data_6MJH
# 
_entry.id   6MJH 
# 
_audit_conform.dict_name       mmcif_pdbx.dic 
_audit_conform.dict_version    4.073 
_audit_conform.dict_location   http://mmcif.pdb.org/dictionaries/ascii/mmcif_pdbx.dic 
# 
loop_
_database_2.database_id 
_database_2.database_code 
PDB   6MJH         
WWPDB D_1000237020 
# 
_pdbx_database_status.status_code                     AUTH 
_pdbx_database_status.status_code_sf                  AUTH 
_pdbx_database_status.status_code_mr                  ? 
_pdbx_database_status.entry_id                        6MJH 
_pdbx_database_status.recvd_initial_deposition_date   2018-09-20 
_pdbx_database_status.SG_entry                        N 
_pdbx_database_status.deposit_site                    RCSB 
_pdbx_database_status.process_site                    RCSB 
_pdbx_database_status.status_code_cs                  ? 
_pdbx_database_status.methods_development_category    ? 
_pdbx_database_status.pdb_format_compatible           Y 
# 
loop_
_audit_author.name 
_audit_author.pdbx_ordinal 
_audit_author.identifier_ORCID 
'Thomaston, J.L.' 1 ? 
'DeGrado, W.F.'   2 ? 
# 
_citation.abstract                  ? 
_citation.abstract_id_CAS           ? 
_citation.book_id_ISBN              ? 
_citation.book_publisher            ? 
_citation.book_publisher_city       ? 
_citation.book_title                ? 
_citation.coordinate_linkage        ? 
_citation.country                   ? 
_citation.database_id_Medline       ? 
_citation.details                   ? 
_citation.id                        primary 
_citation.journal_abbrev            'To Be Published' 
_citation.journal_id_ASTM           ? 
_citation.journal_id_CSD            0353 
_citation.journal_id_ISSN           ? 
_citation.journal_full              ? 
_citation.journal_issue             ? 
_citation.journal_volume            ? 
_citation.language                  ? 
_citation.page_first                ? 
_citation.page_last                 ? 
_citation.title                     'The S31N mutant of influenza A M2 in two distinct conformational states' 
_citation.year                      ? 
_citation.database_id_CSD           ? 
_citation.pdbx_database_id_DOI      ? 
_citation.pdbx_database_id_PubMed   ? 
_citation.unpublished_flag          ? 
# 
loop_
_citation_author.citation_id 
_citation_author.name 
_citation_author.ordinal 
_citation_author.identifier_ORCID 
primary 'Thomaston, J.L.' 1 ? 
primary 'DeGrado, W.F.'   2 ? 
# 
_cell.angle_alpha                  90.00 
_cell.angle_alpha_esd              ? 
_cell.angle_beta                   103.60 
_cell.angle_beta_esd               ? 
_cell.angle_gamma                  90.00 
_cell.angle_gamma_esd              ? 
_cell.entry_id                     6MJH 
_cell.details                      ? 
_cell.formula_units_Z              ? 
_cell.length_a                     36.290 
_cell.length_a_esd                 ? 
_cell.length_b                     36.150 
_cell.length_b_esd                 ? 
_cell.length_c                     76.450 
_cell.length_c_esd                 ? 
_cell.volume                       ? 
_cell.volume_esd                   ? 
_cell.Z_PDB                        16 
_cell.reciprocal_angle_alpha       ? 
_cell.reciprocal_angle_beta        ? 
_cell.reciprocal_angle_gamma       ? 
_cell.reciprocal_angle_alpha_esd   ? 
_cell.reciprocal_angle_beta_esd    ? 
_cell.reciprocal_angle_gamma_esd   ? 
_cell.reciprocal_length_a          ? 
_cell.reciprocal_length_b          ? 
_cell.reciprocal_length_c          ? 
_cell.reciprocal_length_a_esd      ? 
_cell.reciprocal_length_b_esd      ? 
_cell.reciprocal_length_c_esd      ? 
_cell.pdbx_unique_axis             ? 
# 
_symmetry.entry_id                         6MJH 
_symmetry.cell_setting                     ? 
_symmetry.Int_Tables_number                4 
_symmetry.space_group_name_Hall            ? 
_symmetry.space_group_name_H-M             'P 1 21 1' 
_symmetry.pdbx_full_space_group_name_H-M   ? 
# 
loop_
_entity.id 
_entity.type 
_entity.src_method 
_entity.pdbx_description 
_entity.formula_weight 
_entity.pdbx_number_of_molecules 
_entity.pdbx_ec 
_entity.pdbx_mutation 
_entity.pdbx_fragment 
_entity.details 
1 polymer     syn 'Matrix protein 2' 2781.365 8  ? ? ? ? 
2 non-polymer man 'CALCIUM ION'      40.078   4  ? ? ? ? 
3 non-polymer syn 'CHLORIDE ION'     35.453   1  ? ? ? ? 
4 water       nat water              18.015   80 ? ? ? ? 
# 
_entity_poly.entity_id                      1 
_entity_poly.type                           'polypeptide(L)' 
_entity_poly.nstd_linkage                   no 
_entity_poly.nstd_monomer                   yes 
_entity_poly.pdbx_seq_one_letter_code       '(ACE)SSDPLVVAANIIGILHLILWILDRL(NH2)' 
_entity_poly.pdbx_seq_one_letter_code_can   XSSDPLVVAANIIGILHLILWILDRLX 
_entity_poly.pdbx_strand_id                 A,B,C,D,E,F,G,H 
_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  ACE n 
1 2  SER n 
1 3  SER n 
1 4  ASP n 
1 5  PRO n 
1 6  LEU n 
1 7  VAL n 
1 8  VAL n 
1 9  ALA n 
1 10 ALA n 
1 11 ASN n 
1 12 ILE n 
1 13 ILE n 
1 14 GLY n 
1 15 ILE n 
1 16 LEU n 
1 17 HIS n 
1 18 LEU n 
1 19 ILE n 
1 20 LEU n 
1 21 TRP n 
1 22 ILE n 
1 23 LEU n 
1 24 ASP n 
1 25 ARG n 
1 26 LEU n 
1 27 NH2 n 
# 
_pdbx_entity_src_syn.entity_id              1 
_pdbx_entity_src_syn.pdbx_src_id            1 
_pdbx_entity_src_syn.pdbx_alt_source_flag   sample 
_pdbx_entity_src_syn.pdbx_beg_seq_num       1 
_pdbx_entity_src_syn.pdbx_end_seq_num       27 
_pdbx_entity_src_syn.organism_scientific    'Influenza A virus (A/pigeon/Jiangsu/K23/2013(H9N2))' 
_pdbx_entity_src_syn.organism_common_name   ? 
_pdbx_entity_src_syn.ncbi_taxonomy_id       1574560 
_pdbx_entity_src_syn.details                ? 
# 
_struct_ref.id                         1 
_struct_ref.db_name                    UNP 
_struct_ref.db_code                    A0A0R5TVW3_9INFA 
_struct_ref.pdbx_db_accession          A0A0R5TVW3 
_struct_ref.pdbx_db_isoform            ? 
_struct_ref.entity_id                  1 
_struct_ref.pdbx_seq_one_letter_code   SSDPLVVAANIIGILHLILWILDRL 
_struct_ref.pdbx_align_begin           20 
# 
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.pdbx_db_align_beg_ins_code 
_struct_ref_seq.db_align_end 
_struct_ref_seq.pdbx_db_align_end_ins_code 
_struct_ref_seq.pdbx_auth_seq_align_beg 
_struct_ref_seq.pdbx_auth_seq_align_end 
1 1 6MJH A 2 ? 26 ? A0A0R5TVW3 20 ? 44 ? 22 46 
2 1 6MJH B 2 ? 26 ? A0A0R5TVW3 20 ? 44 ? 22 46 
3 1 6MJH C 2 ? 26 ? A0A0R5TVW3 20 ? 44 ? 22 46 
4 1 6MJH D 2 ? 26 ? A0A0R5TVW3 20 ? 44 ? 22 46 
5 1 6MJH E 2 ? 26 ? A0A0R5TVW3 20 ? 44 ? 22 46 
6 1 6MJH F 2 ? 26 ? A0A0R5TVW3 20 ? 44 ? 22 46 
7 1 6MJH G 2 ? 26 ? A0A0R5TVW3 20 ? 44 ? 22 46 
8 1 6MJH H 2 ? 26 ? A0A0R5TVW3 20 ? 44 ? 22 46 
# 
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 6MJH ACE A 1  ? UNP A0A0R5TVW3 ? ? acetylation 21 1  
1 6MJH NH2 A 27 ? UNP A0A0R5TVW3 ? ? amidation   47 2  
2 6MJH ACE B 1  ? UNP A0A0R5TVW3 ? ? acetylation 21 3  
2 6MJH NH2 B 27 ? UNP A0A0R5TVW3 ? ? amidation   47 4  
3 6MJH ACE C 1  ? UNP A0A0R5TVW3 ? ? acetylation 21 5  
3 6MJH NH2 C 27 ? UNP A0A0R5TVW3 ? ? amidation   47 6  
4 6MJH ACE D 1  ? UNP A0A0R5TVW3 ? ? acetylation 21 7  
4 6MJH NH2 D 27 ? UNP A0A0R5TVW3 ? ? amidation   47 8  
5 6MJH ACE E 1  ? UNP A0A0R5TVW3 ? ? acetylation 21 9  
5 6MJH NH2 E 27 ? UNP A0A0R5TVW3 ? ? amidation   47 10 
6 6MJH ACE F 1  ? UNP A0A0R5TVW3 ? ? acetylation 21 11 
6 6MJH NH2 F 27 ? UNP A0A0R5TVW3 ? ? amidation   47 12 
7 6MJH ACE G 1  ? UNP A0A0R5TVW3 ? ? acetylation 21 13 
7 6MJH NH2 G 27 ? UNP A0A0R5TVW3 ? ? amidation   47 14 
8 6MJH ACE H 1  ? UNP A0A0R5TVW3 ? ? acetylation 21 15 
8 6MJH NH2 H 27 ? UNP A0A0R5TVW3 ? ? amidation   47 16 
# 
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 
ACE non-polymer         . 'ACETYL GROUP'  ? 'C2 H4 O'        44.053  
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 
CA  non-polymer         . 'CALCIUM ION'   ? 'Ca 2'           40.078  
CL  non-polymer         . 'CHLORIDE ION'  ? 'Cl -1'          35.453  
GLY 'peptide linking'   y GLYCINE         ? 'C2 H5 N O2'     75.067  
HIS 'L-peptide linking' y HISTIDINE       ? 'C6 H10 N3 O2 1' 156.162 
HOH non-polymer         . WATER           ? 'H2 O'           18.015  
ILE 'L-peptide linking' y ISOLEUCINE      ? 'C6 H13 N O2'    131.173 
LEU 'L-peptide linking' y LEUCINE         ? 'C6 H13 N O2'    131.173 
NH2 non-polymer         . 'AMINO GROUP'   ? 'H2 N'           16.023  
PRO 'L-peptide linking' y PROLINE         ? 'C5 H9 N O2'     115.130 
SER 'L-peptide linking' y SERINE          ? 'C3 H7 N O3'     105.093 
TRP 'L-peptide linking' y TRYPTOPHAN      ? 'C11 H12 N2 O2'  204.225 
VAL 'L-peptide linking' y VALINE          ? 'C5 H11 N O2'    117.146 
# 
_exptl.absorpt_coefficient_mu     ? 
_exptl.absorpt_correction_T_max   ? 
_exptl.absorpt_correction_T_min   ? 
_exptl.absorpt_correction_type    ? 
_exptl.absorpt_process_details    ? 
_exptl.entry_id                   6MJH 
_exptl.crystals_number            1 
_exptl.details                    ? 
_exptl.method                     'X-RAY DIFFRACTION' 
_exptl.method_details             ? 
# 
_exptl_crystal.colour                      ? 
_exptl_crystal.density_diffrn              ? 
_exptl_crystal.density_Matthews            2.19 
_exptl_crystal.density_method              ? 
_exptl_crystal.density_percent_sol         43.85 
_exptl_crystal.description                 ? 
_exptl_crystal.F_000                       ? 
_exptl_crystal.id                          1 
_exptl_crystal.preparation                 ? 
_exptl_crystal.size_max                    ? 
_exptl_crystal.size_mid                    ? 
_exptl_crystal.size_min                    ? 
_exptl_crystal.size_rad                    ? 
_exptl_crystal.colour_lustre               ? 
_exptl_crystal.colour_modifier             ? 
_exptl_crystal.colour_primary              ? 
_exptl_crystal.density_meas                ? 
_exptl_crystal.density_meas_esd            ? 
_exptl_crystal.density_meas_gt             ? 
_exptl_crystal.density_meas_lt             ? 
_exptl_crystal.density_meas_temp           ? 
_exptl_crystal.density_meas_temp_esd       ? 
_exptl_crystal.density_meas_temp_gt        ? 
_exptl_crystal.density_meas_temp_lt        ? 
_exptl_crystal.pdbx_crystal_image_url      ? 
_exptl_crystal.pdbx_crystal_image_format   ? 
_exptl_crystal.pdbx_mosaicity              ? 
_exptl_crystal.pdbx_mosaicity_esd          ? 
# 
_exptl_crystal_grow.apparatus       ? 
_exptl_crystal_grow.atmosphere      ? 
_exptl_crystal_grow.crystal_id      1 
_exptl_crystal_grow.details         ? 
_exptl_crystal_grow.method          'LIPIDIC CUBIC PHASE' 
_exptl_crystal_grow.method_ref      ? 
_exptl_crystal_grow.pH              5.0 
_exptl_crystal_grow.pressure        ? 
_exptl_crystal_grow.pressure_esd    ? 
_exptl_crystal_grow.seeding         ? 
_exptl_crystal_grow.seeding_ref     ? 
_exptl_crystal_grow.temp            277 
_exptl_crystal_grow.temp_details    ? 
_exptl_crystal_grow.temp_esd        ? 
_exptl_crystal_grow.time            ? 
_exptl_crystal_grow.pdbx_details    
;LCP: monoolein, M2TM S31N monomer, and 50 mM MNG-3-C8 detergent
Precipitant solution: 0.2 M NaCl, 0.05 M calcium acetate pH 5.0, 29% v/v PEG 400
;
_exptl_crystal_grow.pdbx_pH_range   ? 
# 
_diffrn.ambient_environment              ? 
_diffrn.ambient_temp                     100 
_diffrn.ambient_temp_details             ? 
_diffrn.ambient_temp_esd                 ? 
_diffrn.crystal_id                       1 
_diffrn.crystal_support                  ? 
_diffrn.crystal_treatment                ? 
_diffrn.details                          ? 
_diffrn.id                               1 
_diffrn.ambient_pressure                 ? 
_diffrn.ambient_pressure_esd             ? 
_diffrn.ambient_pressure_gt              ? 
_diffrn.ambient_pressure_lt              ? 
_diffrn.ambient_temp_gt                  ? 
_diffrn.ambient_temp_lt                  ? 
_diffrn.pdbx_serial_crystal_experiment   ? 
# 
_diffrn_detector.details                      ? 
_diffrn_detector.detector                     PIXEL 
_diffrn_detector.diffrn_id                    1 
_diffrn_detector.type                         'DECTRIS PILATUS3 S 6M' 
_diffrn_detector.area_resol_mean              ? 
_diffrn_detector.dtime                        ? 
_diffrn_detector.pdbx_frames_total            ? 
_diffrn_detector.pdbx_collection_time_total   ? 
_diffrn_detector.pdbx_collection_date         2018-05-06 
_diffrn_detector.pdbx_frequency               ? 
# 
_diffrn_radiation.collimation                      ? 
_diffrn_radiation.diffrn_id                        1 
_diffrn_radiation.filter_edge                      ? 
_diffrn_radiation.inhomogeneity                    ? 
_diffrn_radiation.monochromator                    ? 
_diffrn_radiation.polarisn_norm                    ? 
_diffrn_radiation.polarisn_ratio                   ? 
_diffrn_radiation.probe                            ? 
_diffrn_radiation.type                             ? 
_diffrn_radiation.xray_symbol                      ? 
_diffrn_radiation.wavelength_id                    1 
_diffrn_radiation.pdbx_monochromatic_or_laue_m_l   M 
_diffrn_radiation.pdbx_wavelength_list             ? 
_diffrn_radiation.pdbx_wavelength                  ? 
_diffrn_radiation.pdbx_diffrn_protocol             'SINGLE WAVELENGTH' 
_diffrn_radiation.pdbx_analyzer                    ? 
_diffrn_radiation.pdbx_scattering_type             x-ray 
# 
_diffrn_radiation_wavelength.id           1 
_diffrn_radiation_wavelength.wavelength   1.1158 
_diffrn_radiation_wavelength.wt           1.0 
# 
_diffrn_source.current                     ? 
_diffrn_source.details                     ? 
_diffrn_source.diffrn_id                   1 
_diffrn_source.power                       ? 
_diffrn_source.size                        ? 
_diffrn_source.source                      SYNCHROTRON 
_diffrn_source.target                      ? 
_diffrn_source.type                        'ALS BEAMLINE 8.3.1' 
_diffrn_source.voltage                     ? 
_diffrn_source.take-off_angle              ? 
_diffrn_source.pdbx_wavelength_list        1.1158 
_diffrn_source.pdbx_wavelength             ? 
_diffrn_source.pdbx_synchrotron_beamline   8.3.1 
_diffrn_source.pdbx_synchrotron_site       ALS 
# 
_reflns.B_iso_Wilson_estimate            ? 
_reflns.entry_id                         6MJH 
_reflns.data_reduction_details           ? 
_reflns.data_reduction_method            ? 
_reflns.d_resolution_high                2.06 
_reflns.d_resolution_low                 37.15 
_reflns.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.number_all                       ? 
_reflns.number_obs                       11019 
_reflns.observed_criterion               ? 
_reflns.observed_criterion_F_max         ? 
_reflns.observed_criterion_F_min         ? 
_reflns.observed_criterion_I_max         ? 
_reflns.observed_criterion_I_min         ? 
_reflns.observed_criterion_sigma_F       ? 
_reflns.observed_criterion_sigma_I       2 
_reflns.percent_possible_obs             91.1 
_reflns.R_free_details                   ? 
_reflns.Rmerge_F_all                     ? 
_reflns.Rmerge_F_obs                     ? 
_reflns.Friedel_coverage                 ? 
_reflns.number_gt                        ? 
_reflns.threshold_expression             ? 
_reflns.pdbx_redundancy                  5.7 
_reflns.pdbx_Rmerge_I_obs                ? 
_reflns.pdbx_Rmerge_I_all                ? 
_reflns.pdbx_Rsym_value                  ? 
_reflns.pdbx_netI_over_av_sigmaI         ? 
_reflns.pdbx_netI_over_sigmaI            8.0 
_reflns.pdbx_res_netI_over_av_sigmaI_2   ? 
_reflns.pdbx_res_netI_over_sigmaI_2      ? 
_reflns.pdbx_chi_squared                 ? 
_reflns.pdbx_scaling_rejects             ? 
_reflns.pdbx_d_res_high_opt              ? 
_reflns.pdbx_d_res_low_opt               ? 
_reflns.pdbx_d_res_opt_method            ? 
_reflns.phase_calculation_details        ? 
_reflns.pdbx_Rrim_I_all                  ? 
_reflns.pdbx_Rpim_I_all                  0.062 
_reflns.pdbx_d_opt                       ? 
_reflns.pdbx_number_measured_all         ? 
_reflns.pdbx_diffrn_id                   1 
_reflns.pdbx_ordinal                     1 
_reflns.pdbx_CC_half                     0.997 
_reflns.pdbx_R_split                     ? 
# 
_reflns_shell.d_res_high                  2.06 
_reflns_shell.d_res_low                   2.12 
_reflns_shell.meanI_over_sigI_all         ? 
_reflns_shell.meanI_over_sigI_obs         2.1 
_reflns_shell.number_measured_all         ? 
_reflns_shell.number_measured_obs         ? 
_reflns_shell.number_possible             ? 
_reflns_shell.number_unique_all           ? 
_reflns_shell.number_unique_obs           780 
_reflns_shell.percent_possible_all        82.6 
_reflns_shell.percent_possible_obs        ? 
_reflns_shell.Rmerge_F_all                ? 
_reflns_shell.Rmerge_F_obs                ? 
_reflns_shell.Rmerge_I_all                ? 
_reflns_shell.Rmerge_I_obs                ? 
_reflns_shell.meanI_over_sigI_gt          ? 
_reflns_shell.meanI_over_uI_all           ? 
_reflns_shell.meanI_over_uI_gt            ? 
_reflns_shell.number_measured_gt          ? 
_reflns_shell.number_unique_gt            ? 
_reflns_shell.percent_possible_gt         ? 
_reflns_shell.Rmerge_F_gt                 ? 
_reflns_shell.Rmerge_I_gt                 ? 
_reflns_shell.pdbx_redundancy             5.0 
_reflns_shell.pdbx_Rsym_value             ? 
_reflns_shell.pdbx_chi_squared            ? 
_reflns_shell.pdbx_netI_over_sigmaI_all   ? 
_reflns_shell.pdbx_netI_over_sigmaI_obs   ? 
_reflns_shell.pdbx_Rrim_I_all             ? 
_reflns_shell.pdbx_Rpim_I_all             0.476 
_reflns_shell.pdbx_rejects                ? 
_reflns_shell.pdbx_ordinal                1 
_reflns_shell.pdbx_diffrn_id              1 
_reflns_shell.pdbx_CC_half                0.666 
_reflns_shell.pdbx_R_split                ? 
# 
_refine.aniso_B[1][1]                            ? 
_refine.aniso_B[1][2]                            ? 
_refine.aniso_B[1][3]                            ? 
_refine.aniso_B[2][2]                            ? 
_refine.aniso_B[2][3]                            ? 
_refine.aniso_B[3][3]                            ? 
_refine.B_iso_max                                ? 
_refine.B_iso_mean                               ? 
_refine.B_iso_min                                ? 
_refine.correlation_coeff_Fo_to_Fc               ? 
_refine.correlation_coeff_Fo_to_Fc_free          ? 
_refine.details                                  ? 
_refine.diff_density_max                         ? 
_refine.diff_density_max_esd                     ? 
_refine.diff_density_min                         ? 
_refine.diff_density_min_esd                     ? 
_refine.diff_density_rms                         ? 
_refine.diff_density_rms_esd                     ? 
_refine.entry_id                                 6MJH 
_refine.pdbx_refine_id                           'X-RAY DIFFRACTION' 
_refine.ls_abs_structure_details                 ? 
_refine.ls_abs_structure_Flack                   ? 
_refine.ls_abs_structure_Flack_esd               ? 
_refine.ls_abs_structure_Rogers                  ? 
_refine.ls_abs_structure_Rogers_esd              ? 
_refine.ls_d_res_high                            2.060 
_refine.ls_d_res_low                             35.236 
_refine.ls_extinction_coef                       ? 
_refine.ls_extinction_coef_esd                   ? 
_refine.ls_extinction_expression                 ? 
_refine.ls_extinction_method                     ? 
_refine.ls_goodness_of_fit_all                   ? 
_refine.ls_goodness_of_fit_all_esd               ? 
_refine.ls_goodness_of_fit_obs                   ? 
_refine.ls_goodness_of_fit_obs_esd               ? 
_refine.ls_hydrogen_treatment                    ? 
_refine.ls_matrix_type                           ? 
_refine.ls_number_constraints                    ? 
_refine.ls_number_parameters                     ? 
_refine.ls_number_reflns_all                     ? 
_refine.ls_number_reflns_obs                     10997 
_refine.ls_number_reflns_R_free                  1099 
_refine.ls_number_reflns_R_work                  ? 
_refine.ls_number_restraints                     ? 
_refine.ls_percent_reflns_obs                    90.32 
_refine.ls_percent_reflns_R_free                 9.99 
_refine.ls_R_factor_all                          ? 
_refine.ls_R_factor_obs                          0.2199 
_refine.ls_R_factor_R_free                       0.2485 
_refine.ls_R_factor_R_free_error                 ? 
