0.0178 ? ? ? ? ? ? 1 HYP B C   
46  O O   . HYP B 1 0.0659 0.0414 0.0540 -0.0112 0.0001  -0.0229 ? ? ? ? ? ? 1 HYP B O   
47  C CB  . HYP B 1 0.1042 0.0813 0.0720 0.0687  0.0038  0.0085  ? ? ? ? ? ? 1 HYP B CB  
48  C CG  . HYP B 1 0.0817 0.1363 0.0551 0.0572  0.0255  0.0413  ? ? ? ? ? ? 1 HYP B CG  
49  C CD  . HYP B 1 0.0271 0.1500 0.0650 0.0437  -0.0041 0.0088  ? ? ? ? ? ? 1 HYP B CD  
50  O OD1 . HYP B 1 0.1002 0.1288 0.1040 0.0449  -0.0084 0.0428  ? ? ? ? ? ? 1 HYP B OD1 
51  N N   . GLY B 2 0.0629 0.0416 0.0350 -0.0155 0.0043  -0.0066 ? ? ? ? ? ? 2 GLY B N   
52  C CA  . GLY B 2 0.0315 0.0470 0.0336 0.0168  0.0127  -0.0184 ? ? ? ? ? ? 2 GLY B CA  
53  C C   . GLY B 2 0.0493 0.0521 0.0524 -0.0087 -0.0015 0.0000  ? ? ? ? ? ? 2 GLY B C   
54  O O   . GLY B 2 0.0401 0.0775 0.0296 -0.0169 0.0129  -0.0150 ? ? ? ? ? ? 2 GLY B O   
55  N N   . PRO B 3 0.0844 0.0521 0.0527 0.0072  0.0034  0.0026  ? ? ? ? ? ? 3 PRO B N   
56  C CA  . PRO B 3 0.1073 0.0474 0.0596 -0.0042 -0.0059 0.0092  ? ? ? ? ? ? 3 PRO B CA  
57  C C   . PRO B 3 0.0689 0.0442 0.0494 -0.0055 -0.0122 0.0137  ? ? ? ? ? ? 3 PRO B C   
58  O O   . PRO B 3 0.0534 0.0664 0.0386 -0.0203 0.0029  -0.0008 ? ? ? ? ? ? 3 PRO B O   
59  C CB  . PRO B 3 0.1348 0.0618 0.0925 0.0255  0.0038  0.0191  ? ? ? ? ? ? 3 PRO B CB  
60  C CG  . PRO B 3 0.1150 0.2268 0.2107 0.0090  -0.0342 0.1557  ? ? ? ? ? ? 3 PRO B CG  
61  C CD  . PRO B 3 0.1025 0.0879 0.1145 0.0405  0.0012  0.0450  ? ? ? ? ? ? 3 PRO B CD  
62  N N   . HYP B 4 0.0863 0.0498 0.0737 -0.0300 0.0053  0.0066  ? ? ? ? ? ? 4 HYP B N   
63  C CA  . HYP B 4 0.0757 0.0312 0.0762 -0.0173 0.0119  0.0232  ? ? ? ? ? ? 4 HYP B CA  
64  C C   . HYP B 4 0.0665 0.0457 0.0845 0.0030  0.0164  -0.0212 ? ? ? ? ? ? 4 HYP B C   
65  O O   . HYP B 4 0.1032 0.0627 0.0745 0.0288  0.0086  -0.0060 ? ? ? ? ? ? 4 HYP B O   
66  C CB  . HYP B 4 0.1015 0.0494 0.0606 -0.0364 0.0070  0.0131  ? ? ? ? ? ? 4 HYP B CB  
67  C CG  . HYP B 4 0.0670 0.0572 0.0978 -0.0309 0.0105  -0.0096 ? ? ? ? ? ? 4 HYP B CG  
68  C CD  . HYP B 4 0.1014 0.0519 0.0827 -0.0218 0.0235  -0.0011 ? ? ? ? ? ? 4 HYP B CD  
69  O OD1 . HYP B 4 0.0820 0.1121 0.0772 -0.0205 0.0073  -0.0072 ? ? ? ? ? ? 4 HYP B OD1 
70  N N   . GLY B 5 0.1038 0.0297 0.0609 0.0200  0.0045  0.0056  ? ? ? ? ? ? 5 GLY B N   
71  C CA  . GLY B 5 0.0881 0.0763 0.0518 -0.0096 0.0151  -0.0057 ? ? ? ? ? ? 5 GLY B CA  
72  C C   . GLY B 5 0.0964 0.0514 0.0473 -0.0078 0.0021  -0.0105 ? ? ? ? ? ? 5 GLY B C   
73  O O   . GLY B 5 0.1201 0.0606 0.0705 -0.0286 0.0167  -0.0139 ? ? ? ? ? ? 5 GLY B O   
74  N N   . PRO B 6 0.1044 0.0570 0.0379 -0.0015 0.0195  -0.0148 ? ? ? ? ? ? 6 PRO B N   
75  C CA  . PRO B 6 0.0845 0.0899 0.0363 0.0044  0.0099  -0.0053 ? ? ? ? ? ? 6 PRO B CA  
76  C C   . PRO B 6 0.1159 0.0604 0.0077 0.0096  -0.0020 -0.0043 ? ? ? ? ? ? 6 PRO B C   
77  O O   . PRO B 6 0.0775 0.0587 0.0777 -0.0023 0.0153  0.0097  ? ? ? ? ? ? 6 PRO B O   
78  C CB  . PRO B 6 0.0817 0.1725 0.0299 -0.0344 0.0055  0.0155  ? ? ? ? ? ? 6 PRO B CB  
79  C CG  . PRO B 6 0.0782 0.1627 0.0920 -0.0177 0.0051  0.0470  ? ? ? ? ? ? 6 PRO B CG  
80  C CD  . PRO B 6 0.1152 0.0861 0.0852 -0.0242 -0.0211 -0.0037 ? ? ? ? ? ? 6 PRO B CD  
81  N N   . HYP B 7 0.1368 0.0480 0.0309 0.0164  0.0254  -0.0045 ? ? ? ? ? ? 7 HYP B N   
82  C CA  . HYP B 7 0.0528 0.0689 0.0331 -0.0100 0.0006  -0.0169 ? ? ? ? ? ? 7 HYP B CA  
83  C C   . HYP B 7 0.0535 0.0869 0.0152 -0.0093 -0.0116 -0.0225 ? ? ? ? ? ? 7 HYP B C   
84  O O   . HYP B 7 0.0517 0.1183 0.0541 -0.0069 -0.0061 -0.0376 ? ? ? ? ? ? 7 HYP B O   
85  C CB  . HYP B 7 0.0365 0.0859 0.0504 0.0052  0.0111  -0.0012 ? ? ? ? ? ? 7 HYP B CB  
86  C CG  . HYP B 7 0.0714 0.0783 0.0718 -0.0160 0.0165  -0.0085 ? ? ? ? ? ? 7 HYP B CG  
87  C CD  . HYP B 7 0.0899 0.0586 0.0811 0.0099  0.0434  0.0031  ? ? ? ? ? ? 7 HYP B CD  
88  O OD1 . HYP B 7 0.1016 0.1164 0.0552 -0.0379 0.0044  -0.0071 ? ? ? ? ? ? 7 HYP B OD1 
89  N N   . PRO C 1 0.1194 0.0549 0.0559 -0.0129 0.0096  -0.0195 ? ? ? ? ? ? 1 PRO C N   
90  C CA  . PRO C 1 0.1550 0.0544 0.0501 0.0203  0.0204  -0.0130 ? ? ? ? ? ? 1 PRO C CA  
91  C C   . PRO C 1 0.1059 0.0490 0.0604 0.0139  0.0348  -0.0130 ? ? ? ? ? ? 1 PRO C C   
92  O O   . PRO C 1 0.0996 0.0510 0.0561 -0.0071 0.0325  -0.0037 ? ? ? ? ? ? 1 PRO C O   
93  C CB  . PRO C 1 0.1741 0.1371 0.0629 0.0560  -0.0040 -0.0254 ? ? ? ? ? ? 1 PRO C CB  
94  C CG  . PRO C 1 0.1327 0.0835 0.1290 0.0323  0.0215  -0.0123 ? ? ? ? ? ? 1 PRO C CG  
95  C CD  . PRO C 1 0.1015 0.0715 0.0550 0.0033  0.0093  0.0058  ? ? ? ? ? ? 1 PRO C CD  
96  N N   . HYP C 2 0.0596 0.0382 0.0493 0.0053  -0.0091 0.0027  ? ? ? ? ? ? 2 HYP C N   
97  C CA  . HYP C 2 0.0610 0.0289 0.0605 0.0248  0.0165  0.0106  ? ? ? ? ? ? 2 HYP C CA  