_refine.ls_R_factor_R_free_error_details         ? 
_refine.ls_R_factor_R_work                       0.2168 
_refine.ls_R_Fsqd_factor_obs                     ? 
_refine.ls_R_I_factor_obs                        ? 
_refine.ls_redundancy_reflns_all                 ? 
_refine.ls_redundancy_reflns_obs                 ? 
_refine.ls_restrained_S_all                      ? 
_refine.ls_restrained_S_obs                      ? 
_refine.ls_shift_over_esd_max                    ? 
_refine.ls_shift_over_esd_mean                   ? 
_refine.ls_structure_factor_coef                 ? 
_refine.ls_weighting_details                     ? 
_refine.ls_weighting_scheme                      ? 
_refine.ls_wR_factor_all                         ? 
_refine.ls_wR_factor_obs                         ? 
_refine.ls_wR_factor_R_free                      ? 
_refine.ls_wR_factor_R_work                      ? 
_refine.occupancy_max                            ? 
_refine.occupancy_min                            ? 
_refine.solvent_model_details                    ? 
_refine.solvent_model_param_bsol                 ? 
_refine.solvent_model_param_ksol                 ? 
_refine.ls_R_factor_gt                           ? 
_refine.ls_goodness_of_fit_gt                    ? 
_refine.ls_goodness_of_fit_ref                   ? 
_refine.ls_shift_over_su_max                     ? 
_refine.ls_shift_over_su_max_lt                  ? 
_refine.ls_shift_over_su_mean                    ? 
_refine.ls_shift_over_su_mean_lt                 ? 
_refine.pdbx_ls_sigma_I                          ? 
_refine.pdbx_ls_sigma_F                          1.35 
_refine.pdbx_ls_sigma_Fsqd                       ? 
_refine.pdbx_data_cutoff_high_absF               ? 
_refine.pdbx_data_cutoff_high_rms_absF           ? 
_refine.pdbx_data_cutoff_low_absF                ? 
_refine.pdbx_isotropic_thermal_model             ? 
_refine.pdbx_ls_cross_valid_method               'FREE R-VALUE' 
_refine.pdbx_method_to_determine_struct          'MOLECULAR REPLACEMENT' 
_refine.pdbx_starting_model                      '3LBW, 5JOO' 
_refine.pdbx_stereochemistry_target_values       ? 
_refine.pdbx_R_Free_selection_details            ? 
_refine.pdbx_stereochem_target_val_spec_case     ? 
_refine.pdbx_overall_ESU_R                       ? 
_refine.pdbx_overall_ESU_R_Free                  ? 
_refine.pdbx_solvent_vdw_probe_radii             1.11 
_refine.pdbx_solvent_ion_probe_radii             ? 
_refine.pdbx_solvent_shrinkage_radii             0.90 
_refine.pdbx_real_space_R                        ? 
_refine.pdbx_density_correlation                 ? 
_refine.pdbx_pd_number_of_powder_patterns        ? 
_refine.pdbx_pd_number_of_points                 ? 
_refine.pdbx_pd_meas_number_of_points            ? 
_refine.pdbx_pd_proc_ls_prof_R_factor            ? 
_refine.pdbx_pd_proc_ls_prof_wR_factor           ? 
_refine.pdbx_pd_Marquardt_correlation_coeff      ? 
_refine.pdbx_pd_Fsqrd_R_factor                   ? 
_refine.pdbx_pd_ls_matrix_band_width             ? 
_refine.pdbx_overall_phase_error                 24.99 
_refine.pdbx_overall_SU_R_free_Cruickshank_DPI   ? 
_refine.pdbx_overall_SU_R_free_Blow_DPI          ? 
_refine.pdbx_overall_SU_R_Blow_DPI               ? 
_refine.pdbx_TLS_residual_ADP_flag               ? 
_refine.pdbx_diffrn_id                           1 
_refine.overall_SU_B                             ? 
_refine.overall_SU_ML                            0.23 
_refine.overall_SU_R_Cruickshank_DPI             ? 
_refine.overall_SU_R_free                        ? 
_refine.overall_FOM_free_R_set                   ? 
_refine.overall_FOM_work_R_set                   ? 
_refine.pdbx_average_fsc_overall                 ? 
_refine.pdbx_average_fsc_work                    ? 
_refine.pdbx_average_fsc_free                    ? 
# 
_refine_hist.pdbx_refine_id                   'X-RAY DIFFRACTION' 
_refine_hist.cycle_id                         LAST 
_refine_hist.pdbx_number_atoms_protein        1584 
_refine_hist.pdbx_number_atoms_nucleic_acid   0 
_refine_hist.pdbx_number_atoms_ligand         5 
_refine_hist.number_atoms_solvent             80 
_refine_hist.number_atoms_total               1669 
_refine_hist.d_res_high                       2.060 
_refine_hist.d_res_low                        35.236 
# 
loop_
_refine_ls_restr.pdbx_refine_id 
_refine_ls_restr.criterion 
_refine_ls_restr.dev_ideal 
_refine_ls_restr.dev_ideal_target 
_refine_ls_restr.number 
_refine_ls_restr.rejects 
_refine_ls_restr.type 
_refine_ls_restr.weight 
_refine_ls_restr.pdbx_restraint_function 
'X-RAY DIFFRACTION' ? 0.002  ? 1600 ? f_bond_d           ? ? 
'X-RAY DIFFRACTION' ? 0.573  ? 2192 ? f_angle_d          ? ? 
'X-RAY DIFFRACTION' ? 12.031 ? 944  ? f_dihedral_angle_d ? ? 
'X-RAY DIFFRACTION' ? 0.040  ? 296  ? f_chiral_restr     ? ? 
'X-RAY DIFFRACTION' ? 0.004  ? 256  ? f_plane_restr      ? ? 
# 
loop_
_refine_ls_shell.pdbx_refine_id 
_refine_ls_shell.d_res_high 
_refine_ls_shell.d_res_low 
_refine_ls_shell.number_reflns_all 
_refine_ls_shell.number_reflns_obs 
_refine_ls_shell.number_reflns_R_free 
_refine_ls_shell.number_reflns_R_work 
_refine_ls_shell.percent_reflns_obs 
_refine_ls_shell.percent_reflns_R_free 
_refine_ls_shell.R_factor_all 
_refine_ls_shell.R_factor_obs 
_refine_ls_shell.R_factor_R_free 
_refine_ls_shell.R_factor_R_free_error 
_refine_ls_shell.R_factor_R_work 
_refine_ls_shell.redundancy_reflns_all 
_refine_ls_shell.redundancy_reflns_obs 
_refine_ls_shell.wR_factor_all 
_refine_ls_shell.wR_factor_obs 
_refine_ls_shell.wR_factor_R_free 
_refine_ls_shell.wR_factor_R_work 
_refine_ls_shell.pdbx_total_number_of_bins_used 
_refine_ls_shell.pdbx_phase_error 
_refine_ls_shell.pdbx_fsc_work 
_refine_ls_shell.pdbx_fsc_free 
'X-RAY DIFFRACTION' 2.0601 2.1539  . . 125 1121 82.00 . . . 0.3193 . 0.2567 . . . . . . . . . . 
'X-RAY DIFFRACTION' 2.1539 2.2674  . . 129 1157 86.00 . . . 0.2973 . 0.2189 . . . . . . . . . . 
'X-RAY DIFFRACTION' 2.2674 2.4094  . . 137 1231 90.00 . . . 0.2266 . 0.2079 . . . . . . . . . . 
'X-RAY DIFFRACTION' 2.4094 2.5954  . . 138 1245 92.00 . . . 0.2658 . 0.2003 . . . . . . . . . . 
'X-RAY DIFFRACTION' 2.5954 2.8565  . . 139 1246 92.00 . . . 0.2398 . 0.2078 . . . . . . . . . . 
'X-RAY DIFFRACTION' 2.8565 3.2696  . . 143 1300 94.00 . . . 0.2469 . 0.2125 . . . . . . . . . . 
'X-RAY DIFFRACTION' 3.2696 4.1183  . . 141 1260 93.00 . . . 0.2280 . 0.1943 . . . . . . . . . . 
'X-RAY DIFFRACTION' 4.1183 35.2409 . . 147 1338 93.00 . . . 0.2458 . 0.2414 . . . . . . . . . . 
# 
_struct.entry_id                     6MJH 
_struct.title                        'The S31N mutant of the influenza A M2 proton channel in two distinct conformational states' 
_struct.pdbx_descriptor              'Matrix protein 2' 
_struct.pdbx_model_details           ? 
_struct.pdbx_formula_weight          ? 
_struct.pdbx_formula_weight_method   ? 
_struct.pdbx_model_type_details      ? 
_struct.pdbx_CASP_flag               N 
# 
_struct_keywords.entry_id        6MJH 
_struct_keywords.text            'viral protein, proton channel, S31N, MEMBRANE PROTEIN' 
_struct_keywords.pdbx_keywords   'MEMBRANE 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 1 ? 
C N N 1 ? 
D N N 1 ? 
E N N 1 ? 
F N N 1 ? 
G N N 1 ? 
H N N 1 ? 
I N N 2 ? 
J N N 2 ? 
K N N 2 ? 
L N N 2 ? 
M N N 3 ? 
N N N 4 ? 
O N N 4 ? 
P N N 4 ? 
Q N N 4 ? 
R N N 4 ? 
S N N 4 ? 
T N N 4 ? 
U N N 4 ? 
# 
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 AA1 ASP A 4 ? LEU A 26 ? ASP A 24 LEU A 46 1 ? 23 
HELX_P HELX_P2 AA2 ASP B 4 ? LEU B 26 ? ASP B 24 LEU B 46 1 ? 23 
HELX_P HELX_P3 AA3 ASP C 4 ? LEU C 26 ? ASP C 24 LEU C 46 1 ? 23 
HELX_P HELX_P4 AA4 ASP D 4 ? LEU D 26 ? ASP D 24 LEU D 46 1 ? 23 
HELX_P HELX_P5 AA5 ASP E 4 ? LEU E 26 ? ASP E 24 LEU E 46 1 ? 23 
HELX_P HELX_P6 AA6 ASP F 4 ? LEU F 26 ? ASP F 24 LEU F 46 1 ? 23 
HELX_P HELX_P7 AA7 ASP G 4 ? LEU G 26 ? ASP G 24 LEU G 46 1 ? 23 
HELX_P HELX_P8 AA8 ASP H 4 ? LEU H 26 ? ASP H 24 LEU H 46 1 ? 23 
# 
_struct_conf_type.id          HELX_P 
_struct_conf_type.criteria    ? 
_struct_conf_type.reference   ? 
# 
loop_
_struct_conn.id 
_struct_conn.conn_type_id 
_struct_conn.pdbx_leaving_atom_flag 
_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 both ? A ACE 1  C   ? ? ? 1_555 A SER 2  N  ? ? A ACE 21  A SER 22  1_555 ? ? ? ? ? ? ? 1.331 ? 
metalc1  metalc ?    ? A ASP 24 O   ? ? ? 1_555 I CA  .  CA ? ? A ASP 44  A CA  101 1_555 ? ? ? ? ? ? ? 2.870 ? 
metalc2  metalc ?    ? A ASP 24 OD1 ? ? ? 1_555 I CA  .  CA ? ? A ASP 44  A CA  101 1_555 ? ? ? ? ? ? ? 2.248 ? 
covale2  covale both ? A LEU 26 C   ? ? ? 1_555 A NH2 27 N  ? ? A LEU 46  A NH2 47  1_555 ? ? ? ? ? ? ? 1.328 ? 
covale3  covale both ? B ACE 1  C   ? ? ? 1_555 B SER 2  N  ? ? B ACE 21  B SER 22  1_555 ? ? ? ? ? ? ? 1.332 ? 
metalc3  metalc ?    ? B ASP 24 O   ? ? ? 1_555 J CA  .  CA ? ? B ASP 44  B CA  101 1_555 ? ? ? ? ? ? ? 2.518 ? 
metalc4  metalc ?    ? B ASP 24 OD1 ? ? ? 1_555 J CA  .  CA ? ? B ASP 44  B CA  101 1_555 ? ? ? ? ? ? ? 2.392 ? 
covale4  covale both ? B LEU 26 C   ? ? ? 1_555 B NH2 27 N  ? ? B LEU 46  B NH2 47  1_555 ? ? ? ? ? ? ? 1.329 ? 
covale5  covale both ? C ACE 1  C   ? ? ? 1_555 C SER 2  N  ? ? C ACE 21  C SER 22  1_555 ? ? ? ? ? ? ? 1.331 ? 
covale6  covale both ? C LEU 26 C   ? ? ? 1_555 C NH2 27 N  ? ? C LEU 46  C NH2 47  1_555 ? ? ? ? ? ? ? 1.329 ? 
covale7  covale both ? D ACE 1  C   ? ? ? 1_555 D SER 2  N  ? ? D ACE 21  D SER 22  1_555 ? ? ? ? ? ? ? 1.328 ? 
metalc5  metalc ?    ? D ASP 24 O   ? ? ? 1_555 K CA  .  CA ? ? D ASP 44  D CA  101 1_555 ? ? ? ? ? ? ? 2.725 ? 
metalc6  metalc ?    ? D ASP 24 OD1 ? ? ? 1_555 K CA  .  CA ? ? D ASP 44  D CA  101 1_555 ? ? ? ? ? ? ? 2.650 ? 
covale8  covale both ? D LEU 26 C   ? ? ? 1_555 D NH2 27 N  ? ? D LEU 46  D NH2 47  1_555 ? ? ? ? ? ? ? 1.329 ? 
covale9  covale both ? E ACE 1  C   ? ? ? 1_555 E SER 2  N  ? ? E ACE 21  E SER 22  1_555 ? ? ? ? ? ? ? 1.325 ? 
metalc7  metalc ?    ? E SER 2  O   ? ? ? 1_555 L CA  .  CA ? ? E SER 22  E CA  101 1_555 ? ? ? ? ? ? ? 2.455 ? 
covale10 covale both ? E LEU 26 C   ? ? ? 1_555 E NH2 27 N  ? ? E LEU 46  E NH2 47  1_555 ? ? ? ? ? ? ? 1.329 ? 
covale11 covale both ? F ACE 1  C   ? ? ? 1_555 F SER 2  N  ? ? F ACE 21  F SER 22  1_555 ? ? ? ? ? ? ? 1.326 ? 
metalc8  metalc ?    ? F SER 2  O   ? ? ? 1_555 L CA  .  CA ? ? F SER 22  E CA  101 1_555 ? ? ? ? ? ? ? 2.558 ? 
covale12 covale both ? F LEU 26 C   ? ? ? 1_555 F NH2 27 N  ? ? F LEU 46  F NH2 47  1_555 ? ? ? ? ? ? ? 1.330 ? 
covale13 covale both ? G ACE 1  C   ? ? ? 1_555 G SER 2  N  ? ? G ACE 21  G SER 22  1_555 ? ? ? ? ? ? ? 1.329 ? 
metalc9  metalc ?    ? G SER 2  O   ? ? ? 1_555 L CA  .  CA ? ? G SER 22  E CA  101 1_555 ? ? ? ? ? ? ? 2.496 ? 
covale14 covale both ? G LEU 26 C   ? ? ? 1_555 G NH2 27 N  ? ? G LEU 46  G NH2 47  1_555 ? ? ? ? ? ? ? 1.327 ? 
covale15 covale both ? H ACE 1  C   ? ? ? 1_555 H SER 2  N  ? ? H ACE 21  H SER 22  1_555 ? ? ? ? ? ? ? 1.328 ? 
metalc10 metalc ?    ? H SER 2  O   ? ? ? 1_555 L CA  .  CA ? ? H SER 22  E CA  101 1_555 ? ? ? ? ? ? ? 2.428 ? 
covale16 covale both ? H LEU 26 C   ? ? ? 1_555 H NH2 27 N  ? ? H LEU 46  H NH2 47  1_555 ? ? ? ? ? ? ? 1.329 ? 
metalc11 metalc ?    ? J CA  .  CA  ? ? ? 1_555 O HOH .  O  ? ? B CA  101 B HOH 206 1_555 ? ? ? ? ? ? ? 2.599 ? 
metalc12 metalc ?    ? J CA  .  CA  ? ? ? 1_555 O HOH .  O  ? ? B CA  101 B HOH 205 1_555 ? ? ? ? ? ? ? 2.943 ? 
metalc13 metalc ?    ? K CA  .  CA  ? ? ? 1_555 Q HOH .  O  ? ? D CA  101 D HOH 205 1_555 ? ? ? ? ? ? ? 2.834 ? 
metalc14 metalc ?    ? K CA  .  CA  ? ? ? 1_555 Q HOH .  O  ? ? D CA  101 D HOH 204 1_555 ? ? ? ? ? ? ? 3.177 ? 
metalc15 metalc ?    ? L CA  .  CA  ? ? ? 1_555 S HOH .  O  ? ? E CA  101 F HOH 101 1_555 ? ? ? ? ? ? ? 2.869 ? 
metalc16 metalc ?    ? L CA  .  CA  ? ? ? 1_555 R HOH .  O  ? ? E CA  101 E HOH 201 1_555 ? ? ? ? ? ? ? 2.659 ? 
metalc17 metalc ?    ? L CA  .  CA  ? ? ? 1_555 T HOH .  O  ? ? E CA  101 G HOH 201 1_555 ? ? ? ? ? ? ? 2.763 ? 
metalc18 metalc ?    ? L CA  .  CA  ? ? ? 1_555 U HOH .  O  ? ? E CA  101 H HOH 102 1_555 ? ? ? ? ? ? ? 2.729 ? 
metalc19 metalc ?    ? I CA  .  CA  ? ? ? 1_555 P HOH .  O  ? ? A CA  101 C HOH 101 2_541 ? ? ? ? ? ? ? 2.600 ? 
metalc20 metalc ?    ? J CA  .  CA  ? ? ? 1_555 T HOH .  O  ? ? B CA  101 G HOH 205 2_551 ? ? ? ? ? ? ? 2.676 ? 
# 
loop_
_struct_conn_type.id 
_struct_conn_type.criteria 
_struct_conn_type.reference 
covale ? ? 
metalc ? ? 
# 
loop_
_struct_site.id 
_struct_site.pdbx_evidence_code 
_struct_site.pdbx_auth_asym_id 
_struct_site.pdbx_auth_comp_id 
_struct_site.pdbx_auth_seq_id 
_struct_site.pdbx_auth_ins_code 
_struct_site.pdbx_num_residues 
_struct_site.details 
AC1 Software A CA  101 ? 4  'binding site for residue CA A 101'                 
AC2 Software B CA  101 ? 5  'binding site for residue CA B 101'                 
AC3 Software D CA  101 ? 5  'binding site for residue CA D 101'                 
AC4 Software E CA  101 ? 8  'binding site for residue CA E 101'                 
AC5 Software G CL  101 ? 4  'binding site for residue CL G 101'                 
AC6 Software B ACE 21  ? 2  'binding site for Di-peptide ACE B 21 and SER B 22' 
AC7 Software B LEU 46  ? 4  'binding site for Di-peptide LEU B 46 and NH2 B 47' 
AC8 Software C ACE 21  ? 2  'binding site for Di-peptide ACE C 21 and SER C 22' 
AC9 Software C LEU 46  ? 5  'binding site for Di-peptide LEU C 46 and NH2 C 47' 
AD1 Software D ACE 21  ? 1  'binding site for Di-peptide ACE D 21 and SER D 22' 
AD2 Software D LEU 46  ? 4  'binding site for Di-peptide LEU D 46 and NH2 D 47' 
AD3 Software E ACE 21  ? 8  'binding site for Di-peptide ACE E 21 and SER E 22' 
AD4 Software E LEU 46  ? 7  'binding site for Di-peptide LEU E 46 and NH2 E 47' 
AD5 Software F ACE 21  ? 9  'binding site for Di-peptide ACE F 21 and SER F 22' 
AD6 Software F LEU 46  ? 7  'binding site for Di-peptide LEU F 46 and NH2 F 47' 
AD7 Software G ACE 21  ? 10 'binding site for Di-peptide ACE G 21 and SER G 22' 
AD8 Software G LEU 46  ? 8  'binding site for Di-peptide LEU G 46 and NH2 G 47' 
AD9 Software H ACE 21  ? 9  'binding site for Di-peptide ACE H 21 and SER H 22' 
AE1 Software H LEU 46  ? 7  'binding site for Di-peptide LEU H 46 and NH2 H 47' 