98  C C   . HYP C 2 0.0875 0.0339 0.0461 -0.0015 0.0067  -0.0172 ? ? ? ? ? ? 2 HYP C C   
99  O O   . HYP C 2 0.0850 0.0779 0.0514 -0.0200 -0.0080 -0.0022 ? ? ? ? ? ? 2 HYP C O   
100 C CB  . HYP C 2 0.0308 0.0529 0.0467 0.0080  -0.0224 -0.0003 ? ? ? ? ? ? 2 HYP C CB  
101 C CG  . HYP C 2 0.0839 0.0631 0.0756 -0.0197 -0.0071 -0.0085 ? ? ? ? ? ? 2 HYP C CG  
102 C CD  . HYP C 2 0.0682 0.0391 0.0701 -0.0313 -0.0037 0.0152  ? ? ? ? ? ? 2 HYP C CD  
103 O OD1 . HYP C 2 0.0762 0.0645 0.0680 -0.0400 -0.0050 -0.0161 ? ? ? ? ? ? 2 HYP C OD1 
104 N N   . GLY C 3 0.0722 0.0352 0.0760 -0.0105 0.0210  -0.0048 ? ? ? ? ? ? 3 GLY C N   
105 C CA  . GLY C 3 0.0056 0.0675 0.0489 0.0047  -0.0168 0.0018  ? ? ? ? ? ? 3 GLY C CA  
106 C C   . GLY C 3 0.0492 0.0656 0.0533 0.0079  0.0057  0.0072  ? ? ? ? ? ? 3 GLY C C   
107 O O   . GLY C 3 0.0798 0.0480 0.0859 0.0217  -0.0070 0.0027  ? ? ? ? ? ? 3 GLY C O   
108 N N   . PRO C 4 0.0288 0.0852 0.0499 0.0177  -0.0056 0.0097  ? ? ? ? ? ? 4 PRO C N   
109 C CA  . PRO C 4 0.0760 0.0974 0.0429 0.0173  0.0275  0.0118  ? ? ? ? ? ? 4 PRO C CA  
110 C C   . PRO C 4 0.0586 0.0578 0.0658 -0.0122 0.0136  -0.0006 ? ? ? ? ? ? 4 PRO C C   
111 O O   . PRO C 4 0.0914 0.0567 0.0483 -0.0019 0.0006  -0.0033 ? ? ? ? ? ? 4 PRO C O   
112 C CB  . PRO C 4 0.0501 0.1759 0.1021 0.0111  0.0026  -0.0316 ? ? ? ? ? ? 4 PRO C CB  
113 C CG  . PRO C 4 0.0607 0.0972 0.2356 -0.0039 0.0241  0.0325  ? ? ? ? ? ? 4 PRO C CG  
114 C CD  . PRO C 4 0.0727 0.0939 0.0350 -0.0027 -0.0122 -0.0016 ? ? ? ? ? ? 4 PRO C CD  
115 N N   . HYP C 5 0.0933 0.0628 0.0492 0.0092  0.0068  0.0083  ? ? ? ? ? ? 5 HYP C N   
116 C CA  . HYP C 5 0.0958 0.0932 0.0505 -0.0041 -0.0015 0.0111  ? ? ? ? ? ? 5 HYP C CA  
117 C C   . HYP C 5 0.1106 0.0721 0.0002 0.0038  0.0035  -0.0248 ? ? ? ? ? ? 5 HYP C C   
118 O O   . HYP C 5 0.1123 0.0720 0.0444 -0.0050 -0.0100 0.0006  ? ? ? ? ? ? 5 HYP C O   
119 C CB  . HYP C 5 0.1728 0.0686 0.0584 -0.0126 0.0359  0.0007  ? ? ? ? ? ? 5 HYP C CB  
120 C CG  . HYP C 5 0.0996 0.0879 0.0572 0.0171  0.0657  0.0133  ? ? ? ? ? ? 5 HYP C CG  
121 C CD  . HYP C 5 0.0743 0.0866 0.0644 0.0209  0.0213  0.0113  ? ? ? ? ? ? 5 HYP C CD  
122 O OD1 . HYP C 5 0.1085 0.0837 0.0741 0.0083  0.0328  0.0032  ? ? ? ? ? ? 5 HYP C OD1 
123 N N   . GLY C 6 0.0803 0.0643 0.0522 -0.0257 -0.0027 0.0026  ? ? ? ? ? ? 6 GLY C N   
124 C CA  . GLY C 6 0.0630 0.0673 0.0498 -0.0154 -0.0011 0.0049  ? ? ? ? ? ? 6 GLY C CA  
125 C C   . GLY C 6 0.0378 0.0853 0.0559 0.0090  -0.0075 0.0320  ? ? ? ? ? ? 6 GLY C C   
126 O O   . GLY C 6 0.0644 0.0701 0.0565 0.0009  -0.0070 0.0151  ? ? ? ? ? ? 6 GLY C O   
127 N N   . PRO C 7 0.0584 0.0717 0.0763 -0.0001 0.0272  0.0023  ? ? ? ? ? ? 7 PRO C N   
128 C CA  . PRO C 7 0.0629 0.0558 0.0517 -0.0195 0.0161  -0.0051 ? ? ? ? ? ? 7 PRO C CA  
129 C C   . PRO C 7 0.0725 0.0605 0.0670 -0.0505 0.0218  -0.0214 ? ? ? ? ? ? 7 PRO C C   
130 O O   . PRO C 7 0.0416 0.0465 0.0471 -0.0185 0.0290  0.0054  ? ? ? ? ? ? 7 PRO C O   
131 C CB  . PRO C 7 0.1479 0.0484 0.0900 -0.0372 0.0438  -0.0306 ? ? ? ? ? ? 7 PRO C CB  
132 C CG  . PRO C 7 0.1225 0.0665 0.1687 0.0085  0.0724  -0.0202 ? ? ? ? ? ? 7 PRO C CG  
133 C CD  . PRO C 7 0.0793 0.0831 0.0855 0.0141  0.0101  -0.0173 ? ? ? ? ? ? 7 PRO C CD  
# 
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 GLY 1 1 1 GLY GLY A . n 
A 1 2 PRO 2 2 2 PRO PRO A . n 
A 1 3 HYP 3 3 3 HYP HYP A . n 
A 1 4 GLY 4 4 4 GLY GLY A . n 
A 1 5 PRO 5 5 5 PRO PRO A . n 
A 1 6 HYP 6 6 6 HYP HYP A . n 
A 1 7 GLY 7 7 7 GLY GLY A . n 
B 2 1 HYP 1 1 1 HYP HYP B . n 
B 2 2 GLY 2 2 2 GLY GLY B . n 
B 2 3 PRO 3 3 3 PRO PRO B . n 
B 2 4 HYP 4 4 4 HYP HYP B . n 
B 2 5 GLY 5 5 5 GLY GLY B . n 
B 2 6 PRO 6 6 6 PRO PRO B . n 
B 2 7 HYP 7 7 7 HYP HYP B . n 
C 3 1 PRO 1 1 1 PRO PRO C . n 
C 3 2 HYP 2 2 2 HYP HYP C . n 
C 3 3 GLY 3 3 3 GLY GLY C . n 
C 3 4 PRO 4 4 4 PRO PRO C . n 
C 3 5 HYP 5 5 5 HYP HYP C . n 
C 3 6 GLY 6 6 6 GLY GLY C . n 
C 3 7 PRO 7 7 7 PRO PRO C . n 
# 
loop_
_software.name 
_software.classification 
_software.version 
_software.citation_id 
_software.pdbx_ordinal 
SHELX     'model building' . ? 1 
SHELXL-97 refinement       . ? 2 
# 
loop_
_pdbx_version.entry_id 
_pdbx_version.revision_date 
_pdbx_version.major_version 
_pdbx_version.minor_version 
_pdbx_version.revision_type 
_pdbx_version.details 
1V7H 2008-04-27 3 2    'Version format compliance' 'compliance with PDB format V.3.15'          
1V7H 2011-07-13 4 0000 'Version format compliance' 'compliance with PDB Exchange Dictionary V4' 
1V7H 2013-12-25 4 0001 'Biological assembly'       ?                                            
# 
_pdbx_struct_assembly.id                   1 
_pdbx_struct_assembly.details              author_defined_assembly 
_pdbx_struct_assembly.method_details       ? 