# 
loop_
_struct_site_gen.id 
_struct_site_gen.site_id 
_struct_site_gen.pdbx_num_res 
_struct_site_gen.label_comp_id 
_struct_site_gen.label_asym_id 
_struct_site_gen.label_seq_id 
_struct_site_gen.pdbx_auth_ins_code 
_struct_site_gen.auth_comp_id 
_struct_site_gen.auth_asym_id 
_struct_site_gen.auth_seq_id 
_struct_site_gen.label_atom_id 
_struct_site_gen.label_alt_id 
_struct_site_gen.symmetry 
_struct_site_gen.details 
1   AC1 4  ASP A 24 ? ASP A 44  . ? 1_555 ? 
2   AC1 4  ARG B 25 ? ARG B 45  . ? 1_555 ? 
3   AC1 4  LEU E 26 ? LEU E 46  . ? 1_455 ? 
4   AC1 4  NH2 E 27 ? NH2 E 47  . ? 1_455 ? 
5   AC2 5  ASP B 24 ? ASP B 44  . ? 1_555 ? 
6   AC2 5  HOH O .  ? HOH B 205 . ? 1_555 ? 
7   AC2 5  HOH O .  ? HOH B 206 . ? 1_555 ? 
8   AC2 5  LEU F 26 ? LEU F 46  . ? 1_465 ? 
9   AC2 5  NH2 F 27 ? NH2 F 47  . ? 1_465 ? 
10  AC3 5  ARG A 25 ? ARG A 45  . ? 1_555 ? 
11  AC3 5  ASP D 24 ? ASP D 44  . ? 1_555 ? 
12  AC3 5  HOH Q .  ? HOH D 205 . ? 1_555 ? 
13  AC3 5  LEU H 26 ? LEU H 46  . ? 1_555 ? 
14  AC3 5  NH2 H 27 ? NH2 H 47  . ? 1_555 ? 
15  AC4 8  SER E 2  ? SER E 22  . ? 1_555 ? 
16  AC4 8  HOH R .  ? HOH E 201 . ? 1_555 ? 
17  AC4 8  SER F 2  ? SER F 22  . ? 1_555 ? 
18  AC4 8  HOH S .  ? HOH F 101 . ? 1_555 ? 
19  AC4 8  SER G 2  ? SER G 22  . ? 1_555 ? 
20  AC4 8  HOH T .  ? HOH G 201 . ? 1_555 ? 
21  AC4 8  SER H 2  ? SER H 22  . ? 1_555 ? 
22  AC4 8  HOH U .  ? HOH H 102 . ? 1_555 ? 
23  AC5 4  SER E 3  ? SER E 23  . ? 1_555 ? 
24  AC5 4  SER F 3  ? SER F 23  . ? 1_555 ? 
25  AC5 4  SER G 3  ? SER G 23  . ? 1_555 ? 
26  AC5 4  SER H 3  ? SER H 23  . ? 1_555 ? 
27  AC6 2  SER B 3  ? SER B 23  . ? 1_555 ? 
28  AC6 2  HOH O .  ? HOH B 203 . ? 1_555 ? 
29  AC7 4  ILE B 22 ? ILE B 42  . ? 1_555 ? 
30  AC7 4  LEU B 23 ? LEU B 43  . ? 1_555 ? 
31  AC7 4  ASP B 24 ? ASP B 44  . ? 1_555 ? 
32  AC7 4  ARG B 25 ? ARG B 45  . ? 1_555 ? 
33  AC8 2  SER C 3  ? SER C 23  . ? 1_555 ? 
34  AC8 2  HOH P .  ? HOH C 102 . ? 1_555 ? 
35  AC9 5  ILE C 22 ? ILE C 42  . ? 1_555 ? 
36  AC9 5  LEU C 23 ? LEU C 43  . ? 1_555 ? 
37  AC9 5  ASP C 24 ? ASP C 44  . ? 1_555 ? 
38  AC9 5  ARG C 25 ? ARG C 45  . ? 1_555 ? 
39  AC9 5  ARG F 25 ? ARG F 45  . ? 1_465 ? 
40  AD1 1  SER D 3  ? SER D 23  . ? 1_555 ? 
41  AD2 4  ILE D 22 ? ILE D 42  . ? 1_555 ? 
42  AD2 4  LEU D 23 ? LEU D 43  . ? 1_555 ? 
43  AD2 4  ASP D 24 ? ASP D 44  . ? 1_555 ? 
44  AD2 4  ARG D 25 ? ARG D 45  . ? 1_555 ? 
45  AD3 8  SER E 3  ? SER E 23  . ? 1_555 ? 
46  AD3 8  CA  L .  ? CA  E 101 . ? 1_555 ? 
47  AD3 8  HOH R .  ? HOH E 201 . ? 1_555 ? 
48  AD3 8  SER F 2  ? SER F 22  . ? 1_555 ? 
49  AD3 8  SER H 2  ? SER H 22  . ? 1_555 ? 
50  AD3 8  SER H 3  ? SER H 23  . ? 1_555 ? 
51  AD3 8  ASP H 4  ? ASP H 24  . ? 1_555 ? 
52  AD3 8  HOH U .  ? HOH H 102 . ? 1_555 ? 
53  AD4 7  ASP A 24 ? ASP A 44  . ? 1_655 ? 
54  AD4 7  CA  I .  ? CA  A 101 . ? 1_655 ? 
55  AD4 7  ARG B 25 ? ARG B 45  . ? 1_655 ? 
56  AD4 7  ILE E 22 ? ILE E 42  . ? 1_555 ? 
57  AD4 7  LEU E 23 ? LEU E 43  . ? 1_555 ? 
58  AD4 7  ASP E 24 ? ASP E 44  . ? 1_555 ? 
59  AD4 7  ARG E 25 ? ARG E 45  . ? 1_555 ? 
60  AD5 9  SER E 2  ? SER E 22  . ? 1_555 ? 
61  AD5 9  SER E 3  ? SER E 23  . ? 1_555 ? 
62  AD5 9  ASP E 4  ? ASP E 24  . ? 1_555 ? 
63  AD5 9  CA  L .  ? CA  E 101 . ? 1_555 ? 
64  AD5 9  HOH R .  ? HOH E 201 . ? 1_555 ? 
65  AD5 9  SER F 3  ? SER F 23  . ? 1_555 ? 
66  AD5 9  HOH S .  ? HOH F 101 . ? 1_555 ? 
67  AD5 9  ACE G 1  ? ACE G 21  . ? 1_555 ? 
68  AD5 9  SER G 2  ? SER G 22  . ? 1_555 ? 
69  AD6 7  ASP B 24 ? ASP B 44  . ? 1_645 ? 
70  AD6 7  CA  J .  ? CA  B 101 . ? 1_645 ? 
71  AD6 7  ARG C 25 ? ARG C 45  . ? 1_645 ? 
72  AD6 7  ILE F 22 ? ILE F 42  . ? 1_555 ? 
73  AD6 7  LEU F 23 ? LEU F 43  . ? 1_555 ? 
74  AD6 7  ASP F 24 ? ASP F 44  . ? 1_555 ? 
75  AD6 7  ARG F 25 ? ARG F 45  . ? 1_555 ? 
76  AD7 10 CA  L .  ? CA  E 101 . ? 1_555 ? 
77  AD7 10 SER F 2  ? SER F 22  . ? 1_555 ? 
78  AD7 10 SER F 3  ? SER F 23  . ? 1_555 ? 
79  AD7 10 ASP F 4  ? ASP F 24  . ? 1_555 ? 
80  AD7 10 HOH S .  ? HOH F 101 . ? 1_555 ? 
81  AD7 10 SER G 3  ? SER G 23  . ? 1_555 ? 
82  AD7 10 HOH T .  ? HOH G 201 . ? 1_555 ? 
83  AD7 10 HOH T .  ? HOH G 207 . ? 1_555 ? 
84  AD7 10 ACE H 1  ? ACE H 21  . ? 1_555 ? 
85  AD7 10 SER H 2  ? SER H 22  . ? 1_555 ? 
86  AD8 8  ASP C 24 ? ASP C 44  . ? 1_545 ? 
87  AD8 8  HOH P .  ? HOH C 101 . ? 1_545 ? 
88  AD8 8  TRP D 21 ? TRP D 41  . ? 1_545 ? 
89  AD8 8  ARG D 25 ? ARG D 45  . ? 1_545 ? 
90  AD8 8  ILE G 22 ? ILE G 42  . ? 1_555 ? 
91  AD8 8  LEU G 23 ? LEU G 43  . ? 1_555 ? 
92  AD8 8  ASP G 24 ? ASP G 44  . ? 1_555 ? 
93  AD8 8  ARG G 25 ? ARG G 45  . ? 1_555 ? 
94  AD9 9  ACE E 1  ? ACE E 21  . ? 1_555 ? 
95  AD9 9  SER E 2  ? SER E 22  . ? 1_555 ? 
96  AD9 9  CA  L .  ? CA  E 101 . ? 1_555 ? 
97  AD9 9  SER G 2  ? SER G 22  . ? 1_555 ? 
98  AD9 9  SER G 3  ? SER G 23  . ? 1_555 ? 
99  AD9 9  ASP G 4  ? ASP G 24  . ? 1_555 ? 
100 AD9 9  HOH T .  ? HOH G 201 . ? 1_555 ? 
101 AD9 9  SER H 3  ? SER H 23  . ? 1_555 ? 
102 AD9 9  HOH U .  ? HOH H 102 . ? 1_555 ? 
103 AE1 7  ARG A 25 ? ARG A 45  . ? 1_555 ? 
104 AE1 7  ASP D 24 ? ASP D 44  . ? 1_555 ? 
105 AE1 7  CA  K .  ? CA  D 101 . ? 1_555 ? 
106 AE1 7  ILE H 22 ? ILE H 42  . ? 1_555 ? 
107 AE1 7  LEU H 23 ? LEU H 43  . ? 1_555 ? 
108 AE1 7  ASP H 24 ? ASP H 44  . ? 1_555 ? 
109 AE1 7  ARG H 25 ? ARG H 45  . ? 1_555 ? 
# 
_atom_sites.entry_id                    6MJH 
_atom_sites.fract_transf_matrix[1][1]   0.027556 
_atom_sites.fract_transf_matrix[1][2]   0.000000 
_atom_sites.fract_transf_matrix[1][3]   0.006666 
_atom_sites.fract_transf_matrix[2][1]   0.000000 
_atom_sites.fract_transf_matrix[2][2]   0.027662 
_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]   0.013458 
_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  
CA 
CL 
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.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 
HETATM 1    C  C   . ACE A 1 1  ? 36.878 -53.939 -107.511 1.00 37.14 ?  21  ACE A C   1 
HETATM 2    O  O   . ACE A 1 1  ? 37.441 -53.731 -106.437 1.00 44.39 ?  21  ACE A O   1 
HETATM 3    C  CH3 . ACE A 1 1  ? 37.491 -54.819 -108.563 1.00 36.20 ?  21  ACE A CH3 1 
ATOM   4    N  N   . SER A 1 2  ? 35.689 -53.409 -107.790 1.00 39.74 ?  22  SER A N   1 
ATOM   5    C  CA  . SER A 1 2  ? 34.977 -53.623 -109.047 1.00 31.92 ?  22  SER A CA  1 
ATOM   6    C  C   . SER A 1 2  ? 35.427 -52.626 -110.111 1.00 32.82 ?  22  SER A C   1 
ATOM   7    O  O   . SER A 1 2  ? 36.047 -51.609 -109.798 1.00 27.58 ?  22  SER A O   1 
ATOM   8    C  CB  . SER A 1 2  ? 33.466 -53.513 -108.831 1.00 36.49 ?  22  SER A CB  1 
ATOM   9    O  OG  . SER A 1 2  ? 33.071 -52.162 -108.667 1.00 39.25 ?  22  SER A OG  1 
ATOM   10   N  N   . SER A 1 3  ? 35.121 -52.927 -111.369 1.00 35.53 ?  23  SER A N   1 
ATOM   11   C  CA  . SER A 1 3  ? 35.388 -52.019 -112.472 1.00 28.56 ?  23  SER A CA  1 
ATOM   12   C  C   . SER A 1 3  ? 34.111 -51.275 -112.834 1.00 28.91 ?  23  SER A C   1 
ATOM   13   O  O   . SER A 1 3  ? 33.000 -51.762 -112.606 1.00 24.29 ?  23  SER A O   1 
ATOM   14   C  CB  . SER A 1 3  ? 35.917 -52.774 -113.693 1.00 30.91 ?  23  SER A CB  1 
ATOM   15   O  OG  . SER A 1 3  ? 37.185 -53.345 -113.430 1.00 34.96 ?  23  SER A OG  1 
ATOM   16   N  N   . ASP A 1 4  ? 34.276 -50.088 -113.393 1.00 27.15 ?  24  ASP A N   1 
ATOM   17   C  CA  . ASP A 1 4  ? 33.074 -49.367 -113.779 1.00 22.95 ?  24  ASP A CA  1 
ATOM   18   C  C   . ASP A 1 4  ? 32.554 -49.929 -115.096 1.00 25.49 ?  24  ASP A C   1 
ATOM   19   O  O   . ASP A 1 4  ? 33.245 -49.819 -116.117 1.00 21.14 ?  24  ASP A O   1 
ATOM   20   C  CB  . ASP A 1 4  ? 33.360 -47.876 -113.922 1.00 23.58 ?  24  ASP A CB  1 
ATOM   21   C  CG  . ASP A 1 4  ? 32.112 -47.075 -114.229 1.00 27.19 ?  24  ASP A CG  1 
ATOM   22   O  OD1 . ASP A 1 4  ? 31.021 -47.675 -114.312 1.00 27.97 ?  24  ASP A OD1 1 
ATOM   23   O  OD2 . ASP A 1 4  ? 32.232 -45.843 -114.414 1.00 26.70 -1 24  ASP A OD2 1 
ATOM   24   N  N   . PRO A 1 5  ? 31.320 -50.440 -115.077 1.00 20.31 ?  25  PRO A N   1 
ATOM   25   C  CA  . PRO A 1 5  ? 30.748 -50.994 -116.314 1.00 21.62 ?  25  PRO A CA  1 
ATOM   26   C  C   . PRO A 1 5  ? 30.594 -49.964 -117.417 1.00 19.71 ?  25  PRO A C   1 
ATOM   27   O  O   . PRO A 1 5  ? 30.693 -50.320 -118.598 1.00 23.74 ?  25  PRO A O   1 
ATOM   28   C  CB  . PRO A 1 5  ? 29.390 -51.547 -115.857 1.00 23.08 ?  25  PRO A CB  1 
ATOM   29   C  CG  . PRO A 1 5  ? 29.067 -50.788 -114.616 1.00 31.83 ?  25  PRO A CG  1 
ATOM   30   C  CD  . PRO A 1 5  ? 30.385 -50.531 -113.944 1.00 29.51 ?  25  PRO A CD  1 
ATOM   31   N  N   . LEU A 1 6  ? 30.351 -48.697 -117.075 1.00 21.92 ?  26  LEU A N   1 
ATOM   32   C  CA  . LEU A 1 6  ? 30.280 -47.666 -118.104 1.00 24.71 ?  26  LEU A CA  1 
ATOM   33   C  C   . LEU A 1 6  ? 31.625 -47.465 -118.789 1.00 19.30 ?  26  LEU A C   1 
ATOM   34   O  O   . LEU A 1 6  ? 31.668 -47.109 -119.971 1.00 20.41 ?  26  LEU A O   1 
ATOM   35   C  CB  . LEU A 1 6  ? 29.784 -46.349 -117.506 1.00 24.74 ?  26  LEU A CB  1 
ATOM   36   C  CG  . LEU A 1 6  ? 28.302 -46.345 -117.126 1.00 25.18 ?  26  LEU A CG  1 
ATOM   37   C  CD1 . LEU A 1 6  ? 27.849 -44.962 -116.690 1.00 25.61 ?  26  LEU A CD1 1 
ATOM   38   C  CD2 . LEU A 1 6  ? 27.459 -46.849 -118.286 1.00 28.97 ?  26  LEU A CD2 1 
ATOM   39   N  N   . VAL A 1 7  ? 32.726 -47.683 -118.070 1.00 25.56 ?  27  VAL A N   1 
ATOM   40   C  CA  . VAL A 1 7  ? 34.047 -47.586 -118.684 1.00 20.83 ?  27  VAL A CA  1 
ATOM   41   C  C   . VAL A 1 7  ? 34.336 -48.818 -119.532 1.00 26.49 ?  27  VAL A C   1 
ATOM   42   O  O   . VAL A 1 7  ? 34.936 -48.717 -120.610 1.00 25.33 ?  27  VAL A O   1 
ATOM   43   C  CB  . VAL A 1 7  ? 35.121 -47.372 -117.603 1.00 22.57 ?  27  VAL A CB  1 
ATOM   44   C  CG1 . VAL A 1 7  ? 36.511 -47.365 -118.226 1.00 25.04 ?  27  VAL A CG1 1 
ATOM   45   C  CG2 . VAL A 1 7  ? 34.860 -46.073 -116.849 1.00 20.33 ?  27  VAL A CG2 1 
ATOM   46   N  N   . VAL A 1 8  ? 33.912 -49.997 -119.065 1.00 22.64 ?  28  VAL A N   1 
ATOM   47   C  CA  . VAL A 1 8  ? 34.037 -51.207 -119.875 1.00 21.82 ?  28  VAL A CA  1 
ATOM   48   C  C   . VAL A 1 8  ? 33.334 -51.023 -121.213 1.00 18.63 ?  28  VAL A C   1 
ATOM   49   O  O   . VAL A 1 8  ? 33.883 -51.342 -122.274 1.00 22.56 ?  28  VAL A O   1 
ATOM   50   C  CB  . VAL A 1 8  ? 33.481 -52.425 -119.116 1.00 23.21 ?  28  VAL A CB  1 
ATOM   51   C  CG1 . VAL A 1 8  ? 33.582 -53.673 -119.981 1.00 18.32 ?  28  VAL A CG1 1 
ATOM   52   C  CG2 . VAL A 1 8  ? 34.216 -52.617 -117.796 1.00 22.29 ?  28  VAL A CG2 1 
ATOM   53   N  N   . ALA A 1 9  ? 32.100 -50.512 -121.180 1.00 21.94 ?  29  ALA A N   1 
ATOM   54   C  CA  . ALA A 1 9  ? 31.358 -50.288 -122.415 1.00 17.91 ?  29  ALA A CA  1 
ATOM   55   C  C   . ALA A 1 9  ? 32.088 -49.312 -123.330 1.00 19.68 ?  29  ALA A C   1 
ATOM   56   O  O   . ALA A 1 9  ? 32.142 -49.513 -124.549 1.00 16.23 ?  29  ALA A O   1 
ATOM   57   C  CB  . ALA A 1 9  ? 29.953 -49.776 -122.096 1.00 17.35 ?  29  ALA A CB  1 
ATOM   58   N  N   . ALA A 1 10 ? 32.644 -48.239 -122.759 1.00 21.04 ?  30  ALA A N   1 
ATOM   59   C  CA  . ALA A 1 10 ? 33.418 -47.292 -123.555 1.00 16.60 ?  30  ALA A CA  1 
ATOM   60   C  C   . ALA A 1 10 ? 34.563 -47.988 -124.279 1.00 17.66 ?  30  ALA A C   1 
ATOM   61   O  O   . ALA A 1 10 ? 34.817 -47.719 -125.459 1.00 19.28 ?  30  ALA A O   1 
ATOM   62   C  CB  . ALA A 1 10 ? 33.946 -46.169 -122.663 1.00 20.51 ?  30  ALA A CB  1 
ATOM   63   N  N   . ASN A 1 11 ? 35.263 -48.894 -123.589 1.00 18.21 ?  31  ASN A N   1 
ATOM   64   C  CA  . ASN A 1 11 ? 36.331 -49.649 -124.238 1.00 18.83 ?  31  ASN A CA  1 
ATOM   65   C  C   . ASN A 1 11 ? 35.779 -50.565 -125.322 1.00 18.77 ?  31  ASN A C   1 
ATOM   66   O  O   . ASN A 1 11 ? 36.375 -50.696 -126.397 1.00 18.90 ?  31  ASN A O   1 
ATOM   67   C  CB  . ASN A 1 11 ? 37.111 -50.463 -123.203 1.00 20.49 ?  31  ASN A CB  1 
ATOM   68   C  CG  . ASN A 1 11 ? 38.112 -49.624 -122.433 1.00 29.63 ?  31  ASN A CG  1 
ATOM   69   O  OD1 . ASN A 1 11 ? 39.152 -49.236 -122.964 1.00 35.94 ?  31  ASN A OD1 1 
ATOM   70   N  ND2 . ASN A 1 11 ? 37.813 -49.357 -121.170 1.00 25.15 ?  31  ASN A ND2 1 
ATOM   71   N  N   . ILE A 1 12 ? 34.641 -51.209 -125.058 1.00 17.30 ?  32  ILE A N   1 
ATOM   72   C  CA  . ILE A 1 12 ? 34.074 -52.137 -126.031 1.00 19.36 ?  32  ILE A CA  1 
ATOM   73   C  C   . ILE A 1 12 ? 33.650 -51.397 -127.292 1.00 19.13 ?  32  ILE A C   1 
ATOM   74   O  O   . ILE A 1 12 ? 33.874 -51.871 -128.411 1.00 14.65 ?  32  ILE A O   1 
ATOM   75   C  CB  . ILE A 1 12 ? 32.898 -52.910 -125.408 1.00 18.15 ?  32  ILE A CB  1 
ATOM   76   C  CG1 . ILE A 1 12 ? 33.379 -53.738 -124.214 1.00 23.09 ?  32  ILE A CG1 1 
ATOM   77   C  CG2 . ILE A 1 12 ? 32.233 -53.792 -126.455 1.00 27.33 ?  32  ILE A CG2 1 
ATOM   78   C  CD1 . ILE A 1 12 ? 32.290 -54.561 -123.565 1.00 24.37 ?  32  ILE A CD1 1 
ATOM   79   N  N   . ILE A 1 13 ? 33.030 -50.228 -127.133 1.00 15.11 ?  33  ILE A N   1 
ATOM   80   C  CA  . ILE A 1 13 ? 32.587 -49.463 -128.294 1.00 16.64 ?  33  ILE A CA  1 
ATOM   81   C  C   . ILE A 1 13 ? 33.784 -48.988 -129.108 1.00 18.04 ?  33  ILE A C   1 
ATOM   82   O  O   . ILE A 1 13 ? 33.843 -49.181 -130.328 1.00 19.59 ?  33  ILE A O   1 
ATOM   83   C  CB  . ILE A 1 13 ? 31.701 -48.286 -127.851 1.00 19.33 ?  33  ILE A CB  1 
ATOM   84   C  CG1 . ILE A 1 13 ? 30.426 -48.804 -127.182 1.00 21.88 ?  33  ILE A CG1 1 
ATOM   85   C  CG2 . ILE A 1 13 ? 31.369 -47.394 -129.038 1.00 18.71 ?  33  ILE A CG2 1 
ATOM   86   C  CD1 . ILE A 1 13 ? 29.646 -49.771 -128.040 1.00 26.34 ?  33  ILE A CD1 1 
ATOM   87   N  N   . GLY A 1 14 ? 34.758 -48.362 -128.444 1.00 15.15 ?  34  GLY A N   1 
ATOM   88   C  CA  . GLY A 1 14 ? 35.925 -47.867 -129.157 1.00 19.04 ?  34  GLY A CA  1 
ATOM   89   C  C   . GLY A 1 14 ? 36.724 -48.970 -129.826 1.00 17.30 ?  34  GLY A C   1 
ATOM   90   O  O   . GLY A 1 14 ? 37.193 -48.810 -130.955 1.00 17.81 ?  34  GLY A O   1 
ATOM   91   N  N   . ILE A 1 15 ? 36.888 -50.105 -129.142 1.00 19.28 ?  35  ILE A N   1 
ATOM   92   C  CA  . ILE A 1 15 ? 37.646 -51.218 -129.712 1.00 19.25 ?  35  ILE A CA  1 
ATOM   93   C  C   . ILE A 1 15 ? 36.921 -51.797 -130.922 1.00 15.97 ?  35  ILE A C   1 
ATOM   94   O  O   . ILE A 1 15 ? 37.532 -52.064 -131.965 1.00 16.25 ?  35  ILE A O   1 
ATOM   95   C  CB  . ILE A 1 15 ? 37.902 -52.297 -128.643 1.00 21.34 ?  35  ILE A CB  1 
ATOM   96   C  CG1 . ILE A 1 15 ? 38.791 -51.744 -127.527 1.00 26.79 ?  35  ILE A CG1 1 
ATOM   97   C  CG2 . ILE A 1 15 ? 38.534 -53.525 -129.274 1.00 23.04 ?  35  ILE A CG2 1 
ATOM   98   C  CD1 . ILE A 1 15 ? 38.891 -52.654 -126.317 1.00 28.66 ?  35  ILE A CD1 1 
ATOM   99   N  N   . LEU A 1 16 ? 35.612 -52.024 -130.796 1.00 20.85 ?  36  LEU A N   1 
ATOM   100  C  CA  . LEU A 1 16 ? 34.839 -52.523 -131.929 1.00 19.78 ?  36  LEU A CA  1 
ATOM   101  C  C   . LEU A 1 16 ? 34.910 -51.553 -133.100 1.00 18.75 ?  36  LEU A C   1 
ATOM   102  O  O   . LEU A 1 16 ? 35.097 -51.960 -134.253 1.00 18.11 ?  36  LEU A O   1 
ATOM   103  C  CB  . LEU A 1 16 ? 33.386 -52.759 -131.512 1.00 20.54 ?  36  LEU A CB  1 
ATOM   104  C  CG  . LEU A 1 16 ? 32.438 -53.170 -132.644 1.00 26.40 ?  36  LEU A CG  1 
ATOM   105  C  CD1 . LEU A 1 16 ? 32.863 -54.504 -133.244 1.00 28.25 ?  36  LEU A CD1 1 
ATOM   106  C  CD2 . LEU A 1 16 ? 30.995 -53.227 -132.161 1.00 28.18 ?  36  LEU A CD2 1 
ATOM   107  N  N   . HIS A 1 17 ? 34.761 -50.256 -132.818 1.00 18.04 ?  37  HIS A N   1 
ATOM   108  C  CA  . HIS A 1 17 ? 34.772 -49.253 -133.879 1.00 17.01 ?  37  HIS A CA  1 
ATOM   109  C  C   . HIS A 1 17 ? 36.117 -49.227 -134.590 1.00 17.65 ?  37  HIS A C   1 
ATOM   110  O  O   . HIS A 1 17 ? 36.187 -49.175 -135.823 1.00 15.78 ?  37  HIS A O   1 
ATOM   111  C  CB  . HIS A 1 17 ? 34.440 -47.878 -133.296 1.00 16.85 ?  37  HIS A CB  1 
ATOM   112  C  CG  . HIS A 1 17 ? 34.190 -46.827 -134.331 1.00 20.98 ?  37  HIS A CG  1 
ATOM   113  N  ND1 . HIS A 1 17 ? 33.860 -45.530 -134.003 1.00 20.56 ?  37  HIS A ND1 1 
ATOM   114  C  CD2 . HIS A 1 17 ? 34.221 -46.877 -135.684 1.00 19.67 ?  37  HIS A CD2 1 
ATOM   115  C  CE1 . HIS A 1 17 ? 33.698 -44.826 -135.109 1.00 17.98 ?  37  HIS A CE1 1 
ATOM   116  N  NE2 . HIS A 1 17 ? 33.910 -45.619 -136.143 1.00 17.08 ?  37  HIS A NE2 1 
ATOM   117  N  N   . LEU A 1 18 ? 37.204 -49.269 -133.820 1.00 17.64 ?  38  LEU A N   1 
ATOM   118  C  CA  . LEU A 1 18 ? 38.530 -49.273 -134.424 1.00 20.64 ?  38  LEU A CA  1 
ATOM   119  C  C   . LEU A 1 18 ? 38.734 -50.513 -135.288 1.00 16.50 ?  38  LEU A C   1 
ATOM   120  O  O   . LEU A 1 18 ? 39.226 -50.419 -136.418 1.00 16.34 ?  38  LEU A O   1 
ATOM   121  C  CB  . LEU A 1 18 ? 39.591 -49.184 -133.327 1.00 18.11 ?  38  LEU A CB  1 
ATOM   122  C  CG  . LEU A 1 18 ? 41.067 -49.313 -133.706 1.00 20.25 ?  38  LEU A CG  1 
ATOM   123  C  CD1 . LEU A 1 18 ? 41.460 -48.275 -134.735 1.00 16.45 ?  38  LEU A CD1 1 
ATOM   124  C  CD2 . LEU A 1 18 ? 41.931 -49.188 -132.458 1.00 18.78 ?  38  LEU A CD2 1 
ATOM   125  N  N   . ILE A 1 19 ? 38.335 -51.681 -134.782 1.00 19.46 ?  39  ILE A N   1 
ATOM   126  C  CA  . ILE A 1 19 ? 38.518 -52.925 -135.527 1.00 20.51 ?  39  ILE A CA  1 
ATOM   127  C  C   . ILE A 1 19 ? 37.709 -52.898 -136.817 1.00 19.19 ?  39  ILE A C   1 
ATOM   128  O  O   . ILE A 1 19 ? 38.225 -53.193 -137.902 1.00 19.55 ?  39  ILE A O   1 
ATOM   129  C  CB  . ILE A 1 19 ? 38.139 -54.133 -134.652 1.00 16.88 ?  39  ILE A CB  1 
ATOM   130  C  CG1 . ILE A 1 19 ? 39.084 -54.239 -133.453 1.00 21.84 ?  39  ILE A CG1 1 
ATOM   131  C  CG2 . ILE A 1 19 ? 38.155 -55.418 -135.471 1.00 27.66 ?  39  ILE A CG2 1 
ATOM   132  C  CD1 . ILE A 1 19 ? 38.700 -55.324 -132.468 1.00 27.29 ?  39  ILE A CD1 1 
ATOM   133  N  N   . LEU A 1 20 ? 36.422 -52.554 -136.716 1.00 18.71 ?  40  LEU A N   1 
ATOM   134  C  CA  . LEU A 1 20 ? 35.574 -52.518 -137.902 1.00 19.55 ?  40  LEU A CA  1 
ATOM   135  C  C   . LEU A 1 20 ? 36.150 -51.589 -138.961 1.00 18.93 ?  40  LEU A C   1 
ATOM   136  O  O   . LEU A 1 20 ? 36.161 -51.924 -140.152 1.00 21.68 ?  40  LEU A O   1 
ATOM   137  C  CB  . LEU A 1 20 ? 34.155 -52.087 -137.526 1.00 16.40 ?  40  LEU A CB  1 
ATOM   138  C  CG  . LEU A 1 20 ? 33.320 -53.067 -136.699 1.00 24.52 ?  40  LEU A CG  1 
ATOM   139  C  CD1 . LEU A 1 20 ? 31.917 -52.525 -136.474 1.00 18.47 ?  40  LEU A CD1 1 
ATOM   140  C  CD2 . LEU A 1 20 ? 33.266 -54.426 -137.377 1.00 21.86 ?  40  LEU A CD2 1 
ATOM   141  N  N   . TRP A 1 21 ? 36.639 -50.418 -138.547 1.00 16.98 ?  41  TRP A N   1 
ATOM   142  C  CA  . TRP A 1 21 ? 37.187 -49.466 -139.506 1.00 16.82 ?  41  TRP A CA  1 
ATOM   143  C  C   . TRP A 1 21 ? 38.433 -50.019 -140.185 1.00 19.20 ?  41  TRP A C   1 
ATOM   144  O  O   . TRP A 1 21 ? 38.588 -49.893 -141.405 1.00 18.74 ?  41  TRP A O   1 
ATOM   145  C  CB  . TRP A 1 21 ? 37.496 -48.139 -138.812 1.00 17.93 ?  41  TRP A CB  1 
ATOM   146  C  CG  . TRP A 1 21 ? 38.157 -47.144 -139.719 1.00 20.86 ?  41  TRP A CG  1 
ATOM   147  C  CD1 . TRP A 1 21 ? 37.560 -46.401 -140.697 1.00 22.84 ?  41  TRP A CD1 1 
ATOM   148  C  CD2 . TRP A 1 21 ? 39.545 -46.789 -139.737 1.00 20.43 ?  41  TRP A CD2 1 
ATOM   149  N  NE1 . TRP A 1 21 ? 38.489 -45.604 -141.320 1.00 22.54 ?  41  TRP A NE1 1 
ATOM   150  C  CE2 . TRP A 1 21 ? 39.715 -45.823 -140.749 1.00 20.98 ?  41  TRP A CE2 1 
ATOM   151  C  CE3 . TRP A 1 21 ? 40.658 -47.191 -138.994 1.00 19.10 ?  41  TRP A CE3 1 
ATOM   152  C  CZ2 . TRP A 1 21 ? 40.954 -45.257 -141.038 1.00 17.36 ?  41  TRP A CZ2 1 
ATOM   153  C  CZ3 . TRP A 1 21 ? 41.888 -46.626 -139.283 1.00 18.52 ?  41  TRP A CZ3 1 
ATOM   154  C  CH2 . TRP A 1 21 ? 42.025 -45.671 -140.297 1.00 20.79 ?  41  TRP A CH2 1 
ATOM   155  N  N   . ILE A 1 22 ? 39.332 -50.632 -139.413 1.00 19.45 ?  42  ILE A N   1 
ATOM   156  C  CA  . ILE A 1 22 ? 40.546 -51.201 -139.995 1.00 21.35 ?  42  ILE A CA  1 
ATOM   157  C  C   . ILE A 1 22 ? 40.191 -52.305 -140.984 1.00 19.95 ?  42  ILE A C   1 
ATOM   158  O  O   . ILE A 1 22 ? 40.649 -52.308 -142.133 1.00 26.24 ?  42  ILE A O   1 
ATOM   159  C  CB  . ILE A 1 22 ? 41.482 -51.711 -138.886 1.00 21.02 ?  42  ILE A CB  1 
ATOM   160  C  CG1 . ILE A 1 22 ? 42.013 -50.537 -138.054 1.00 19.50 ?  42  ILE A CG1 1 
ATOM   161  C  CG2 . ILE A 1 22 ? 42.627 -52.526 -139.484 1.00 25.27 ?  42  ILE A CG2 1 
ATOM   162  C  CD1 . ILE A 1 22 ? 42.706 -50.962 -136.773 1.00 21.66 ?  42  ILE A CD1 1 
ATOM   163  N  N   . LEU A 1 23 ? 39.360 -53.256 -140.555 1.00 18.36 ?  43  LEU A N   1 
ATOM   164  C  CA  . LEU A 1 23 ? 38.983 -54.352 -141.440 1.00 20.39 ?  43  LEU A CA  1 
ATOM   165  C  C   . LEU A 1 23 ? 38.272 -53.847 -142.687 1.00 24.06 ?  43  LEU A C   1 
ATOM   166  O  O   . LEU A 1 23 ? 38.424 -54.428 -143.768 1.00 22.29 ?  43  LEU A O   1 
ATOM   167  C  CB  . LEU A 1 23 ? 38.107 -55.351 -140.689 1.00 18.03 ?  43  LEU A CB  1 
ATOM   168  C  CG  . LEU A 1 23 ? 38.840 -56.051 -139.545 1.00 19.06 ?  43  LEU A CG  1 
ATOM   169  C  CD1 . LEU A 1 23 ? 37.968 -57.117 -138.906 1.00 22.90 ?  43  LEU A CD1 1 
ATOM   170  C  CD2 . LEU A 1 23 ? 40.146 -56.645 -140.055 1.00 31.53 ?  43  LEU A CD2 1 
ATOM   171  N  N   . ASP A 1 24 ? 37.493 -52.770 -142.561 1.00 21.66 ?  44  ASP A N   1 
ATOM   172  C  CA  . ASP A 1 24 ? 36.848 -52.190 -143.733 1.00 20.95 ?  44  ASP A CA  1 
ATOM   173  C  C   . ASP A 1 24 ? 37.877 -51.616 -144.701 1.00 26.79 ?  44  ASP A C   1 
ATOM   174  O  O   . ASP A 1 24 ? 37.729 -51.743 -145.923 1.00 22.58 ?  44  ASP A O   1 
ATOM   175  C  CB  . ASP A 1 24 ? 35.854 -51.113 -143.303 1.00 24.73 ?  44  ASP A CB  1 
ATOM   176  C  CG  . ASP A 1 24 ? 35.130 -50.489 -144.476 1.00 28.96 ?  44  ASP A CG  1 
ATOM   177  O  OD1 . ASP A 1 24 ? 35.112 -51.108 -145.560 1.00 28.99 ?  44  ASP A OD1 1 
ATOM   178  O  OD2 . ASP A 1 24 ? 34.589 -49.373 -144.316 1.00 31.97 -1 44  ASP A OD2 1 
ATOM   179  N  N   . ARG A 1 25 ? 38.931 -50.993 -144.172 1.00 27.30 ?  45  ARG A N   1 
ATOM   180  C  CA  . ARG A 1 25 ? 39.972 -50.436 -145.024 1.00 28.04 ?  45  ARG A CA  1 
ATOM   181  C  C   . ARG A 1 25 ? 40.904 -51.508 -145.572 1.00 33.17 ?  45  ARG A C   1 
ATOM   182  O  O   . ARG A 1 25 ? 41.467 -51.331 -146.658 1.00 40.24 ?  45  ARG A O   1 
ATOM   183  C  CB  . ARG A 1 25 ? 40.772 -49.388 -144.252 1.00 27.84 ?  45  ARG A CB  1 
ATOM   184  C  CG  . ARG A 1 25 ? 40.033 -48.068 -144.049 1.00 27.60 ?  45  ARG A CG  1 
ATOM   185  C  CD  . ARG A 1 25 ? 39.872 -47.307 -145.360 1.00 32.03 ?  45  ARG A CD  1 
ATOM   186  N  NE  . ARG A 1 25 ? 41.135 -46.732 -145.818 1.00 35.87 ?  45  ARG A NE  1 
ATOM   187  C  CZ  . ARG A 1 25 ? 41.826 -47.173 -146.865 1.00 38.36 ?  45  ARG A CZ  1 
ATOM   188  N  NH1 . ARG A 1 25 ? 41.381 -48.200 -147.579 1.00 39.55 1  45  ARG A NH1 1 
ATOM   189  N  NH2 . ARG A 1 25 ? 42.967 -46.585 -147.198 1.00 35.85 ?  45  ARG A NH2 1 
ATOM   190  N  N   . LEU A 1 26 ? 41.083 -52.615 -144.853 1.00 24.97 ?  46  LEU A N   1 
ATOM   191  C  CA  . LEU A 1 26 ? 41.975 -53.682 -145.307 1.00 31.80 ?  46  LEU A CA  1 
ATOM   192  C  C   . LEU A 1 26 ? 41.258 -54.689 -146.194 1.00 35.21 ?  46  LEU A C   1 
ATOM   193  O  O   . LEU A 1 26 ? 40.088 -55.010 -145.974 1.00 39.35 ?  46  LEU A O   1 
ATOM   194  C  CB  . LEU A 1 26 ? 42.600 -54.414 -144.122 1.00 27.37 ?  46  LEU A CB  1 
ATOM   195  C  CG  . LEU A 1 26 ? 43.467 -53.600 -143.167 1.00 26.80 ?  46  LEU A CG  1 
ATOM   196  C  CD1 . LEU A 1 26 ? 44.159 -54.538 -142.205 1.00 37.16 ?  46  LEU A CD1 1 
ATOM   197  C  CD2 . LEU A 1 26 ? 44.474 -52.741 -143.923 1.00 36.86 ?  46  LEU A CD2 1 
HETATM 198  N  N   . NH2 A 1 27 ? 41.973 -55.192 -147.194 1.00 35.05 ?  47  NH2 A N   1 
HETATM 199  C  C   . ACE B 1 1  ? 25.535 -44.045 -107.380 1.00 46.60 ?  21  ACE B C   1 
HETATM 200  O  O   . ACE B 1 1  ? 25.748 -44.541 -106.274 1.00 54.44 ?  21  ACE B O   1 
HETATM 201  C  CH3 . ACE B 1 1  ? 24.731 -44.765 -108.424 1.00 40.42 ?  21  ACE B CH3 1 
ATOM   202  N  N   . SER B 1 2  ? 25.995 -42.839 -107.708 1.00 45.08 ?  22  SER B N   1 
ATOM   203  C  CA  . SER B 1 2  ? 25.762 -42.222 -109.010 1.00 37.79 ?  22  SER B CA  1 
ATOM   204  C  C   . SER B 1 2  ? 26.826 -42.636 -110.023 1.00 36.95 ?  22  SER B C   1 
ATOM   205  O  O   . SER B 1 2  ? 27.863 -43.193 -109.661 1.00 35.93 ?  22  SER B O   1 
ATOM   206  C  CB  . SER B 1 2  ? 25.727 -40.698 -108.882 1.00 42.83 ?  22  SER B CB  1 
ATOM   207  O  OG  . SER B 1 2  ? 27.036 -40.155 -108.882 1.00 45.68 ?  22  SER B OG  1 
ATOM   208  N  N   . SER B 1 3  ? 26.555 -42.366 -111.294 1.00 39.73 ?  23  SER B N   1 
ATOM   209  C  CA  . SER B 1 3  ? 27.490 -42.644 -112.371 1.00 33.19 ?  23  SER B CA  1 
ATOM   210  C  C   . SER B 1 3  ? 28.162 -41.354 -112.822 1.00 25.56 ?  23  SER B C   1 
ATOM   211  O  O   . SER B 1 3  ? 27.580 -40.270 -112.744 1.00 26.27 ?  23  SER B O   1 
ATOM   212  C  CB  . SER B 1 3  ? 26.783 -43.306 -113.555 1.00 29.57 ?  23  SER B CB  1 
ATOM   213  O  OG  . SER B 1 3  ? 26.417 -44.639 -113.243 1.00 40.55 ?  23  SER B OG  1 
ATOM   214  N  N   . ASP B 1 4  ? 29.396 -41.483 -113.286 1.00 25.52 ?  24  ASP B N   1 
ATOM   215  C  CA  . ASP B 1 4  ? 30.159 -40.328 -113.744 1.00 24.93 ?  24  ASP B CA  1 
ATOM   216  C  C   . ASP B 1 4  ? 29.532 -39.767 -115.013 1.00 22.96 ?  24  ASP B C   1 
ATOM   217  O  O   . ASP B 1 4  ? 29.479 -40.472 -116.029 1.00 23.27 ?  24  ASP B O   1 
ATOM   218  C  CB  . ASP B 1 4  ? 31.613 -40.722 -113.995 1.00 22.13 ?  24  ASP B CB  1 
ATOM   219  C  CG  . ASP B 1 4  ? 32.518 -39.521 -114.207 1.00 26.09 ?  24  ASP B CG  1 
ATOM   220  O  OD1 . ASP B 1 4  ? 32.014 -38.379 -114.215 1.00 30.16 ?  24  ASP B OD1 1 
ATOM   221  O  OD2 . ASP B 1 4  ? 33.741 -39.719 -114.366 1.00 28.59 -1 24  ASP B OD2 1 
ATOM   222  N  N   . PRO B 1 5  ? 29.045 -38.522 -115.007 1.00 24.14 ?  25  PRO B N   1 
ATOM   223  C  CA  . PRO B 1 5  ? 28.462 -37.964 -116.238 1.00 24.92 ?  25  PRO B CA  1 
ATOM   224  C  C   . PRO B 1 5  ? 29.447 -37.894 -117.391 1.00 21.22 ?  25  PRO B C   1 
ATOM   225  O  O   . PRO B 1 5  ? 29.032 -37.991 -118.553 1.00 21.55 ?  25  PRO B O   1 
ATOM   226  C  CB  . PRO B 1 5  ? 27.998 -36.564 -115.806 1.00 25.40 ?  25  PRO B CB  1 
ATOM   227  C  CG  . PRO B 1 5  ? 27.881 -36.636 -114.317 1.00 33.03 ?  25  PRO B CG  1 
ATOM   228  C  CD  . PRO B 1 5  ? 28.940 -37.593 -113.870 1.00 27.85 ?  25  PRO B CD  1 
ATOM   229  N  N   . LEU B 1 6  ? 30.743 -37.737 -117.106 1.00 21.71 ?  26  LEU B N   1 
ATOM   230  C  CA  . LEU B 1 6  ? 31.732 -37.700 -118.178 1.00 25.23 ?  26  LEU B CA  1 
ATOM   231  C  C   . LEU B 1 6  ? 31.896 -39.057 -118.848 1.00 18.81 ?  26  LEU B C   1 
ATOM   232  O  O   . LEU B 1 6  ? 32.150 -39.119 -120.055 1.00 22.09 ?  26  LEU B O   1 
ATOM   233  C  CB  . LEU B 1 6  ? 33.073 -37.205 -117.635 1.00 23.57 ?  26  LEU B CB  1 
ATOM   234  C  CG  . LEU B 1 6  ? 33.308 -35.703 -117.803 1.00 31.26 ?  26  LEU B CG  1 
ATOM   235  C  CD1 . LEU B 1 6  ? 32.038 -34.923 -117.503 1.00 27.61 ?  26  LEU B CD1 1 
ATOM   236  C  CD2 . LEU B 1 6  ? 34.454 -35.232 -116.919 1.00 27.97 ?  26  LEU B CD2 1 
ATOM   237  N  N   . VAL B 1 7  ? 31.771 -40.147 -118.089 1.00 23.14 ?  27  VAL B N   1 
ATOM   238  C  CA  . VAL B 1 7  ? 31.824 -41.473 -118.697 1.00 21.21 ?  27  VAL B CA  1 
ATOM   239  C  C   . VAL B 1 7  ? 30.552 -41.747 -119.488 1.00 23.12 ?  27  VAL B C   1 
ATOM   240  O  O   . VAL B 1 7  ? 30.586 -42.444 -120.510 1.00 25.62 ?  27  VAL B O   1 
ATOM   241  C  CB  . VAL B 1 7  ? 32.067 -42.552 -117.625 1.00 24.43 ?  27  VAL B CB  1 
ATOM   242  C  CG1 . VAL B 1 7  ? 32.058 -43.936 -118.259 1.00 16.26 ?  27  VAL B CG1 1 
ATOM   243  C  CG2 . VAL B 1 7  ? 33.384 -42.298 -116.906 1.00 17.13 ?  27  VAL B CG2 1 
ATOM   244  N  N   . VAL B 1 8  ? 29.415 -41.203 -119.044 1.00 22.46 ?  28  VAL B N   1 
ATOM   245  C  CA  . VAL B 1 8  ? 28.182 -41.325 -119.817 1.00 24.64 ?  28  VAL B CA  1 
ATOM   246  C  C   . VAL B 1 8  ? 28.322 -40.606 -121.152 1.00 20.39 ?  28  VAL B C   1 
ATOM   247  O  O   . VAL B 1 8  ? 27.890 -41.110 -122.196 1.00 21.06 ?  28  VAL B O   1 
ATOM   248  C  CB  . VAL B 1 8  ? 26.987 -40.785 -119.011 1.00 24.25 ?  28  VAL B CB  1 
ATOM   249  C  CG1 . VAL B 1 8  ? 25.696 -40.960 -119.802 1.00 25.86 ?  28  VAL B CG1 1 
ATOM   250  C  CG2 . VAL B 1 8  ? 26.897 -41.478 -117.660 1.00 20.48 ?  28  VAL B CG2 1 
ATOM   251  N  N   . ALA B 1 9  ? 28.922 -39.413 -121.140 1.00 24.24 ?  29  ALA B N   1 
ATOM   252  C  CA  . ALA B 1 9  ? 29.130 -38.675 -122.382 1.00 18.21 ?  29  ALA B CA  1 
ATOM   253  C  C   . ALA B 1 9  ? 30.088 -39.414 -123.308 1.00 25.28 ?  29  ALA B C   1 
ATOM   254  O  O   . ALA B 1 9  ? 29.930 -39.380 -124.535 1.00 23.07 ?  29  ALA B O   1 
ATOM   255  C  CB  . ALA B 1 9  ? 29.657 -37.271 -122.078 1.00 21.36 ?  29  ALA B CB  1 
ATOM   256  N  N   . ALA B 1 10 ? 31.091 -40.086 -122.738 1.00 25.98 ?  30  ALA B N   1 
ATOM   257  C  CA  . ALA B 1 10 ? 32.030 -40.849 -123.554 1.00 21.46 ?  30  ALA B CA  1 
ATOM   258  C  C   . ALA B 1 10 ? 31.316 -41.963 -124.309 1.00 23.12 ?  30  ALA B C   1 
ATOM   259  O  O   . ALA B 1 10 ? 31.546 -42.163 -125.508 1.00 22.84 ?  30  ALA B O   1 
ATOM   260  C  CB  . ALA B 1 10 ? 33.147 -41.417 -122.676 1.00 31.95 ?  30  ALA B CB  1 
ATOM   261  N  N   . ASN B 1 11 ? 30.440 -42.701 -123.624 1.00 18.18 ?  31  ASN B N   1 
ATOM   262  C  CA  . ASN B 1 11 ? 29.686 -43.755 -124.293 1.00 21.52 ?  31  ASN B CA  1 
ATOM   263  C  C   . ASN B 1 11 ? 28.775 -43.179 -125.369 1.00 22.62 ?  31  ASN B C   1 