_pdbx_struct_assembly.oligomeric_details   hexameric 
_pdbx_struct_assembly.oligomeric_count     6 
# 
_pdbx_struct_assembly_gen.assembly_id       1 
_pdbx_struct_assembly_gen.oper_expression   1,2 
_pdbx_struct_assembly_gen.asym_id_list      A,D,B,E,C,F 
# 
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] 
1 'identity operation'         1_555 x,y,z   1.0000000000 0.0000000000 0.0000000000 0.0000000000  0.0000000000 1.0000000000 
0.0000000000 0.0000000000 0.0000000000 0.0000000000 1.0000000000 0.0000000000  
2 'crystal symmetry operation' 1_556 x,y,z+1 1.0000000000 0.0000000000 0.0000000000 -5.4833271118 0.0000000000 1.0000000000 
0.0000000000 0.0000000000 0.0000000000 0.0000000000 1.0000000000 19.1858082912 
# 
loop_
_pdbx_nonpoly_scheme.asym_id 
_pdbx_nonpoly_scheme.entity_id 
_pdbx_nonpoly_scheme.mon_id 
_pdbx_nonpoly_scheme.ndb_seq_num 
_pdbx_nonpoly_scheme.pdb_seq_num 
_pdbx_nonpoly_scheme.auth_seq_num 
_pdbx_nonpoly_scheme.pdb_mon_id 
_pdbx_nonpoly_scheme.auth_mon_id 
_pdbx_nonpoly_scheme.pdb_strand_id 
_pdbx_nonpoly_scheme.pdb_ins_code 
D 4 HOH 1  8  2  HOH HOH A . 
D 4 HOH 2  9  4  HOH HOH A . 
D 4 HOH 3  10 5  HOH HOH A . 
D 4 HOH 4  11 8  HOH HOH A . 
D 4 HOH 5  12 12 HOH HOH A . 
D 4 HOH 6  13 13 HOH HOH A . 
D 4 HOH 7  14 16 HOH HOH A . 
D 4 HOH 8  15 18 HOH HOH A . 
D 4 HOH 9  16 20 HOH HOH A . 
D 4 HOH 10 17 21 HOH HOH A . 
D 4 HOH 11 18 22 HOH HOH A . 
D 4 HOH 12 19 23 HOH HOH A . 
D 4 HOH 13 20 26 HOH HOH A . 
D 4 HOH 14 21 31 HOH HOH A . 
D 4 HOH 15 22 38 HOH HOH A . 
D 4 HOH 16 23 39 HOH HOH A . 
D 4 HOH 17 24 46 HOH HOH A . 
E 4 HOH 1  8  1  HOH HOH B . 
E 4 HOH 2  9  7  HOH HOH B . 
E 4 HOH 3  10 10 HOH HOH B . 
E 4 HOH 4  11 15 HOH HOH B . 
E 4 HOH 5  12 19 HOH HOH B . 
E 4 HOH 6  13 24 HOH HOH B . 
E 4 HOH 7  14 28 HOH HOH B . 
E 4 HOH 8  15 32 HOH HOH B . 
E 4 HOH 9  16 34 HOH HOH B . 