ATOM   264  O  O   . ASN B 1 11 ? 28.703 -43.708 -126.484 1.00 19.36 ?  31  ASN B O   1 
ATOM   265  C  CB  . ASN B 1 11 ? 28.876 -44.560 -123.273 1.00 18.61 ?  31  ASN B CB  1 
ATOM   266  C  CG  . ASN B 1 11 ? 29.723 -45.571 -122.525 1.00 25.92 ?  31  ASN B CG  1 
ATOM   267  O  OD1 . ASN B 1 11 ? 30.245 -46.516 -123.115 1.00 28.40 ?  31  ASN B OD1 1 
ATOM   268  N  ND2 . ASN B 1 11 ? 29.854 -45.383 -121.218 1.00 20.50 ?  31  ASN B ND2 1 
ATOM   269  N  N   . ILE B 1 12 ? 28.069 -42.090 -125.054 1.00 18.46 ?  32  ILE B N   1 
ATOM   270  C  CA  . ILE B 1 12 ? 27.135 -41.507 -126.015 1.00 18.87 ?  32  ILE B CA  1 
ATOM   271  C  C   . ILE B 1 12 ? 27.869 -41.094 -127.284 1.00 21.11 ?  32  ILE B C   1 
ATOM   272  O  O   . ILE B 1 12 ? 27.428 -41.385 -128.403 1.00 14.18 ?  32  ILE B O   1 
ATOM   273  C  CB  . ILE B 1 12 ? 26.385 -40.318 -125.389 1.00 19.67 ?  32  ILE B CB  1 
ATOM   274  C  CG1 . ILE B 1 12 ? 25.563 -40.778 -124.183 1.00 21.76 ?  32  ILE B CG1 1 
ATOM   275  C  CG2 . ILE B 1 12 ? 25.493 -39.652 -126.431 1.00 18.10 ?  32  ILE B CG2 1 
ATOM   276  C  CD1 . ILE B 1 12 ? 24.840 -39.651 -123.470 1.00 28.98 ?  32  ILE B CD1 1 
ATOM   277  N  N   . ILE B 1 13 ? 29.002 -40.406 -127.126 1.00 18.81 ?  33  ILE B N   1 
ATOM   278  C  CA  . ILE B 1 13 ? 29.782 -39.972 -128.281 1.00 17.50 ?  33  ILE B CA  1 
ATOM   279  C  C   . ILE B 1 13 ? 30.278 -41.176 -129.070 1.00 18.92 ?  33  ILE B C   1 
ATOM   280  O  O   . ILE B 1 13 ? 30.117 -41.247 -130.295 1.00 18.79 ?  33  ILE B O   1 
ATOM   281  C  CB  . ILE B 1 13 ? 30.948 -39.074 -127.832 1.00 22.33 ?  33  ILE B CB  1 
ATOM   282  C  CG1 . ILE B 1 13 ? 30.409 -37.775 -127.235 1.00 23.59 ?  33  ILE B CG1 1 
ATOM   283  C  CG2 . ILE B 1 13 ? 31.883 -38.786 -129.000 1.00 25.08 ?  33  ILE B CG2 1 
ATOM   284  C  CD1 . ILE B 1 13 ? 29.432 -37.058 -128.144 1.00 28.73 ?  33  ILE B CD1 1 
ATOM   285  N  N   . GLY B 1 14 ? 30.887 -42.141 -128.380 1.00 21.09 ?  34  GLY B N   1 
ATOM   286  C  CA  . GLY B 1 14 ? 31.430 -43.299 -129.073 1.00 17.30 ?  34  GLY B CA  1 
ATOM   287  C  C   . GLY B 1 14 ? 30.373 -44.072 -129.840 1.00 20.56 ?  34  GLY B C   1 
ATOM   288  O  O   . GLY B 1 14 ? 30.562 -44.415 -131.009 1.00 20.01 ?  34  GLY B O   1 
ATOM   289  N  N   . ILE B 1 15 ? 29.242 -44.357 -129.190 1.00 17.64 ?  35  ILE B N   1 
ATOM   290  C  CA  . ILE B 1 15 ? 28.240 -45.166 -129.878 1.00 20.21 ?  35  ILE B CA  1 
ATOM   291  C  C   . ILE B 1 15 ? 27.583 -44.371 -131.000 1.00 18.54 ?  35  ILE B C   1 
ATOM   292  O  O   . ILE B 1 15 ? 27.290 -44.914 -132.072 1.00 19.82 ?  35  ILE B O   1 
ATOM   293  C  CB  . ILE B 1 15 ? 27.201 -45.703 -128.876 1.00 21.40 ?  35  ILE B CB  1 
ATOM   294  C  CG1 . ILE B 1 15 ? 26.000 -46.289 -129.620 1.00 26.71 ?  35  ILE B CG1 1 
ATOM   295  C  CG2 . ILE B 1 15 ? 26.742 -44.605 -127.941 1.00 27.09 ?  35  ILE B CG2 1 
ATOM   296  C  CD1 . ILE B 1 15 ? 24.990 -46.965 -128.711 1.00 45.82 ?  35  ILE B CD1 1 
ATOM   297  N  N   . LEU B 1 16 ? 27.397 -43.060 -130.835 1.00 16.48 ?  36  LEU B N   1 
ATOM   298  C  CA  . LEU B 1 16 ? 26.893 -42.248 -131.939 1.00 18.72 ?  36  LEU B CA  1 
ATOM   299  C  C   . LEU B 1 16 ? 27.847 -42.296 -133.125 1.00 17.41 ?  36  LEU B C   1 
ATOM   300  O  O   . LEU B 1 16 ? 27.426 -42.487 -134.272 1.00 16.23 ?  36  LEU B O   1 
ATOM   301  C  CB  . LEU B 1 16 ? 26.674 -40.806 -131.482 1.00 17.29 ?  36  LEU B CB  1 
ATOM   302  C  CG  . LEU B 1 16 ? 26.328 -39.796 -132.585 1.00 29.30 ?  36  LEU B CG  1 
ATOM   303  C  CD1 . LEU B 1 16 ? 25.004 -40.138 -133.260 1.00 24.14 ?  36  LEU B CD1 1 
ATOM   304  C  CD2 . LEU B 1 16 ? 26.307 -38.372 -132.046 1.00 22.61 ?  36  LEU B CD2 1 
ATOM   305  N  N   . HIS B 1 17 ? 29.145 -42.126 -132.864 1.00 20.77 ?  37  HIS B N   1 
ATOM   306  C  CA  . HIS B 1 17 ? 30.128 -42.148 -133.942 1.00 18.93 ?  37  HIS B CA  1 
ATOM   307  C  C   . HIS B 1 17 ? 30.132 -43.497 -134.650 1.00 17.26 ?  37  HIS B C   1 
ATOM   308  O  O   . HIS B 1 17 ? 30.133 -43.564 -135.884 1.00 17.79 ?  37  HIS B O   1 
ATOM   309  C  CB  . HIS B 1 17 ? 31.514 -41.820 -133.387 1.00 15.90 ?  37  HIS B CB  1 
ATOM   310  C  CG  . HIS B 1 17 ? 32.552 -41.602 -134.442 1.00 18.87 ?  37  HIS B CG  1 
ATOM   311  N  ND1 . HIS B 1 17 ? 33.852 -41.254 -134.145 1.00 19.33 ?  37  HIS B ND1 1 
ATOM   312  C  CD2 . HIS B 1 17 ? 32.483 -41.685 -135.792 1.00 21.29 ?  37  HIS B CD2 1 
ATOM   313  C  CE1 . HIS B 1 17 ? 34.539 -41.131 -135.267 1.00 20.27 ?  37  HIS B CE1 1 
ATOM   314  N  NE2 . HIS B 1 17 ? 33.732 -41.387 -136.280 1.00 24.34 ?  37  HIS B NE2 1 
ATOM   315  N  N   . LEU B 1 18 ? 30.132 -44.588 -133.881 1.00 17.05 ?  38  LEU B N   1 
ATOM   316  C  CA  . LEU B 1 18 ? 30.098 -45.915 -134.487 1.00 17.65 ?  38  LEU B CA  1 
ATOM   317  C  C   . LEU B 1 18 ? 28.827 -46.117 -135.303 1.00 13.50 ?  38  LEU B C   1 
ATOM   318  O  O   . LEU B 1 18 ? 28.871 -46.646 -136.418 1.00 15.08 ?  38  LEU B O   1 
ATOM   319  C  CB  . LEU B 1 18 ? 30.221 -46.985 -133.403 1.00 15.25 ?  38  LEU B CB  1 
ATOM   320  C  CG  . LEU B 1 18 ? 30.012 -48.440 -133.826 1.00 22.28 ?  38  LEU B CG  1 
ATOM   321  C  CD1 . LEU B 1 18 ? 30.978 -48.828 -134.931 1.00 13.88 ?  38  LEU B CD1 1 
ATOM   322  C  CD2 . LEU B 1 18 ? 30.173 -49.355 -132.627 1.00 20.70 ?  38  LEU B CD2 1 
ATOM   323  N  N   . ILE B 1 19 ? 27.685 -45.681 -134.772 1.00 15.67 ?  39  ILE B N   1 
ATOM   324  C  CA  . ILE B 1 19 ? 26.421 -45.871 -135.476 1.00 17.30 ?  39  ILE B CA  1 
ATOM   325  C  C   . ILE B 1 19 ? 26.403 -45.064 -136.768 1.00 22.22 ?  39  ILE B C   1 
ATOM   326  O  O   . ILE B 1 19 ? 26.045 -45.578 -137.835 1.00 18.19 ?  39  ILE B O   1 
ATOM   327  C  CB  . ILE B 1 19 ? 25.241 -45.501 -134.562 1.00 19.62 ?  39  ILE B CB  1 
ATOM   328  C  CG1 . ILE B 1 19 ? 25.104 -46.528 -133.435 1.00 17.90 ?  39  ILE B CG1 1 
ATOM   329  C  CG2 . ILE B 1 19 ? 23.960 -45.384 -135.371 1.00 23.40 ?  39  ILE B CG2 1 
ATOM   330  C  CD1 . ILE B 1 19 ? 24.004 -46.211 -132.448 1.00 26.51 ?  39  ILE B CD1 1 
ATOM   331  N  N   . LEU B 1 20 ? 26.785 -43.787 -136.691 1.00 17.70 ?  40  LEU B N   1 
ATOM   332  C  CA  . LEU B 1 20 ? 26.777 -42.945 -137.882 1.00 15.29 ?  40  LEU B CA  1 
ATOM   333  C  C   . LEU B 1 20 ? 27.720 -43.488 -138.948 1.00 16.09 ?  40  LEU B C   1 
ATOM   334  O  O   . LEU B 1 20 ? 27.432 -43.395 -140.148 1.00 20.54 ?  40  LEU B O   1 
ATOM   335  C  CB  . LEU B 1 20 ? 27.150 -41.509 -137.510 1.00 21.76 ?  40  LEU B CB  1 
ATOM   336  C  CG  . LEU B 1 20 ? 26.138 -40.738 -136.659 1.00 21.67 ?  40  LEU B CG  1 
ATOM   337  C  CD1 . LEU B 1 20 ? 26.689 -39.377 -136.261 1.00 20.16 ?  40  LEU B CD1 1 
ATOM   338  C  CD2 . LEU B 1 20 ? 24.824 -40.589 -137.408 1.00 22.67 ?  40  LEU B CD2 1 
ATOM   339  N  N   . TRP B 1 21 ? 28.851 -44.061 -138.532 1.00 16.74 ?  41  TRP B N   1 
ATOM   340  C  CA  . TRP B 1 21 ? 29.813 -44.576 -139.502 1.00 19.40 ?  41  TRP B CA  1 
ATOM   341  C  C   . TRP B 1 21 ? 29.291 -45.838 -140.179 1.00 18.34 ?  41  TRP B C   1 
ATOM   342  O  O   . TRP B 1 21 ? 29.393 -45.983 -141.402 1.00 17.80 ?  41  TRP B O   1 
ATOM   343  C  CB  . TRP B 1 21 ? 31.157 -44.841 -138.822 1.00 20.29 ?  41  TRP B CB  1 
ATOM   344  C  CG  . TRP B 1 21 ? 32.151 -45.511 -139.723 1.00 18.46 ?  41  TRP B CG  1 
ATOM   345  C  CD1 . TRP B 1 21 ? 32.844 -44.935 -140.750 1.00 21.76 ?  41  TRP B CD1 1 
ATOM   346  C  CD2 . TRP B 1 21 ? 32.568 -46.882 -139.676 1.00 24.30 ?  41  TRP B CD2 1 
ATOM   347  N  NE1 . TRP B 1 21 ? 33.661 -45.866 -141.349 1.00 21.58 ?  41  TRP B NE1 1 
ATOM   348  C  CE2 . TRP B 1 21 ? 33.511 -47.067 -140.708 1.00 20.41 ?  41  TRP B CE2 1 
ATOM   349  C  CE3 . TRP B 1 21 ? 32.234 -47.971 -138.862 1.00 21.62 ?  41  TRP B CE3 1 
ATOM   350  C  CZ2 . TRP B 1 21 ? 34.123 -48.297 -140.948 1.00 19.41 ?  41  TRP B CZ2 1 
ATOM   351  C  CZ3 . TRP B 1 21 ? 32.844 -49.191 -139.102 1.00 18.33 ?  41  TRP B CZ3 1 
ATOM   352  C  CH2 . TRP B 1 21 ? 33.777 -49.344 -140.138 1.00 21.36 ?  41  TRP B CH2 1 
ATOM   353  N  N   . ILE B 1 22 ? 28.730 -46.762 -139.399 1.00 20.48 ?  42  ILE B N   1 
ATOM   354  C  CA  . ILE B 1 22 ? 28.133 -47.961 -139.979 1.00 21.39 ?  42  ILE B CA  1 
ATOM   355  C  C   . ILE B 1 22 ? 27.052 -47.579 -140.982 1.00 21.38 ?  42  ILE B C   1 
ATOM   356  O  O   . ILE B 1 22 ? 27.048 -48.042 -142.129 1.00 22.63 ?  42  ILE B O   1 
ATOM   357  C  CB  . ILE B 1 22 ? 27.578 -48.869 -138.868 1.00 19.71 ?  42  ILE B CB  1 
ATOM   358  C  CG1 . ILE B 1 22 ? 28.724 -49.462 -138.044 1.00 16.05 ?  42  ILE B CG1 1 
ATOM   359  C  CG2 . ILE B 1 22 ? 26.692 -49.955 -139.460 1.00 22.99 ?  42  ILE B CG2 1 
ATOM   360  C  CD1 . ILE B 1 22 ? 28.262 -50.191 -136.801 1.00 22.79 ?  42  ILE B CD1 1 
ATOM   361  N  N   . LEU B 1 23 ? 26.120 -46.719 -140.563 1.00 19.67 ?  43  LEU B N   1 
ATOM   362  C  CA  . LEU B 1 23 ? 25.032 -46.273 -141.427 1.00 21.68 ?  43  LEU B CA  1 
ATOM   363  C  C   . LEU B 1 23 ? 25.568 -45.624 -142.696 1.00 17.09 ?  43  LEU B C   1 
ATOM   364  O  O   . LEU B 1 23 ? 25.024 -45.834 -143.785 1.00 22.73 ?  43  LEU B O   1 
ATOM   365  C  CB  . LEU B 1 23 ? 24.121 -45.307 -140.665 1.00 19.69 ?  43  LEU B CB  1 
ATOM   366  C  CG  . LEU B 1 23 ? 23.111 -45.919 -139.687 1.00 23.31 ?  43  LEU B CG  1 
ATOM   367  C  CD1 . LEU B 1 23 ? 22.129 -44.879 -139.168 1.00 27.12 ?  43  LEU B CD1 1 
ATOM   368  C  CD2 . LEU B 1 23 ? 22.368 -47.086 -140.320 1.00 29.40 ?  43  LEU B CD2 1 
ATOM   369  N  N   . ASP B 1 24 ? 26.597 -44.788 -142.542 1.00 22.79 ?  44  ASP B N   1 
ATOM   370  C  CA  . ASP B 1 24 ? 27.206 -44.140 -143.701 1.00 21.73 ?  44  ASP B CA  1 
ATOM   371  C  C   . ASP B 1 24 ? 27.729 -45.173 -144.694 1.00 28.73 ?  44  ASP B C   1 
ATOM   372  O  O   . ASP B 1 24 ? 27.500 -45.063 -145.904 1.00 27.53 ?  44  ASP B O   1 
ATOM   373  C  CB  . ASP B 1 24 ? 28.333 -43.212 -143.248 1.00 25.62 ?  44  ASP B CB  1 
ATOM   374  C  CG  . ASP B 1 24 ? 28.970 -42.461 -144.402 1.00 28.16 ?  44  ASP B CG  1 
ATOM   375  O  OD1 . ASP B 1 24 ? 28.378 -42.436 -145.502 1.00 26.29 ?  44  ASP B OD1 1 
ATOM   376  O  OD2 . ASP B 1 24 ? 30.068 -41.896 -144.209 1.00 30.16 -1 44  ASP B OD2 1 
ATOM   377  N  N   . ARG B 1 25 ? 28.429 -46.191 -144.192 1.00 25.80 ?  45  ARG B N   1 
ATOM   378  C  CA  . ARG B 1 25 ? 29.035 -47.181 -145.070 1.00 27.88 ?  45  ARG B CA  1 
ATOM   379  C  C   . ARG B 1 25 ? 27.981 -48.023 -145.776 1.00 27.22 ?  45  ARG B C   1 
ATOM   380  O  O   . ARG B 1 25 ? 28.096 -48.289 -146.977 1.00 33.00 ?  45  ARG B O   1 
ATOM   381  C  CB  . ARG B 1 25 ? 29.990 -48.063 -144.271 1.00 28.29 ?  45  ARG B CB  1 
ATOM   382  C  CG  . ARG B 1 25 ? 31.319 -47.393 -143.966 1.00 30.47 ?  45  ARG B CG  1 
ATOM   383  C  CD  . ARG B 1 25 ? 32.149 -47.247 -145.228 1.00 31.08 ?  45  ARG B CD  1 
ATOM   384  N  NE  . ARG B 1 25 ? 32.672 -48.531 -145.682 1.00 30.99 ?  45  ARG B NE  1 
ATOM   385  C  CZ  . ARG B 1 25 ? 32.239 -49.181 -146.758 1.00 34.11 ?  45  ARG B CZ  1 
ATOM   386  N  NH1 . ARG B 1 25 ? 31.269 -48.668 -147.504 1.00 34.39 1  45  ARG B NH1 1 
ATOM   387  N  NH2 . ARG B 1 25 ? 32.778 -50.342 -147.089 1.00 29.34 ?  45  ARG B NH2 1 
ATOM   388  N  N   . LEU B 1 26 ? 26.938 -48.437 -145.055 1.00 21.51 ?  46  LEU B N   1 
ATOM   389  C  CA  . LEU B 1 26 ? 25.887 -49.272 -145.637 1.00 29.65 ?  46  LEU B CA  1 
ATOM   390  C  C   . LEU B 1 26 ? 24.913 -48.468 -146.497 1.00 38.36 ?  46  LEU B C   1 
ATOM   391  O  O   . LEU B 1 26 ? 23.830 -48.949 -146.828 1.00 40.61 ?  46  LEU B O   1 
ATOM   392  C  CB  . LEU B 1 26 ? 25.107 -50.004 -144.540 1.00 27.23 ?  46  LEU B CB  1 
ATOM   393  C  CG  . LEU B 1 26 ? 25.897 -50.704 -143.436 1.00 32.59 ?  46  LEU B CG  1 
ATOM   394  C  CD1 . LEU B 1 26 ? 24.953 -51.196 -142.357 1.00 36.64 ?  46  LEU B CD1 1 
ATOM   395  C  CD2 . LEU B 1 26 ? 26.731 -51.852 -143.985 1.00 33.38 ?  46  LEU B CD2 1 
HETATM 396  N  N   . NH2 B 1 27 ? 25.299 -47.247 -146.853 1.00 43.22 ?  47  NH2 B N   1 
HETATM 397  C  C   . ACE C 1 1  ? 35.059 -33.088 -107.245 1.00 45.39 ?  21  ACE C C   1 
HETATM 398  O  O   . ACE C 1 1  ? 34.472 -33.383 -106.205 1.00 51.01 ?  21  ACE C O   1 
HETATM 399  C  CH3 . ACE C 1 1  ? 34.515 -32.061 -108.196 1.00 37.10 ?  21  ACE C CH3 1 
ATOM   400  N  N   . SER C 1 2  ? 36.216 -33.656 -107.578 1.00 38.68 ?  22  SER C N   1 
ATOM   401  C  CA  . SER C 1 2  ? 36.935 -33.325 -108.804 1.00 41.83 ?  22  SER C CA  1 
ATOM   402  C  C   . SER C 1 2  ? 36.491 -34.212 -109.965 1.00 35.34 ?  22  SER C C   1 
ATOM   403  O  O   . SER C 1 2  ? 35.636 -35.083 -109.804 1.00 37.47 ?  22  SER C O   1 
ATOM   404  C  CB  . SER C 1 2  ? 38.444 -33.457 -108.592 1.00 40.08 ?  22  SER C CB  1 
ATOM   405  O  OG  . SER C 1 2  ? 38.812 -33.048 -107.286 1.00 52.84 ?  22  SER C OG  1 
ATOM   406  N  N   . SER C 1 3  ? 37.087 -33.986 -111.132 1.00 41.76 ?  23  SER C N   1 
ATOM   407  C  CA  . SER C 1 3  ? 36.810 -34.766 -112.329 1.00 30.24 ?  23  SER C CA  1 
ATOM   408  C  C   . SER C 1 3  ? 38.084 -35.464 -112.782 1.00 29.78 ?  23  SER C C   1 
ATOM   409  O  O   . SER C 1 3  ? 39.183 -34.913 -112.659 1.00 27.87 ?  23  SER C O   1 
ATOM   410  C  CB  . SER C 1 3  ? 36.265 -33.883 -113.457 1.00 35.41 ?  23  SER C CB  1 
ATOM   411  O  OG  . SER C 1 3  ? 34.988 -33.364 -113.127 1.00 51.01 ?  23  SER C OG  1 
ATOM   412  N  N   . ASP C 1 4  ? 37.930 -36.675 -113.298 1.00 29.47 ?  24  ASP C N   1 
ATOM   413  C  CA  . ASP C 1 4  ? 39.071 -37.446 -113.775 1.00 22.26 ?  24  ASP C CA  1 
ATOM   414  C  C   . ASP C 1 4  ? 39.633 -36.806 -115.037 1.00 28.88 ?  24  ASP C C   1 
ATOM   415  O  O   . ASP C 1 4  ? 38.912 -36.698 -116.038 1.00 23.39 ?  24  ASP C O   1 
ATOM   416  C  CB  . ASP C 1 4  ? 38.651 -38.889 -114.043 1.00 23.51 ?  24  ASP C CB  1 
ATOM   417  C  CG  . ASP C 1 4  ? 39.818 -39.781 -114.429 1.00 28.77 ?  24  ASP C CG  1 
ATOM   418  O  OD1 . ASP C 1 4  ? 40.982 -39.344 -114.310 1.00 29.45 ?  24  ASP C OD1 1 
ATOM   419  O  OD2 . ASP C 1 4  ? 39.569 -40.929 -114.854 1.00 26.54 -1 24  ASP C OD2 1 
ATOM   420  N  N   . PRO C 1 5  ? 40.893 -36.365 -115.040 1.00 23.52 ?  25  PRO C N   1 
ATOM   421  C  CA  . PRO C 1 5  ? 41.453 -35.779 -116.268 1.00 25.59 ?  25  PRO C CA  1 
ATOM   422  C  C   . PRO C 1 5  ? 41.554 -36.766 -117.417 1.00 24.51 ?  25  PRO C C   1 
ATOM   423  O  O   . PRO C 1 5  ? 41.548 -36.344 -118.580 1.00 24.87 ?  25  PRO C O   1 
ATOM   424  C  CB  . PRO C 1 5  ? 42.836 -35.282 -115.823 1.00 24.99 ?  25  PRO C CB  1 
ATOM   425  C  CG  . PRO C 1 5  ? 43.154 -36.074 -114.599 1.00 34.98 ?  25  PRO C CG  1 
ATOM   426  C  CD  . PRO C 1 5  ? 41.843 -36.310 -113.916 1.00 26.78 ?  25  PRO C CD  1 
ATOM   427  N  N   . LEU C 1 6  ? 41.643 -38.069 -117.134 1.00 19.15 ?  26  LEU C N   1 
ATOM   428  C  CA  . LEU C 1 6  ? 41.691 -39.042 -118.220 1.00 22.05 ?  26  LEU C CA  1 
ATOM   429  C  C   . LEU C 1 6  ? 40.333 -39.214 -118.886 1.00 19.79 ?  26  LEU C C   1 
ATOM   430  O  O   . LEU C 1 6  ? 40.268 -39.491 -120.088 1.00 23.61 ?  26  LEU C O   1 
ATOM   431  C  CB  . LEU C 1 6  ? 42.204 -40.385 -117.702 1.00 26.63 ?  26  LEU C CB  1 
ATOM   432  C  CG  . LEU C 1 6  ? 43.661 -40.366 -117.237 1.00 29.01 ?  26  LEU C CG  1 
ATOM   433  C  CD1 . LEU C 1 6  ? 44.103 -41.746 -116.782 1.00 26.29 ?  26  LEU C CD1 1 
ATOM   434  C  CD2 . LEU C 1 6  ? 44.564 -39.847 -118.348 1.00 30.55 ?  26  LEU C CD2 1 
ATOM   435  N  N   . VAL C 1 7  ? 39.243 -39.060 -118.130 1.00 23.69 ?  27  VAL C N   1 
ATOM   436  C  CA  . VAL C 1 7  ? 37.915 -39.146 -118.730 1.00 18.49 ?  27  VAL C CA  1 
ATOM   437  C  C   . VAL C 1 7  ? 37.630 -37.907 -119.569 1.00 25.41 ?  27  VAL C C   1 
ATOM   438  O  O   . VAL C 1 7  ? 37.001 -37.991 -120.632 1.00 24.16 ?  27  VAL C O   1 
ATOM   439  C  CB  . VAL C 1 7  ? 36.846 -39.359 -117.644 1.00 22.83 ?  27  VAL C CB  1 
ATOM   440  C  CG1 . VAL C 1 7  ? 35.459 -39.449 -118.270 1.00 22.62 ?  27  VAL C CG1 1 
ATOM   441  C  CG2 . VAL C 1 7  ? 37.153 -40.610 -116.837 1.00 23.13 ?  27  VAL C CG2 1 
ATOM   442  N  N   . VAL C 1 8  ? 38.089 -36.737 -119.111 1.00 22.23 ?  28  VAL C N   1 
ATOM   443  C  CA  . VAL C 1 8  ? 37.977 -35.528 -119.923 1.00 22.82 ?  28  VAL C CA  1 
ATOM   444  C  C   . VAL C 1 8  ? 38.759 -35.687 -121.220 1.00 20.60 ?  28  VAL C C   1 
ATOM   445  O  O   . VAL C 1 8  ? 38.277 -35.328 -122.301 1.00 22.99 ?  28  VAL C O   1 
ATOM   446  C  CB  . VAL C 1 8  ? 38.447 -34.296 -119.125 1.00 28.06 ?  28  VAL C CB  1 
ATOM   447  C  CG1 . VAL C 1 8  ? 38.477 -33.058 -120.022 1.00 21.62 ?  28  VAL C CG1 1 
ATOM   448  C  CG2 . VAL C 1 8  ? 37.548 -34.068 -117.918 1.00 23.12 ?  28  VAL C CG2 1 
ATOM   449  N  N   . ALA C 1 9  ? 39.979 -36.225 -121.133 1.00 25.51 ?  29  ALA C N   1 
ATOM   450  C  CA  . ALA C 1 9  ? 40.754 -36.495 -122.339 1.00 19.07 ?  29  ALA C CA  1 
ATOM   451  C  C   . ALA C 1 9  ? 40.014 -37.455 -123.260 1.00 22.43 ?  29  ALA C C   1 
ATOM   452  O  O   . ALA C 1 9  ? 39.969 -37.248 -124.479 1.00 21.70 ?  29  ALA C O   1 
ATOM   453  C  CB  . ALA C 1 9  ? 42.127 -37.057 -121.965 1.00 21.02 ?  29  ALA C CB  1 
ATOM   454  N  N   . ALA C 1 10 ? 39.430 -38.514 -122.696 1.00 21.28 ?  30  ALA C N   1 
ATOM   455  C  CA  . ALA C 1 10 ? 38.645 -39.443 -123.501 1.00 20.75 ?  30  ALA C CA  1 
ATOM   456  C  C   . ALA C 1 10 ? 37.542 -38.712 -124.257 1.00 23.37 ?  30  ALA C C   1 
ATOM   457  O  O   . ALA C 1 10 ? 37.365 -38.907 -125.466 1.00 19.27 ?  30  ALA C O   1 
ATOM   458  C  CB  . ALA C 1 10 ? 38.059 -40.540 -122.612 1.00 25.30 ?  30  ALA C CB  1 
ATOM   459  N  N   . ASN C 1 11 ? 36.791 -37.857 -123.557 1.00 19.34 ?  31  ASN C N   1 
ATOM   460  C  CA  . ASN C 1 11 ? 35.738 -37.084 -124.209 1.00 21.77 ?  31  ASN C CA  1 
ATOM   461  C  C   . ASN C 1 11 ? 36.307 -36.209 -125.318 1.00 20.13 ?  31  ASN C C   1 
ATOM   462  O  O   . ASN C 1 11 ? 35.778 -36.175 -126.435 1.00 18.99 ?  31  ASN C O   1 
ATOM   463  C  CB  . ASN C 1 11 ? 34.998 -36.228 -123.179 1.00 22.44 ?  31  ASN C CB  1 
ATOM   464  C  CG  . ASN C 1 11 ? 34.209 -37.060 -122.181 1.00 31.21 ?  31  ASN C CG  1 
ATOM   465  O  OD1 . ASN C 1 11 ? 33.595 -38.065 -122.539 1.00 30.11 ?  31  ASN C OD1 1 
ATOM   466  N  ND2 . ASN C 1 11 ? 34.222 -36.641 -120.922 1.00 26.70 ?  31  ASN C ND2 1 
ATOM   467  N  N   . ILE C 1 12 ? 37.391 -35.489 -125.024 1.00 17.79 ?  32  ILE C N   1 
ATOM   468  C  CA  . ILE C 1 12 ? 37.964 -34.571 -126.004 1.00 20.30 ?  32  ILE C CA  1 
ATOM   469  C  C   . ILE C 1 12 ? 38.360 -35.322 -127.268 1.00 20.67 ?  32  ILE C C   1 
ATOM   470  O  O   . ILE C 1 12 ? 38.065 -34.889 -128.389 1.00 15.08 ?  32  ILE C O   1 
ATOM   471  C  CB  . ILE C 1 12 ? 39.159 -33.817 -125.396 1.00 19.86 ?  32  ILE C CB  1 
ATOM   472  C  CG1 . ILE C 1 12 ? 38.686 -32.914 -124.254 1.00 22.99 ?  32  ILE C CG1 1 
ATOM   473  C  CG2 . ILE C 1 12 ? 39.883 -33.015 -126.469 1.00 20.26 ?  32  ILE C CG2 1 
ATOM   474  C  CD1 . ILE C 1 12 ? 39.800 -32.168 -123.562 1.00 21.37 ?  32  ILE C CD1 1 
ATOM   475  N  N   . ILE C 1 13 ? 39.036 -36.461 -127.108 1.00 17.20 ?  33  ILE C N   1 
ATOM   476  C  CA  . ILE C 1 13 ? 39.470 -37.232 -128.269 1.00 19.04 ?  33  ILE C CA  1 
ATOM   477  C  C   . ILE C 1 13 ? 38.264 -37.714 -129.065 1.00 20.64 ?  33  ILE C C   1 
ATOM   478  O  O   . ILE C 1 13 ? 38.213 -37.583 -130.295 1.00 18.28 ?  33  ILE C O   1 
ATOM   479  C  CB  . ILE C 1 13 ? 40.365 -38.404 -127.829 1.00 19.56 ?  33  ILE C CB  1 
ATOM   480  C  CG1 . ILE C 1 13 ? 41.566 -37.882 -127.040 1.00 25.32 ?  33  ILE C CG1 1 
ATOM   481  C  CG2 . ILE C 1 13 ? 40.827 -39.202 -129.037 1.00 22.69 ?  33  ILE C CG2 1 
ATOM   482  C  CD1 . ILE C 1 13 ? 42.419 -36.898 -127.814 1.00 31.56 ?  33  ILE C CD1 1 
ATOM   483  N  N   . GLY C 1 14 ? 37.269 -38.272 -128.372 1.00 16.42 ?  34  GLY C N   1 
ATOM   484  C  CA  . GLY C 1 14 ? 36.099 -38.789 -129.062 1.00 20.70 ?  34  GLY C CA  1 
ATOM   485  C  C   . GLY C 1 14 ? 35.304 -37.710 -129.773 1.00 20.27 ?  34  GLY C C   1 
ATOM   486  O  O   . GLY C 1 14 ? 34.840 -37.912 -130.899 1.00 15.13 ?  34  GLY C O   1 
ATOM   487  N  N   . ILE C 1 15 ? 35.133 -36.554 -129.129 1.00 20.20 ?  35  ILE C N   1 
ATOM   488  C  CA  . ILE C 1 15 ? 34.374 -35.464 -129.739 1.00 22.21 ?  35  ILE C CA  1 
ATOM   489  C  C   . ILE C 1 15 ? 35.095 -34.934 -130.970 1.00 19.89 ?  35  ILE C C   1 
ATOM   490  O  O   . ILE C 1 15 ? 34.475 -34.657 -132.004 1.00 19.68 ?  35  ILE C O   1 
ATOM   491  C  CB  . ILE C 1 15 ? 34.126 -34.342 -128.714 1.00 16.34 ?  35  ILE C CB  1 
ATOM   492  C  CG1 . ILE C 1 15 ? 33.437 -34.897 -127.467 1.00 24.62 ?  35  ILE C CG1 1 
ATOM   493  C  CG2 . ILE C 1 15 ? 33.291 -33.238 -129.341 1.00 26.97 ?  35  ILE C CG2 1 
ATOM   494  C  CD1 . ILE C 1 15 ? 33.543 -33.987 -126.262 1.00 24.94 ?  35  ILE C CD1 1 
ATOM   495  N  N   . LEU C 1 16 ? 36.413 -34.755 -130.869 1.00 21.94 ?  36  LEU C N   1 
ATOM   496  C  CA  . LEU C 1 16 ? 37.182 -34.269 -132.009 1.00 18.78 ?  36  LEU C CA  1 
ATOM   497  C  C   . LEU C 1 16 ? 37.111 -35.249 -133.171 1.00 17.33 ?  36  LEU C C   1 
ATOM   498  O  O   . LEU C 1 16 ? 36.874 -34.856 -134.320 1.00 15.20 ?  36  LEU C O   1 
ATOM   499  C  CB  . LEU C 1 16 ? 38.635 -34.031 -131.599 1.00 15.91 ?  36  LEU C CB  1 
ATOM   500  C  CG  . LEU C 1 16 ? 39.549 -33.566 -132.734 1.00 26.15 ?  36  LEU C CG  1 
ATOM   501  C  CD1 . LEU C 1 16 ? 39.092 -32.208 -133.257 1.00 27.59 ?  36  LEU C CD1 1 
ATOM   502  C  CD2 . LEU C 1 16 ? 40.998 -33.514 -132.279 1.00 26.36 ?  36  LEU C CD2 1 
ATOM   503  N  N   . HIS C 1 17 ? 37.316 -36.537 -132.890 1.00 18.98 ?  37  HIS C N   1 
ATOM   504  C  CA  . HIS C 1 17 ? 37.265 -37.544 -133.944 1.00 17.34 ?  37  HIS C CA  1 
ATOM   505  C  C   . HIS C 1 17 ? 35.917 -37.525 -134.653 1.00 18.55 ?  37  HIS C C   1 
ATOM   506  O  O   . HIS C 1 17 ? 35.850 -37.522 -135.887 1.00 19.91 ?  37  HIS C O   1 
ATOM   507  C  CB  . HIS C 1 17 ? 37.551 -38.929 -133.362 1.00 13.98 ?  37  HIS C CB  1 
ATOM   508  C  CG  . HIS C 1 17 ? 37.757 -39.987 -134.400 1.00 18.75 ?  37  HIS C CG  1 
ATOM   509  N  ND1 . HIS C 1 17 ? 37.981 -41.310 -134.084 1.00 18.02 ?  37  HIS C ND1 1 
ATOM   510  C  CD2 . HIS C 1 17 ? 37.773 -39.916 -135.753 1.00 20.86 ?  37  HIS C CD2 1 
ATOM   511  C  CE1 . HIS C 1 17 ? 38.125 -42.008 -135.196 1.00 17.82 ?  37  HIS C CE1 1 
ATOM   512  N  NE2 . HIS C 1 17 ? 38.005 -41.186 -136.223 1.00 16.79 ?  37  HIS C NE2 1 
ATOM   513  N  N   . LEU C 1 18 ? 34.827 -37.512 -133.884 1.00 19.19 ?  38  LEU C N   1 
ATOM   514  C  CA  . LEU C 1 18 ? 33.500 -37.467 -134.490 1.00 19.88 ?  38  LEU C CA  1 
ATOM   515  C  C   . LEU C 1 18 ? 33.311 -36.197 -135.312 1.00 18.17 ?  38  LEU C C   1 
ATOM   516  O  O   . LEU C 1 18 ? 32.795 -36.244 -136.434 1.00 18.96 ?  38  LEU C O   1 
ATOM   517  C  CB  . LEU C 1 18 ? 32.428 -37.573 -133.406 1.00 17.21 ?  38  LEU C CB  1 
ATOM   518  C  CG  . LEU C 1 18 ? 30.979 -37.333 -133.828 1.00 20.26 ?  38  LEU C CG  1 
ATOM   519  C  CD1 . LEU C 1 18 ? 30.530 -38.359 -134.854 1.00 17.79 ?  38  LEU C CD1 1 
ATOM   520  C  CD2 . LEU C 1 18 ? 30.069 -37.351 -132.612 1.00 20.56 ?  38  LEU C CD2 1 
ATOM   521  N  N   . ILE C 1 19 ? 33.734 -35.054 -134.772 1.00 18.85 ?  39  ILE C N   1 
ATOM   522  C  CA  . ILE C 1 19 ? 33.575 -33.787 -135.482 1.00 22.83 ?  39  ILE C CA  1 
ATOM   523  C  C   . ILE C 1 19 ? 34.370 -33.803 -136.781 1.00 21.45 ?  39  ILE C C   1 
ATOM   524  O  O   . ILE C 1 19 ? 33.850 -33.475 -137.854 1.00 21.35 ?  39  ILE C O   1 
ATOM   525  C  CB  . ILE C 1 19 ? 33.994 -32.614 -134.582 1.00 22.61 ?  39  ILE C CB  1 
ATOM   526  C  CG1 . ILE C 1 19 ? 33.027 -32.477 -133.404 1.00 25.05 ?  39  ILE C CG1 1 
ATOM   527  C  CG2 . ILE C 1 19 ? 34.072 -31.322 -135.389 1.00 25.36 ?  39  ILE C CG2 1 
ATOM   528  C  CD1 . ILE C 1 19 ? 33.462 -31.461 -132.378 1.00 26.56 ?  39  ILE C CD1 1 
ATOM   529  N  N   . LEU C 1 20 ? 35.648 -34.179 -136.701 1.00 19.11 ?  40  LEU C N   1 
ATOM   530  C  CA  . LEU C 1 20 ? 36.490 -34.182 -137.893 1.00 18.33 ?  40  LEU C CA  1 
ATOM   531  C  C   . LEU C 1 20 ? 35.951 -35.140 -138.947 1.00 23.03 ?  40  LEU C C   1 
ATOM   532  O  O   . LEU C 1 20 ? 36.051 -34.871 -140.150 1.00 23.02 ?  40  LEU C O   1 
ATOM   533  C  CB  . LEU C 1 20 ? 37.926 -34.549 -137.520 1.00 22.22 ?  40  LEU C CB  1 
ATOM   534  C  CG  . LEU C 1 20 ? 38.690 -33.516 -136.690 1.00 23.95 ?  40  LEU C CG  1 
ATOM   535  C  CD1 . LEU C 1 20 ? 40.107 -33.991 -136.413 1.00 20.84 ?  40  LEU C CD1 1 
ATOM   536  C  CD2 . LEU C 1 20 ? 38.698 -32.172 -137.405 1.00 24.11 ?  40  LEU C CD2 1 
ATOM   537  N  N   . TRP C 1 21 ? 35.377 -36.265 -138.516 1.00 16.20 ?  41  TRP C N   1 
ATOM   538  C  CA  . TRP C 1 21 ? 34.841 -37.227 -139.472 1.00 18.62 ?  41  TRP C CA  1 
ATOM   539  C  C   . TRP C 1 21 ? 33.585 -36.695 -140.150 1.00 20.03 ?  41  TRP C C   1 
ATOM   540  O  O   . TRP C 1 21 ? 33.423 -36.837 -141.367 1.00 17.70 ?  41  TRP C O   1 
ATOM   541  C  CB  . TRP C 1 21 ? 34.554 -38.559 -138.777 1.00 17.54 ?  41  TRP C CB  1 
ATOM   542  C  CG  . TRP C 1 21 ? 33.895 -39.556 -139.676 1.00 18.80 ?  41  TRP C CG  1 
ATOM   543  C  CD1 . TRP C 1 21 ? 34.492 -40.298 -140.656 1.00 23.19 ?  41  TRP C CD1 1 
ATOM   544  C  CD2 . TRP C 1 21 ? 32.510 -39.922 -139.682 1.00 20.01 ?  41  TRP C CD2 1 
ATOM   545  N  NE1 . TRP C 1 21 ? 33.563 -41.103 -141.271 1.00 23.35 ?  41  TRP C NE1 1 
ATOM   546  C  CE2 . TRP C 1 21 ? 32.339 -40.891 -140.692 1.00 22.31 ?  41  TRP C CE2 1 
ATOM   547  C  CE3 . TRP C 1 21 ? 31.399 -39.525 -138.931 1.00 18.85 ?  41  TRP C CE3 1 
ATOM   548  C  CZ2 . TRP C 1 21 ? 31.101 -41.467 -140.971 1.00 20.92 ?  41  TRP C CZ2 1 
ATOM   549  C  CZ3 . TRP C 1 21 ? 30.172 -40.099 -139.209 1.00 21.54 ?  41  TRP C CZ3 1 
ATOM   550  C  CH2 . TRP C 1 21 ? 30.033 -41.059 -140.221 1.00 25.21 ?  41  TRP C CH2 1 
ATOM   551  N  N   . ILE C 1 22 ? 32.684 -36.081 -139.380 1.00 22.73 ?  42  ILE C N   1 
ATOM   552  C  CA  . ILE C 1 22 ? 31.469 -35.521 -139.967 1.00 24.24 ?  42  ILE C CA  1 
ATOM   553  C  C   . ILE C 1 22 ? 31.822 -34.429 -140.969 1.00 20.58 ?  42  ILE C C   1 
ATOM   554  O  O   . ILE C 1 22 ? 31.322 -34.411 -142.100 1.00 25.22 ?  42  ILE C O   1 
ATOM   555  C  CB  . ILE C 1 22 ? 30.529 -35.000 -138.866 1.00 18.93 ?  42  ILE C CB  1 
ATOM   556  C  CG1 . ILE C 1 22 ? 29.957 -36.167 -138.058 1.00 19.47 ?  42  ILE C CG1 1 
ATOM   557  C  CG2 . ILE C 1 22 ? 29.406 -34.161 -139.475 1.00 24.76 ?  42  ILE C CG2 1 
ATOM   558  C  CD1 . ILE C 1 22 ? 29.186 -35.736 -136.829 1.00 18.40 ?  42  ILE C CD1 1 
ATOM   559  N  N   . LEU C 1 23 ? 32.696 -33.504 -140.571 1.00 18.20 ?  43  LEU C N   1 
ATOM   560  C  CA  . LEU C 1 23 ? 33.075 -32.426 -141.477 1.00 20.50 ?  43  LEU C CA  1 
ATOM   561  C  C   . LEU C 1 23 ? 33.765 -32.969 -142.720 1.00 20.86 ?  43  LEU C C   1 
ATOM   562  O  O   . LEU C 1 23 ? 33.566 -32.452 -143.825 1.00 20.33 ?  43  LEU C O   1 
ATOM   563  C  CB  . LEU C 1 23 ? 33.966 -31.421 -140.750 1.00 14.39 ?  43  LEU C CB  1 
ATOM   564  C  CG  . LEU C 1 23 ? 33.216 -30.657 -139.658 1.00 18.88 ?  43  LEU C CG  1 
ATOM   565  C  CD1 . LEU C 1 23 ? 34.114 -29.647 -138.958 1.00 17.95 ?  43  LEU C CD1 1 
ATOM   566  C  CD2 . LEU C 1 23 ? 31.989 -29.981 -140.257 1.00 24.61 ?  43  LEU C CD2 1 
ATOM   567  N  N   . ASP C 1 24 ? 34.577 -34.017 -142.559 1.00 22.73 ?  44  ASP C N   1 
ATOM   568  C  CA  . ASP C 1 24 ? 35.212 -34.650 -143.710 1.00 25.83 ?  44  ASP C CA  1 
ATOM   569  C  C   . ASP C 1 24 ? 34.167 -35.165 -144.694 1.00 26.66 ?  44  ASP C C   1 
ATOM   570  O  O   . ASP C 1 24 ? 34.267 -34.932 -145.905 1.00 25.54 ?  44  ASP C O   1 
ATOM   571  C  CB  . ASP C 1 24 ? 36.121 -35.787 -143.239 1.00 26.08 ?  44  ASP C CB  1 
ATOM   572  C  CG  . ASP C 1 24 ? 36.944 -36.386 -144.365 1.00 31.27 ?  44  ASP C CG  1 
ATOM   573  O  OD1 . ASP C 1 24 ? 37.042 -35.753 -145.436 1.00 30.07 ?  44  ASP C OD1 1 
ATOM   574  O  OD2 . ASP C 1 24 ? 37.494 -37.492 -144.175 1.00 29.60 -1 44  ASP C OD2 1 
ATOM   575  N  N   . ARG C 1 25 ? 33.147 -35.862 -144.187 1.00 26.66 ?  45  ARG C N   1 
ATOM   576  C  CA  . ARG C 1 25 ? 32.115 -36.402 -145.063 1.00 30.16 ?  45  ARG C CA  1 
ATOM   577  C  C   . ARG C 1 25 ? 31.235 -35.307 -145.652 1.00 33.68 ?  45  ARG C C   1 
ATOM   578  O  O   . ARG C 1 25 ? 30.779 -35.427 -146.792 1.00 38.01 ?  45  ARG C O   1 
ATOM   579  C  CB  . ARG C 1 25 ? 31.264 -37.417 -144.301 1.00 30.20 ?  45  ARG C CB  1 
ATOM   580  C  CG  . ARG C 1 25 ? 31.994 -38.716 -143.960 1.00 30.75 ?  45  ARG C CG  1 
ATOM   581  C  CD  . ARG C 1 25 ? 32.171 -39.593 -145.191 1.00 31.57 ?  45  ARG C CD  1 
ATOM   582  N  NE  . ARG C 1 25 ? 30.886 -40.046 -145.719 1.00 34.99 ?  45  ARG C NE  1 
ATOM   583  C  CZ  . ARG C 1 25 ? 30.319 -39.576 -146.828 1.00 38.69 ?  45  ARG C CZ  1 
ATOM   584  N  NH1 . ARG C 1 25 ? 29.147 -40.051 -147.224 1.00 35.53 1  45  ARG C NH1 1 
ATOM   585  N  NH2 . ARG C 1 25 ? 30.921 -38.631 -147.542 1.00 34.34 ?  45  ARG C NH2 1 
ATOM   586  N  N   . LEU C 1 26 ? 30.984 -34.240 -144.891 1.00 25.05 ?  46  LEU C N   1 
ATOM   587  C  CA  . LEU C 1 26 ? 30.189 -33.112 -145.376 1.00 32.44 ?  46  LEU C CA  1 
ATOM   588  C  C   . LEU C 1 26 ? 31.093 -31.935 -145.728 1.00 36.45 ?  46  LEU C C   1 
ATOM   589  O  O   . LEU C 1 26 ? 31.347 -31.066 -144.892 1.00 37.29 ?  46  LEU C O   1 
ATOM   590  C  CB  . LEU C 1 26 ? 29.158 -32.678 -144.331 1.00 30.52 ?  46  LEU C CB  1 
ATOM   591  C  CG  . LEU C 1 26 ? 28.182 -33.730 -143.798 1.00 37.43 ?  46  LEU C CG  1 
ATOM   592  C  CD1 . LEU C 1 26 ? 27.003 -33.061 -143.113 1.00 32.47 ?  46  LEU C CD1 1 