E 4 HOH 10 17 37 HOH HOH B . 
E 4 HOH 11 18 40 HOH HOH B . 
E 4 HOH 12 19 41 HOH HOH B . 
E 4 HOH 13 20 43 HOH HOH B . 
E 4 HOH 14 21 47 HOH HOH B . 
E 4 HOH 15 22 48 HOH HOH B . 
E 4 HOH 16 23 49 HOH HOH B . 
F 4 HOH 1  8  3  HOH HOH C . 
F 4 HOH 2  9  6  HOH HOH C . 
F 4 HOH 3  10 9  HOH HOH C . 
F 4 HOH 4  11 11 HOH HOH C . 
F 4 HOH 5  12 14 HOH HOH C . 
F 4 HOH 6  13 17 HOH HOH C . 
F 4 HOH 7  14 25 HOH HOH C . 
F 4 HOH 8  15 27 HOH HOH C . 
F 4 HOH 9  16 29 HOH HOH C . 
F 4 HOH 10 17 30 HOH HOH C . 
F 4 HOH 11 18 33 HOH HOH C . 
F 4 HOH 12 19 35 HOH HOH C . 
F 4 HOH 13 20 36 HOH HOH C . 
F 4 HOH 14 21 42 HOH HOH C . 
F 4 HOH 15 22 44 HOH HOH C . 
F 4 HOH 16 23 45 HOH HOH C . 
# 
loop_
_pdbx_struct_mod_residue.id 
_pdbx_struct_mod_residue.label_asym_id 
_pdbx_struct_mod_residue.label_seq_id 
_pdbx_struct_mod_residue.label_comp_id 
_pdbx_struct_mod_residue.auth_asym_id 
_pdbx_struct_mod_residue.auth_seq_id 
_pdbx_struct_mod_residue.auth_comp_id 
_pdbx_struct_mod_residue.PDB_ins_code 
_pdbx_struct_mod_residue.parent_comp_id 
_pdbx_struct_mod_residue.details 
1 A 3 HYP A 3 HYP ? PRO 4-HYDROXYPROLINE 
2 A 6 HYP A 6 HYP ? PRO 4-HYDROXYPROLINE 
3 B 1 HYP B 1 HYP ? PRO 4-HYDROXYPROLINE 
4 B 4 HYP B 4 HYP ? PRO 4-HYDROXYPROLINE 
5 B 7 HYP B 7 HYP ? PRO 4-HYDROXYPROLINE 
6 C 2 HYP C 2 HYP ? PRO 4-HYDROXYPROLINE 
7 C 5 HYP C 5 HYP ? PRO 4-HYDROXYPROLINE 
# 
loop_
_pdbx_validate_symm_contact.id 
_pdbx_validate_symm_contact.PDB_model_num 
_pdbx_validate_symm_contact.auth_atom_id_1 
_pdbx_validate_symm_contact.auth_asym_id_1 
_pdbx_validate_symm_contact.auth_comp_id_1 
_pdbx_validate_symm_contact.auth_seq_id_1 
_pdbx_validate_symm_contact.PDB_ins_code_1 
_pdbx_validate_symm_contact.label_alt_id_1 
_pdbx_validate_symm_contact.site_symmetry_1 
_pdbx_validate_symm_contact.auth_atom_id_2 
_pdbx_validate_symm_contact.auth_asym_id_2 
_pdbx_validate_symm_contact.auth_comp_id_2 
_pdbx_validate_symm_contact.auth_seq_id_2 
_pdbx_validate_symm_contact.PDB_ins_code_2 
_pdbx_validate_symm_contact.label_alt_id_2 
_pdbx_validate_symm_contact.site_symmetry_2 
_pdbx_validate_symm_contact.dist 
1 1 C A GLY 7 ? ? 1_555 N C PRO 1 ? ? 1_556 1.32 
2 1 N A GLY 1 ? ? 1_555 C B HYP 7 ? ? 1_554 1.33 
# 
_pdbx_entity_nonpoly.entity_id   4 
_pdbx_entity_nonpoly.name        water 
_pdbx_entity_nonpoly.comp_id     HOH 
# 