ATOM   593  C  CD2 . LEU C 1 26 ? 27.711 -34.642 -144.918 1.00 33.89 ?  46  LEU C CD2 1 
HETATM 594  N  N   . NH2 C 1 27 ? 31.578 -31.914 -146.965 1.00 40.34 ?  47  NH2 C N   1 
HETATM 595  C  C   . ACE D 1 1  ? 46.915 -41.813 -107.842 1.00 47.98 ?  21  ACE D C   1 
HETATM 596  O  O   . ACE D 1 1  ? 47.971 -42.350 -107.511 1.00 66.02 ?  21  ACE D O   1 
HETATM 597  C  CH3 . ACE D 1 1  ? 46.537 -40.437 -107.382 1.00 58.62 ?  21  ACE D CH3 1 
ATOM   598  N  N   . SER D 1 2  ? 46.030 -42.408 -108.633 1.00 52.07 ?  22  SER D N   1 
ATOM   599  C  CA  . SER D 1 2  ? 46.221 -43.748 -109.182 1.00 48.70 ?  22  SER D CA  1 
ATOM   600  C  C   . SER D 1 2  ? 45.208 -43.987 -110.292 1.00 35.86 ?  22  SER D C   1 
ATOM   601  O  O   . SER D 1 2  ? 44.042 -44.274 -110.024 1.00 42.55 ?  22  SER D O   1 
ATOM   602  C  CB  . SER D 1 2  ? 46.077 -44.813 -108.097 1.00 48.47 ?  22  SER D CB  1 
ATOM   603  O  OG  . SER D 1 2  ? 45.787 -46.080 -108.663 1.00 49.34 ?  22  SER D OG  1 
ATOM   604  N  N   . SER D 1 3  ? 45.663 -43.879 -111.537 1.00 34.51 ?  23  SER D N   1 
ATOM   605  C  CA  . SER D 1 3  ? 44.748 -43.849 -112.667 1.00 28.79 ?  23  SER D CA  1 
ATOM   606  C  C   . SER D 1 3  ? 44.046 -45.189 -112.847 1.00 28.69 ?  23  SER D C   1 
ATOM   607  O  O   . SER D 1 3  ? 44.528 -46.236 -112.410 1.00 27.88 ?  23  SER D O   1 
ATOM   608  C  CB  . SER D 1 3  ? 45.504 -43.472 -113.939 1.00 31.89 ?  23  SER D CB  1 
ATOM   609  O  OG  . SER D 1 3  ? 46.218 -42.264 -113.756 1.00 36.92 ?  23  SER D OG  1 
ATOM   610  N  N   . ASP D 1 4  ? 42.885 -45.136 -113.491 1.00 28.40 ?  24  ASP D N   1 
ATOM   611  C  CA  . ASP D 1 4  ? 42.140 -46.341 -113.827 1.00 27.46 ?  24  ASP D CA  1 
ATOM   612  C  C   . ASP D 1 4  ? 42.670 -46.916 -115.134 1.00 22.08 ?  24  ASP D C   1 
ATOM   613  O  O   . ASP D 1 4  ? 42.663 -46.216 -116.152 1.00 26.14 ?  24  ASP D O   1 
ATOM   614  C  CB  . ASP D 1 4  ? 40.652 -46.030 -113.952 1.00 20.97 ?  24  ASP D CB  1 
ATOM   615  C  CG  . ASP D 1 4  ? 39.815 -47.266 -114.231 1.00 27.14 ?  24  ASP D CG  1 
ATOM   616  O  OD1 . ASP D 1 4  ? 38.571 -47.179 -114.128 1.00 28.53 ?  24  ASP D OD1 1 
ATOM   617  O  OD2 . ASP D 1 4  ? 40.398 -48.325 -114.542 1.00 27.61 -1 24  ASP D OD2 1 
ATOM   618  N  N   . PRO D 1 5  ? 43.144 -48.165 -115.153 1.00 21.27 ?  25  PRO D N   1 
ATOM   619  C  CA  . PRO D 1 5  ? 43.659 -48.728 -116.413 1.00 23.46 ?  25  PRO D CA  1 
ATOM   620  C  C   . PRO D 1 5  ? 42.603 -48.822 -117.499 1.00 20.44 ?  25  PRO D C   1 
ATOM   621  O  O   . PRO D 1 5  ? 42.937 -48.736 -118.687 1.00 24.54 ?  25  PRO D O   1 
ATOM   622  C  CB  . PRO D 1 5  ? 44.165 -50.117 -115.997 1.00 25.10 ?  25  PRO D CB  1 
ATOM   623  C  CG  . PRO D 1 5  ? 44.340 -50.039 -114.508 1.00 34.16 ?  25  PRO D CG  1 
ATOM   624  C  CD  . PRO D 1 5  ? 43.282 -49.102 -114.027 1.00 26.80 ?  25  PRO D CD  1 
ATOM   625  N  N   . LEU D 1 6  ? 41.334 -48.996 -117.121 1.00 22.01 ?  26  LEU D N   1 
ATOM   626  C  CA  . LEU D 1 6  ? 40.247 -48.997 -118.094 1.00 22.05 ?  26  LEU D CA  1 
ATOM   627  C  C   . LEU D 1 6  ? 40.181 -47.680 -118.858 1.00 18.62 ?  26  LEU D C   1 
ATOM   628  O  O   . LEU D 1 6  ? 39.873 -47.668 -120.054 1.00 21.05 ?  26  LEU D O   1 
ATOM   629  C  CB  . LEU D 1 6  ? 38.921 -49.280 -117.389 1.00 22.85 ?  26  LEU D CB  1 
ATOM   630  C  CG  . LEU D 1 6  ? 38.435 -50.730 -117.469 1.00 25.96 ?  26  LEU D CG  1 
ATOM   631  C  CD1 . LEU D 1 6  ? 39.595 -51.709 -117.338 1.00 26.40 ?  26  LEU D CD1 1 
ATOM   632  C  CD2 . LEU D 1 6  ? 37.368 -50.996 -116.421 1.00 31.51 ?  26  LEU D CD2 1 
ATOM   633  N  N   . VAL D 1 7  ? 40.290 -46.590 -118.097 1.00 19.22 ?  27  VAL D N   1 
ATOM   634  C  CA  . VAL D 1 7  ? 40.226 -45.262 -118.699 1.00 19.87 ?  27  VAL D CA  1 
ATOM   635  C  C   . VAL D 1 7  ? 41.477 -44.993 -119.527 1.00 22.19 ?  27  VAL D C   1 
ATOM   636  O  O   . VAL D 1 7  ? 41.412 -44.363 -120.590 1.00 19.95 ?  27  VAL D O   1 
ATOM   637  C  CB  . VAL D 1 7  ? 40.020 -44.190 -117.615 1.00 20.05 ?  27  VAL D CB  1 
ATOM   638  C  CG1 . VAL D 1 7  ? 40.000 -42.803 -118.242 1.00 23.08 ?  27  VAL D CG1 1 
ATOM   639  C  CG2 . VAL D 1 7  ? 38.729 -44.450 -116.852 1.00 19.64 ?  27  VAL D CG2 1 
ATOM   640  N  N   . VAL D 1 8  ? 42.636 -45.466 -119.059 1.00 17.57 ?  28  VAL D N   1 
ATOM   641  C  CA  . VAL D 1 8  ? 43.854 -45.346 -119.856 1.00 22.71 ?  28  VAL D CA  1 
ATOM   642  C  C   . VAL D 1 8  ? 43.705 -46.105 -121.167 1.00 21.36 ?  28  VAL D C   1 
ATOM   643  O  O   . VAL D 1 8  ? 44.077 -45.609 -122.237 1.00 21.01 ?  28  VAL D O   1 
ATOM   644  C  CB  . VAL D 1 8  ? 45.073 -45.837 -119.054 1.00 25.69 ?  28  VAL D CB  1 
ATOM   645  C  CG1 . VAL D 1 8  ? 46.324 -45.807 -119.925 1.00 20.80 ?  28  VAL D CG1 1 
ATOM   646  C  CG2 . VAL D 1 8  ? 45.263 -44.990 -117.802 1.00 22.13 ?  28  VAL D CG2 1 
ATOM   647  N  N   . ALA D 1 9  ? 43.151 -47.319 -121.105 1.00 25.30 ?  29  ALA D N   1 
ATOM   648  C  CA  . ALA D 1 9  ? 42.932 -48.095 -122.322 1.00 18.34 ?  29  ALA D CA  1 
ATOM   649  C  C   . ALA D 1 9  ? 42.013 -47.358 -123.286 1.00 25.64 ?  29  ALA D C   1 
ATOM   650  O  O   . ALA D 1 9  ? 42.226 -47.387 -124.504 1.00 23.65 ?  29  ALA D O   1 
ATOM   651  C  CB  . ALA D 1 9  ? 42.355 -49.466 -121.970 1.00 23.45 ?  29  ALA D CB  1 
ATOM   652  N  N   . ALA D 1 10 ? 40.981 -46.693 -122.758 1.00 23.92 ?  30  ALA D N   1 
ATOM   653  C  CA  . ALA D 1 10 ? 40.060 -45.955 -123.616 1.00 22.33 ?  30  ALA D CA  1 
ATOM   654  C  C   . ALA D 1 10 ? 40.773 -44.828 -124.348 1.00 25.25 ?  30  ALA D C   1 
ATOM   655  O  O   . ALA D 1 10 ? 40.534 -44.605 -125.541 1.00 24.69 ?  30  ALA D O   1 
ATOM   656  C  CB  . ALA D 1 10 ? 38.896 -45.408 -122.790 1.00 29.35 ?  30  ALA D CB  1 
ATOM   657  N  N   . ASN D 1 11 ? 41.650 -44.101 -123.651 1.00 17.49 ?  31  ASN D N   1 
ATOM   658  C  CA  . ASN D 1 11 ? 42.391 -43.024 -124.301 1.00 20.57 ?  31  ASN D CA  1 
ATOM   659  C  C   . ASN D 1 11 ? 43.310 -43.567 -125.388 1.00 23.11 ?  31  ASN D C   1 
ATOM   660  O  O   . ASN D 1 11 ? 43.451 -42.956 -126.453 1.00 21.39 ?  31  ASN D O   1 
ATOM   661  C  CB  . ASN D 1 11 ? 43.199 -42.234 -123.268 1.00 26.12 ?  31  ASN D CB  1 
ATOM   662  C  CG  . ASN D 1 11 ? 42.334 -41.323 -122.415 1.00 28.23 ?  31  ASN D CG  1 
ATOM   663  O  OD1 . ASN D 1 11 ? 41.889 -40.269 -122.865 1.00 33.30 ?  31  ASN D OD1 1 
ATOM   664  N  ND2 . ASN D 1 11 ? 42.105 -41.721 -121.172 1.00 23.42 ?  31  ASN D ND2 1 
ATOM   665  N  N   . ILE D 1 12 ? 43.946 -44.714 -125.136 1.00 16.80 ?  32  ILE D N   1 
ATOM   666  C  CA  . ILE D 1 12 ? 44.876 -45.277 -126.110 1.00 19.76 ?  32  ILE D CA  1 
ATOM   667  C  C   . ILE D 1 12 ? 44.138 -45.689 -127.375 1.00 19.93 ?  32  ILE D C   1 
ATOM   668  O  O   . ILE D 1 12 ? 44.597 -45.431 -128.493 1.00 15.78 ?  32  ILE D O   1 
ATOM   669  C  CB  . ILE D 1 12 ? 45.642 -46.462 -125.493 1.00 19.83 ?  32  ILE D CB  1 
ATOM   670  C  CG1 . ILE D 1 12 ? 46.470 -45.995 -124.295 1.00 18.59 ?  32  ILE D CG1 1 
ATOM   671  C  CG2 . ILE D 1 12 ? 46.517 -47.129 -126.545 1.00 19.36 ?  32  ILE D CG2 1 
ATOM   672  C  CD1 . ILE D 1 12 ? 47.195 -47.116 -123.585 1.00 25.05 ?  32  ILE D CD1 1 
ATOM   673  N  N   . ILE D 1 13 ? 42.983 -46.338 -127.218 1.00 21.58 ?  33  ILE D N   1 
ATOM   674  C  CA  . ILE D 1 13 ? 42.199 -46.756 -128.377 1.00 15.08 ?  33  ILE D CA  1 
ATOM   675  C  C   . ILE D 1 13 ? 41.725 -45.539 -129.161 1.00 18.97 ?  33  ILE D C   1 
ATOM   676  O  O   . ILE D 1 13 ? 41.935 -45.438 -130.376 1.00 18.24 ?  33  ILE D O   1 
ATOM   677  C  CB  . ILE D 1 13 ? 41.019 -47.637 -127.931 1.00 22.26 ?  33  ILE D CB  1 
ATOM   678  C  CG1 . ILE D 1 13 ? 41.534 -48.866 -127.182 1.00 23.56 ?  33  ILE D CG1 1 
ATOM   679  C  CG2 . ILE D 1 13 ? 40.167 -48.042 -129.127 1.00 23.34 ?  33  ILE D CG2 1 
ATOM   680  C  CD1 . ILE D 1 13 ? 42.511 -49.693 -127.986 1.00 27.23 ?  33  ILE D CD1 1 
ATOM   681  N  N   . GLY D 1 14 ? 41.088 -44.590 -128.473 1.00 15.77 ?  34  GLY D N   1 
ATOM   682  C  CA  . GLY D 1 14 ? 40.556 -43.424 -129.160 1.00 16.14 ?  34  GLY D CA  1 
ATOM   683  C  C   . GLY D 1 14 ? 41.625 -42.618 -129.873 1.00 18.52 ?  34  GLY D C   1 
ATOM   684  O  O   . GLY D 1 14 ? 41.420 -42.158 -130.998 1.00 18.98 ?  34  GLY D O   1 
ATOM   685  N  N   . ILE D 1 15 ? 42.782 -42.437 -129.231 1.00 18.37 ?  35  ILE D N   1 
ATOM   686  C  CA  . ILE D 1 15 ? 43.849 -41.643 -129.834 1.00 19.82 ?  35  ILE D CA  1 
ATOM   687  C  C   . ILE D 1 15 ? 44.463 -42.377 -131.019 1.00 20.88 ?  35  ILE D C   1 
ATOM   688  O  O   . ILE D 1 15 ? 44.727 -41.778 -132.069 1.00 19.37 ?  35  ILE D O   1 
ATOM   689  C  CB  . ILE D 1 15 ? 44.909 -41.287 -128.777 1.00 21.39 ?  35  ILE D CB  1 
ATOM   690  C  CG1 . ILE D 1 15 ? 44.259 -40.539 -127.613 1.00 24.52 ?  35  ILE D CG1 1 
ATOM   691  C  CG2 . ILE D 1 15 ? 46.020 -40.453 -129.402 1.00 25.42 ?  35  ILE D CG2 1 
ATOM   692  C  CD1 . ILE D 1 15 ? 45.081 -40.545 -126.346 1.00 28.87 ?  35  ILE D CD1 1 
ATOM   693  N  N   . LEU D 1 16 ? 44.717 -43.679 -130.869 1.00 16.37 ?  36  LEU D N   1 
ATOM   694  C  CA  . LEU D 1 16 ? 45.229 -44.459 -131.990 1.00 20.67 ?  36  LEU D CA  1 
ATOM   695  C  C   . LEU D 1 16 ? 44.261 -44.416 -133.165 1.00 19.79 ?  36  LEU D C   1 
ATOM   696  O  O   . LEU D 1 16 ? 44.668 -44.222 -134.317 1.00 17.16 ?  36  LEU D O   1 
ATOM   697  C  CB  . LEU D 1 16 ? 45.485 -45.901 -131.555 1.00 20.34 ?  36  LEU D CB  1 
ATOM   698  C  CG  . LEU D 1 16 ? 45.918 -46.847 -132.678 1.00 29.79 ?  36  LEU D CG  1 
ATOM   699  C  CD1 . LEU D 1 16 ? 47.268 -46.422 -133.241 1.00 22.54 ?  36  LEU D CD1 1 
ATOM   700  C  CD2 . LEU D 1 16 ? 45.952 -48.295 -132.199 1.00 26.44 ?  36  LEU D CD2 1 
ATOM   701  N  N   . HIS D 1 17 ? 42.967 -44.594 -132.889 1.00 19.54 ?  37  HIS D N   1 
ATOM   702  C  CA  . HIS D 1 17 ? 41.970 -44.561 -133.951 1.00 16.60 ?  37  HIS D CA  1 
ATOM   703  C  C   . HIS D 1 17 ? 41.965 -43.207 -134.649 1.00 16.16 ?  37  HIS D C   1 
ATOM   704  O  O   . HIS D 1 17 ? 41.960 -43.130 -135.883 1.00 16.80 ?  37  HIS D O   1 
ATOM   705  C  CB  . HIS D 1 17 ? 40.589 -44.882 -133.378 1.00 14.30 ?  37  HIS D CB  1 
ATOM   706  C  CG  . HIS D 1 17 ? 39.536 -45.096 -134.419 1.00 18.54 ?  37  HIS D CG  1 
ATOM   707  N  ND1 . HIS D 1 17 ? 38.244 -45.458 -134.106 1.00 17.16 ?  37  HIS D ND1 1 
ATOM   708  C  CD2 . HIS D 1 17 ? 39.583 -44.997 -135.769 1.00 18.61 ?  37  HIS D CD2 1 
ATOM   709  C  CE1 . HIS D 1 17 ? 37.541 -45.576 -135.218 1.00 19.23 ?  37  HIS D CE1 1 
ATOM   710  N  NE2 . HIS D 1 17 ? 38.329 -45.300 -136.241 1.00 18.06 ?  37  HIS D NE2 1 
ATOM   711  N  N   . LEU D 1 18 ? 41.968 -42.123 -133.870 1.00 16.50 ?  38  LEU D N   1 
ATOM   712  C  CA  . LEU D 1 18 ? 41.988 -40.789 -134.460 1.00 16.99 ?  38  LEU D CA  1 
ATOM   713  C  C   . LEU D 1 18 ? 43.242 -40.583 -135.304 1.00 16.00 ?  38  LEU D C   1 
ATOM   714  O  O   . LEU D 1 18 ? 43.171 -40.096 -136.437 1.00 16.84 ?  38  LEU D O   1 
ATOM   715  C  CB  . LEU D 1 18 ? 41.890 -39.735 -133.358 1.00 15.61 ?  38  LEU D CB  1 
ATOM   716  C  CG  . LEU D 1 18 ? 42.031 -38.262 -133.739 1.00 19.60 ?  38  LEU D CG  1 
ATOM   717  C  CD1 . LEU D 1 18 ? 41.091 -37.902 -134.875 1.00 15.63 ?  38  LEU D CD1 1 
ATOM   718  C  CD2 . LEU D 1 18 ? 41.758 -37.395 -132.525 1.00 25.28 ?  38  LEU D CD2 1 
ATOM   719  N  N   . ILE D 1 19 ? 44.402 -40.962 -134.770 1.00 17.88 ?  39  ILE D N   1 
ATOM   720  C  CA  . ILE D 1 19 ? 45.653 -40.759 -135.494 1.00 18.75 ?  39  ILE D CA  1 
ATOM   721  C  C   . ILE D 1 19 ? 45.688 -41.611 -136.756 1.00 23.48 ?  39  ILE D C   1 
ATOM   722  O  O   . ILE D 1 19 ? 46.090 -41.141 -137.827 1.00 22.32 ?  39  ILE D O   1 
ATOM   723  C  CB  . ILE D 1 19 ? 46.851 -41.054 -134.576 1.00 21.53 ?  39  ILE D CB  1 
ATOM   724  C  CG1 . ILE D 1 19 ? 46.973 -39.972 -133.498 1.00 24.16 ?  39  ILE D CG1 1 
ATOM   725  C  CG2 . ILE D 1 19 ? 48.132 -41.177 -135.391 1.00 30.37 ?  39  ILE D CG2 1 
ATOM   726  C  CD1 . ILE D 1 19 ? 48.053 -40.247 -132.473 1.00 31.15 ?  39  ILE D CD1 1 
ATOM   727  N  N   . LEU D 1 20 ? 45.277 -42.879 -136.650 1.00 19.24 ?  40  LEU D N   1 
ATOM   728  C  CA  . LEU D 1 20 ? 45.269 -43.746 -137.824 1.00 18.10 ?  40  LEU D CA  1 
ATOM   729  C  C   . LEU D 1 20 ? 44.309 -43.227 -138.884 1.00 16.99 ?  40  LEU D C   1 
ATOM   730  O  O   . LEU D 1 20 ? 44.596 -43.304 -140.084 1.00 18.98 ?  40  LEU D O   1 
ATOM   731  C  CB  . LEU D 1 20 ? 44.904 -45.177 -137.426 1.00 18.83 ?  40  LEU D CB  1 
ATOM   732  C  CG  . LEU D 1 20 ? 45.977 -45.970 -136.675 1.00 22.84 ?  40  LEU D CG  1 
ATOM   733  C  CD1 . LEU D 1 20 ? 45.522 -47.393 -136.422 1.00 18.42 ?  40  LEU D CD1 1 
ATOM   734  C  CD2 . LEU D 1 20 ? 47.281 -45.956 -137.454 1.00 25.64 ?  40  LEU D CD2 1 
ATOM   735  N  N   . TRP D 1 21 ? 43.164 -42.689 -138.463 1.00 14.62 ?  41  TRP D N   1 
ATOM   736  C  CA  . TRP D 1 21 ? 42.199 -42.190 -139.435 1.00 16.31 ?  41  TRP D CA  1 
ATOM   737  C  C   . TRP D 1 21 ? 42.710 -40.932 -140.126 1.00 18.22 ?  41  TRP D C   1 
ATOM   738  O  O   . TRP D 1 21 ? 42.593 -40.799 -141.350 1.00 17.47 ?  41  TRP D O   1 
ATOM   739  C  CB  . TRP D 1 21 ? 40.855 -41.923 -138.759 1.00 17.35 ?  41  TRP D CB  1 
ATOM   740  C  CG  . TRP D 1 21 ? 39.877 -41.259 -139.674 1.00 19.32 ?  41  TRP D CG  1 
ATOM   741  C  CD1 . TRP D 1 21 ? 39.206 -41.836 -140.716 1.00 18.50 ?  41  TRP D CD1 1 
ATOM   742  C  CD2 . TRP D 1 21 ? 39.469 -39.885 -139.645 1.00 21.91 ?  41  TRP D CD2 1 
ATOM   743  N  NE1 . TRP D 1 21 ? 38.402 -40.906 -141.331 1.00 24.67 ?  41  TRP D NE1 1 
ATOM   744  C  CE2 . TRP D 1 21 ? 38.545 -39.702 -140.694 1.00 22.18 ?  41  TRP D CE2 1 
ATOM   745  C  CE3 . TRP D 1 21 ? 39.792 -38.794 -138.832 1.00 21.62 ?  41  TRP D CE3 1 
ATOM   746  C  CZ2 . TRP D 1 21 ? 37.941 -38.472 -140.951 1.00 22.89 ?  41  TRP D CZ2 1 
ATOM   747  C  CZ3 . TRP D 1 21 ? 39.189 -37.573 -139.088 1.00 22.63 ?  41  TRP D CZ3 1 
ATOM   748  C  CH2 . TRP D 1 21 ? 38.276 -37.422 -140.141 1.00 23.01 ?  41  TRP D CH2 1 
ATOM   749  N  N   . ILE D 1 22 ? 43.274 -39.999 -139.361 1.00 19.15 ?  42  ILE D N   1 
ATOM   750  C  CA  . ILE D 1 22 ? 43.835 -38.791 -139.958 1.00 21.17 ?  42  ILE D CA  1 
ATOM   751  C  C   . ILE D 1 22 ? 44.896 -39.157 -140.985 1.00 22.60 ?  42  ILE D C   1 
ATOM   752  O  O   . ILE D 1 22 ? 44.875 -38.681 -142.127 1.00 23.27 ?  42  ILE D O   1 
ATOM   753  C  CB  . ILE D 1 22 ? 44.408 -37.870 -138.867 1.00 20.43 ?  42  ILE D CB  1 
ATOM   754  C  CG1 . ILE D 1 22 ? 43.299 -37.390 -137.928 1.00 21.84 ?  42  ILE D CG1 1 
ATOM   755  C  CG2 . ILE D 1 22 ? 45.134 -36.689 -139.499 1.00 22.82 ?  42  ILE D CG2 1 
ATOM   756  C  CD1 . ILE D 1 22 ? 43.817 -36.723 -136.673 1.00 19.93 ?  42  ILE D CD1 1 
ATOM   757  N  N   . LEU D 1 23 ? 45.842 -40.013 -140.591 1.00 19.26 ?  43  LEU D N   1 
ATOM   758  C  CA  . LEU D 1 23 ? 46.939 -40.360 -141.484 1.00 21.93 ?  43  LEU D CA  1 
ATOM   759  C  C   . LEU D 1 23 ? 46.442 -41.083 -142.725 1.00 19.05 ?  43  LEU D C   1 
ATOM   760  O  O   . LEU D 1 23 ? 47.000 -40.903 -143.814 1.00 23.50 ?  43  LEU D O   1 
ATOM   761  C  CB  . LEU D 1 23 ? 47.971 -41.207 -140.738 1.00 18.79 ?  43  LEU D CB  1 
ATOM   762  C  CG  . LEU D 1 23 ? 48.741 -40.433 -139.664 1.00 22.45 ?  43  LEU D CG  1 
ATOM   763  C  CD1 . LEU D 1 23 ? 49.788 -41.309 -138.991 1.00 24.49 ?  43  LEU D CD1 1 
ATOM   764  C  CD2 . LEU D 1 23 ? 49.376 -39.182 -140.269 1.00 22.78 ?  43  LEU D CD2 1 
ATOM   765  N  N   . ASP D 1 24 ? 45.394 -41.897 -142.587 1.00 23.08 ?  44  ASP D N   1 
ATOM   766  C  CA  . ASP D 1 24 ? 44.826 -42.566 -143.752 1.00 22.47 ?  44  ASP D CA  1 
ATOM   767  C  C   . ASP D 1 24 ? 44.202 -41.563 -144.717 1.00 26.94 ?  44  ASP D C   1 
ATOM   768  O  O   . ASP D 1 24 ? 44.337 -41.702 -145.938 1.00 27.09 ?  44  ASP D O   1 
ATOM   769  C  CB  . ASP D 1 24 ? 43.800 -43.609 -143.305 1.00 25.95 ?  44  ASP D CB  1 
ATOM   770  C  CG  . ASP D 1 24 ? 43.187 -44.361 -144.470 1.00 33.08 ?  44  ASP D CG  1 
ATOM   771  O  OD1 . ASP D 1 24 ? 43.922 -45.093 -145.164 1.00 37.75 ?  44  ASP D OD1 1 
ATOM   772  O  OD2 . ASP D 1 24 ? 41.964 -44.229 -144.681 1.00 30.49 -1 44  ASP D OD2 1 
ATOM   773  N  N   . ARG D 1 25 ? 43.480 -40.576 -144.178 1.00 25.87 ?  45  ARG D N   1 
ATOM   774  C  CA  . ARG D 1 25 ? 42.835 -39.583 -145.026 1.00 27.80 ?  45  ARG D CA  1 
ATOM   775  C  C   . ARG D 1 25 ? 43.866 -38.684 -145.694 1.00 32.49 ?  45  ARG D C   1 
ATOM   776  O  O   . ARG D 1 25 ? 43.710 -38.318 -146.863 1.00 35.80 ?  45  ARG D O   1 
ATOM   777  C  CB  . ARG D 1 25 ? 41.833 -38.768 -144.209 1.00 28.60 ?  45  ARG D CB  1 
ATOM   778  C  CG  . ARG D 1 25 ? 40.465 -39.440 -144.035 1.00 32.18 ?  45  ARG D CG  1 
ATOM   779  C  CD  . ARG D 1 25 ? 39.726 -39.552 -145.352 1.00 30.48 ?  45  ARG D CD  1 
ATOM   780  N  NE  . ARG D 1 25 ? 39.218 -38.262 -145.817 1.00 32.86 ?  45  ARG D NE  1 
ATOM   781  C  CZ  . ARG D 1 25 ? 39.691 -37.608 -146.875 1.00 35.28 ?  45  ARG D CZ  1 
ATOM   782  N  NH1 . ARG D 1 25 ? 40.696 -38.116 -147.578 1.00 31.07 1  45  ARG D NH1 1 
ATOM   783  N  NH2 . ARG D 1 25 ? 39.162 -36.444 -147.232 1.00 27.14 ?  45  ARG D NH2 1 
ATOM   784  N  N   . LEU D 1 26 ? 44.934 -38.331 -144.976 1.00 29.37 ?  46  LEU D N   1 
ATOM   785  C  CA  . LEU D 1 26 ? 46.101 -37.700 -145.592 1.00 34.26 ?  46  LEU D CA  1 
ATOM   786  C  C   . LEU D 1 26 ? 46.899 -38.748 -146.357 1.00 46.22 ?  46  LEU D C   1 
ATOM   787  O  O   . LEU D 1 26 ? 48.054 -39.006 -146.030 1.00 51.24 ?  46  LEU D O   1 
ATOM   788  C  CB  . LEU D 1 26 ? 47.004 -37.034 -144.544 1.00 35.14 ?  46  LEU D CB  1 
ATOM   789  C  CG  . LEU D 1 26 ? 46.404 -36.246 -143.374 1.00 31.51 ?  46  LEU D CG  1 
ATOM   790  C  CD1 . LEU D 1 26 ? 47.497 -35.882 -142.373 1.00 42.24 ?  46  LEU D CD1 1 
ATOM   791  C  CD2 . LEU D 1 26 ? 45.656 -35.001 -143.836 1.00 34.65 ?  46  LEU D CD2 1 
HETATM 792  N  N   . NH2 D 1 27 ? 46.280 -39.353 -147.365 1.00 54.42 ?  47  NH2 D N   1 
HETATM 793  C  C   . ACE E 1 1  ? 58.507 -58.064 -112.837 1.00 22.18 ?  21  ACE E C   1 
HETATM 794  O  O   . ACE E 1 1  ? 59.711 -57.944 -113.054 1.00 22.34 ?  21  ACE E O   1 
HETATM 795  C  CH3 . ACE E 1 1  ? 57.664 -56.951 -112.284 1.00 20.14 ?  21  ACE E CH3 1 
ATOM   796  N  N   . SER E 1 2  ? 57.860 -59.192 -113.089 1.00 18.66 ?  22  SER E N   1 
ATOM   797  C  CA  . SER E 1 2  ? 58.543 -60.359 -113.630 1.00 22.23 ?  22  SER E CA  1 
ATOM   798  C  C   . SER E 1 2  ? 57.568 -61.218 -114.426 1.00 19.27 ?  22  SER E C   1 
ATOM   799  O  O   . SER E 1 2  ? 56.354 -61.024 -114.356 1.00 16.09 ?  22  SER E O   1 
ATOM   800  C  CB  . SER E 1 2  ? 59.187 -61.179 -112.508 1.00 22.24 ?  22  SER E CB  1 
ATOM   801  O  OG  . SER E 1 2  ? 58.247 -61.484 -111.492 1.00 22.24 ?  22  SER E OG  1 
ATOM   802  N  N   . SER E 1 3  ? 58.111 -62.167 -115.183 1.00 20.85 ?  23  SER E N   1 
ATOM   803  C  CA  . SER E 1 3  ? 57.321 -62.965 -116.107 1.00 20.89 ?  23  SER E CA  1 
ATOM   804  C  C   . SER E 1 3  ? 57.771 -64.415 -116.044 1.00 18.96 ?  23  SER E C   1 
ATOM   805  O  O   . SER E 1 3  ? 58.866 -64.732 -115.575 1.00 22.42 ?  23  SER E O   1 
ATOM   806  C  CB  . SER E 1 3  ? 57.452 -62.453 -117.549 1.00 20.54 ?  23  SER E CB  1 
ATOM   807  O  OG  . SER E 1 3  ? 57.132 -61.079 -117.637 1.00 17.77 ?  23  SER E OG  1 
ATOM   808  N  N   . ASP E 1 4  ? 56.904 -65.292 -116.525 1.00 21.63 ?  24  ASP E N   1 
ATOM   809  C  CA  . ASP E 1 4  ? 57.281 -66.676 -116.747 1.00 24.07 ?  24  ASP E CA  1 
ATOM   810  C  C   . ASP E 1 4  ? 58.541 -66.722 -117.612 1.00 20.03 ?  24  ASP E C   1 
ATOM   811  O  O   . ASP E 1 4  ? 58.655 -65.954 -118.576 1.00 21.54 ?  24  ASP E O   1 
ATOM   812  C  CB  . ASP E 1 4  ? 56.129 -67.425 -117.426 1.00 23.98 ?  24  ASP E CB  1 
ATOM   813  C  CG  . ASP E 1 4  ? 56.314 -68.928 -117.413 1.00 29.22 ?  24  ASP E CG  1 
ATOM   814  O  OD1 . ASP E 1 4  ? 55.389 -69.646 -116.978 1.00 34.02 ?  24  ASP E OD1 1 
ATOM   815  O  OD2 . ASP E 1 4  ? 57.391 -69.393 -117.840 1.00 37.05 -1 24  ASP E OD2 1 
ATOM   816  N  N   . PRO E 1 5  ? 59.520 -67.575 -117.300 1.00 24.59 ?  25  PRO E N   1 
ATOM   817  C  CA  . PRO E 1 5  ? 60.726 -67.625 -118.144 1.00 23.40 ?  25  PRO E CA  1 
ATOM   818  C  C   . PRO E 1 5  ? 60.430 -67.976 -119.591 1.00 22.32 ?  25  PRO E C   1 
ATOM   819  O  O   . PRO E 1 5  ? 61.177 -67.563 -120.487 1.00 20.09 ?  25  PRO E O   1 
ATOM   820  C  CB  . PRO E 1 5  ? 61.593 -68.695 -117.462 1.00 33.39 ?  25  PRO E CB  1 
ATOM   821  C  CG  . PRO E 1 5  ? 60.657 -69.481 -116.610 1.00 31.31 ?  25  PRO E CG  1 
ATOM   822  C  CD  . PRO E 1 5  ? 59.591 -68.529 -116.180 1.00 24.58 ?  25  PRO E CD  1 
ATOM   823  N  N   . LEU E 1 6  ? 59.358 -68.728 -119.847 1.00 23.38 ?  26  LEU E N   1 
ATOM   824  C  CA  . LEU E 1 6  ? 58.987 -69.047 -121.220 1.00 20.65 ?  26  LEU E CA  1 
ATOM   825  C  C   . LEU E 1 6  ? 58.503 -67.805 -121.959 1.00 24.43 ?  26  LEU E C   1 
ATOM   826  O  O   . LEU E 1 6  ? 58.806 -67.622 -123.145 1.00 22.84 ?  26  LEU E O   1 
ATOM   827  C  CB  . LEU E 1 6  ? 57.912 -70.132 -121.222 1.00 24.70 ?  26  LEU E CB  1 
ATOM   828  C  CG  . LEU E 1 6  ? 57.492 -70.700 -122.577 1.00 29.31 ?  26  LEU E CG  1 
ATOM   829  C  CD1 . LEU E 1 6  ? 58.677 -71.318 -123.312 1.00 30.61 ?  26  LEU E CD1 1 
ATOM   830  C  CD2 . LEU E 1 6  ? 56.395 -71.726 -122.378 1.00 27.46 ?  26  LEU E CD2 1 
ATOM   831  N  N   . VAL E 1 7  ? 57.748 -66.942 -121.276 1.00 23.02 ?  27  VAL E N   1 
ATOM   832  C  CA  . VAL E 1 7  ? 57.325 -65.681 -121.874 1.00 23.63 ?  27  VAL E CA  1 
ATOM   833  C  C   . VAL E 1 7  ? 58.532 -64.789 -122.134 1.00 17.77 ?  27  VAL E C   1 
ATOM   834  O  O   . VAL E 1 7  ? 58.626 -64.143 -123.184 1.00 18.64 ?  27  VAL E O   1 
ATOM   835  C  CB  . VAL E 1 7  ? 56.287 -64.991 -120.969 1.00 18.48 ?  27  VAL E CB  1 
ATOM   836  C  CG1 . VAL E 1 7  ? 55.936 -63.600 -121.489 1.00 19.28 ?  27  VAL E CG1 1 
ATOM   837  C  CG2 . VAL E 1 7  ? 55.032 -65.845 -120.869 1.00 19.66 ?  27  VAL E CG2 1 
ATOM   838  N  N   . VAL E 1 8  ? 59.472 -64.737 -121.187 1.00 19.91 ?  28  VAL E N   1 
ATOM   839  C  CA  . VAL E 1 8  ? 60.703 -63.978 -121.399 1.00 23.62 ?  28  VAL E CA  1 
ATOM   840  C  C   . VAL E 1 8  ? 61.425 -64.486 -122.641 1.00 22.69 ?  28  VAL E C   1 
ATOM   841  O  O   . VAL E 1 8  ? 61.809 -63.708 -123.522 1.00 26.31 ?  28  VAL E O   1 
ATOM   842  C  CB  . VAL E 1 8  ? 61.606 -64.057 -120.152 1.00 18.73 ?  28  VAL E CB  1 
ATOM   843  C  CG1 . VAL E 1 8  ? 62.938 -63.353 -120.397 1.00 21.36 ?  28  VAL E CG1 1 
ATOM   844  C  CG2 . VAL E 1 8  ? 60.909 -63.448 -118.946 1.00 21.12 ?  28  VAL E CG2 1 
ATOM   845  N  N   . ALA E 1 9  ? 61.616 -65.803 -122.732 1.00 25.46 ?  29  ALA E N   1 
ATOM   846  C  CA  . ALA E 1 9  ? 62.315 -66.372 -123.879 1.00 23.13 ?  29  ALA E CA  1 
ATOM   847  C  C   . ALA E 1 9  ? 61.564 -66.090 -125.174 1.00 23.06 ?  29  ALA E C   1 
ATOM   848  O  O   . ALA E 1 9  ? 62.160 -65.677 -126.175 1.00 23.52 ?  29  ALA E O   1 
ATOM   849  C  CB  . ALA E 1 9  ? 62.501 -67.876 -123.683 1.00 24.35 ?  29  ALA E CB  1 
ATOM   850  N  N   . ALA E 1 10 ? 60.247 -66.307 -125.171 1.00 21.81 ?  30  ALA E N   1 
ATOM   851  C  CA  . ALA E 1 10 ? 59.457 -66.086 -126.378 1.00 21.32 ?  30  ALA E CA  1 
ATOM   852  C  C   . ALA E 1 10 ? 59.568 -64.644 -126.853 1.00 24.00 ?  30  ALA E C   1 
ATOM   853  O  O   . ALA E 1 10 ? 59.676 -64.384 -128.058 1.00 21.87 ?  30  ALA E O   1 
ATOM   854  C  CB  . ALA E 1 10 ? 57.996 -66.452 -126.118 1.00 24.33 ?  30  ALA E CB  1 
ATOM   855  N  N   . ASN E 1 11 ? 59.537 -63.689 -125.920 1.00 21.07 ?  31  ASN E N   1 
ATOM   856  C  CA  . ASN E 1 11 ? 59.620 -62.282 -126.300 1.00 26.00 ?  31  ASN E CA  1 
ATOM   857  C  C   . ASN E 1 11 ? 60.994 -61.939 -126.864 1.00 20.97 ?  31  ASN E C   1 
ATOM   858  O  O   . ASN E 1 11 ? 61.102 -61.152 -127.809 1.00 24.14 ?  31  ASN E O   1 
ATOM   859  C  CB  . ASN E 1 11 ? 59.290 -61.397 -125.099 1.00 24.62 ?  31  ASN E CB  1 
ATOM   860  C  CG  . ASN E 1 11 ? 57.799 -61.281 -124.858 1.00 24.96 ?  31  ASN E CG  1 
ATOM   861  O  OD1 . ASN E 1 11 ? 57.191 -60.255 -125.158 1.00 30.53 ?  31  ASN E OD1 1 
ATOM   862  N  ND2 . ASN E 1 11 ? 57.198 -62.340 -124.327 1.00 24.25 ?  31  ASN E ND2 1 
ATOM   863  N  N   . ILE E 1 12 ? 62.054 -62.519 -126.300 1.00 25.23 ?  32  ILE E N   1 
ATOM   864  C  CA  . ILE E 1 12 ? 63.387 -62.330 -126.867 1.00 26.16 ?  32  ILE E CA  1 
ATOM   865  C  C   . ILE E 1 12 ? 63.441 -62.894 -128.282 1.00 20.36 ?  32  ILE E C   1 
ATOM   866  O  O   . ILE E 1 12 ? 64.043 -62.296 -129.181 1.00 22.77 ?  32  ILE E O   1 
ATOM   867  C  CB  . ILE E 1 12 ? 64.452 -62.973 -125.959 1.00 22.11 ?  32  ILE E CB  1 
ATOM   868  C  CG1 . ILE E 1 12 ? 64.484 -62.272 -124.602 1.00 26.83 ?  32  ILE E CG1 1 
ATOM   869  C  CG2 . ILE E 1 12 ? 65.831 -62.887 -126.601 1.00 25.21 ?  32  ILE E CG2 1 
ATOM   870  C  CD1 . ILE E 1 12 ? 65.233 -63.037 -123.532 1.00 27.97 ?  32  ILE E CD1 1 
ATOM   871  N  N   . ILE E 1 13 ? 62.817 -64.052 -128.501 1.00 22.82 ?  33  ILE E N   1 
ATOM   872  C  CA  . ILE E 1 13 ? 62.800 -64.650 -129.833 1.00 21.81 ?  33  ILE E CA  1 
ATOM   873  C  C   . ILE E 1 13 ? 62.027 -63.762 -130.798 1.00 20.92 ?  33  ILE E C   1 
ATOM   874  O  O   . ILE E 1 13 ? 62.431 -63.573 -131.951 1.00 23.90 ?  33  ILE E O   1 
ATOM   875  C  CB  . ILE E 1 13 ? 62.208 -66.071 -129.770 1.00 18.77 ?  33  ILE E CB  1 
ATOM   876  C  CG1 . ILE E 1 13 ? 63.094 -66.978 -128.914 1.00 21.63 ?  33  ILE E CG1 1 
ATOM   877  C  CG2 . ILE E 1 13 ? 62.061 -66.659 -131.168 1.00 20.49 ?  33  ILE E CG2 1 
ATOM   878  C  CD1 . ILE E 1 13 ? 62.445 -68.294 -128.534 1.00 30.93 ?  33  ILE E CD1 1 
ATOM   879  N  N   . GLY E 1 14 ? 60.902 -63.209 -130.342 1.00 23.32 ?  34  GLY E N   1 
ATOM   880  C  CA  . GLY E 1 14 ? 60.140 -62.300 -131.184 1.00 22.85 ?  34  GLY E CA  1 
ATOM   881  C  C   . GLY E 1 14 ? 60.948 -61.088 -131.600 1.00 22.47 ?  34  GLY E C   1 
ATOM   882  O  O   . GLY E 1 14 ? 60.944 -60.692 -132.768 1.00 20.40 ?  34  GLY E O   1 
ATOM   883  N  N   . ILE E 1 15 ? 61.656 -60.479 -130.645 1.00 22.94 ?  35  ILE E N   1 
ATOM   884  C  CA  . ILE E 1 15 ? 62.497 -59.331 -130.972 1.00 26.89 ?  35  ILE E CA  1 
ATOM   885  C  C   . ILE E 1 15 ? 63.570 -59.733 -131.975 1.00 19.50 ?  35  ILE E C   1 
ATOM   886  O  O   . ILE E 1 15 ? 63.852 -59.001 -132.931 1.00 23.61 ?  35  ILE E O   1 
ATOM   887  C  CB  . ILE E 1 15 ? 63.115 -58.729 -129.695 1.00 22.09 ?  35  ILE E CB  1 
ATOM   888  C  CG1 . ILE E 1 15 ? 62.021 -58.208 -128.766 1.00 30.07 ?  35  ILE E CG1 1 
ATOM   889  C  CG2 . ILE E 1 15 ? 64.071 -57.588 -130.049 1.00 31.22 ?  35  ILE E CG2 1 
ATOM   890  C  CD1 . ILE E 1 15 ? 62.528 -57.776 -127.402 1.00 33.78 ?  35  ILE E CD1 1 
ATOM   891  N  N   . LEU E 1 16 ? 64.189 -60.899 -131.774 1.00 19.99 ?  36  LEU E N   1 
ATOM   892  C  CA  . LEU E 1 16 ? 65.188 -61.372 -132.726 1.00 19.64 ?  36  LEU E CA  1 
ATOM   893  C  C   . LEU E 1 16 ? 64.584 -61.530 -134.114 1.00 23.49 ?  36  LEU E C   1 
ATOM   894  O  O   . LEU E 1 16 ? 65.200 -61.146 -135.116 1.00 23.67 ?  36  LEU E O   1 
ATOM   895  C  CB  . LEU E 1 16 ? 65.787 -62.695 -132.247 1.00 25.92 ?  36  LEU E CB  1 
ATOM   896  C  CG  . LEU E 1 16 ? 66.782 -63.370 -133.197 1.00 29.64 ?  36  LEU E CG  1 
ATOM   897  C  CD1 . LEU E 1 16 ? 67.954 -62.449 -133.504 1.00 21.89 ?  36  LEU E CD1 1 
ATOM   898  C  CD2 . LEU E 1 16 ? 67.274 -64.687 -132.613 1.00 31.68 ?  36  LEU E CD2 1 
ATOM   899  N  N   . HIS E 1 17 ? 63.373 -62.087 -134.192 1.00 23.62 ?  37  HIS E N   1 
ATOM   900  C  CA  . HIS E 1 17 ? 62.709 -62.251 -135.480 1.00 23.89 ?  37  HIS E CA  1 
ATOM   901  C  C   . HIS E 1 17 ? 62.517 -60.905 -136.167 1.00 22.18 ?  37  HIS E C   1 
ATOM   902  O  O   . HIS E 1 17 ? 62.787 -60.760 -137.366 1.00 21.75 ?  37  HIS E O   1 
ATOM   903  C  CB  . HIS E 1 17 ? 61.365 -62.955 -135.283 1.00 30.39 ?  37  HIS E CB  1 
ATOM   904  C  CG  . HIS E 1 17 ? 60.654 -63.275 -136.561 1.00 31.48 ?  37  HIS E CG  1 
ATOM   905  N  ND1 . HIS E 1 17 ? 59.304 -63.547 -136.612 1.00 39.90 ?  37  HIS E ND1 1 
ATOM   906  C  CD2 . HIS E 1 17 ? 61.106 -63.369 -137.834 1.00 38.22 ?  37  HIS E CD2 1 
ATOM   907  C  CE1 . HIS E 1 17 ? 58.954 -63.793 -137.862 1.00 44.75 ?  37  HIS E CE1 1 
ATOM   908  N  NE2 . HIS E 1 17 ? 60.029 -63.691 -138.623 1.00 42.80 ?  37  HIS E NE2 1 
ATOM   909  N  N   . LEU E 1 18 ? 62.053 -59.902 -135.419 1.00 20.16 ?  38  LEU E N   1 
ATOM   910  C  CA  . LEU E 1 18 ? 61.896 -58.569 -135.991 1.00 24.56 ?  38  LEU E CA  1 
ATOM   911  C  C   . LEU E 1 18 ? 63.236 -58.013 -136.465 1.00 26.43 ?  38  LEU E C   1 
ATOM   912  O  O   . LEU E 1 18 ? 63.322 -57.419 -137.545 1.00 24.75 ?  38  LEU E O   1 
ATOM   913  C  CB  . LEU E 1 18 ? 61.252 -57.634 -134.967 1.00 27.88 ?  38  LEU E CB  1 
ATOM   914  C  CG  . LEU E 1 18 ? 61.088 -56.167 -135.376 1.00 28.37 ?  38  LEU E CG  1 
ATOM   915  C  CD1 . LEU E 1 18 ? 60.417 -56.036 -136.734 1.00 27.80 ?  38  LEU E CD1 1 
ATOM   916  C  CD2 . LEU E 1 18 ? 60.291 -55.416 -134.320 1.00 26.06 ?  38  LEU E CD2 1 
ATOM   917  N  N   . ILE E 1 19 ? 64.297 -58.208 -135.678 1.00 24.22 ?  39  ILE E N   1 
ATOM   918  C  CA  . ILE E 1 19 ? 65.618 -57.725 -136.082 1.00 28.86 ?  39  ILE E CA  1 
ATOM   919  C  C   . ILE E 1 19 ? 66.049 -58.393 -137.382 1.00 27.04 ?  39  ILE E C   1 
ATOM   920  O  O   . ILE E 1 19 ? 66.433 -57.724 -138.349 1.00 28.79 ?  39  ILE E O   1 
ATOM   921  C  CB  . ILE E 1 19 ? 66.643 -57.959 -134.957 1.00 26.80 ?  39  ILE E CB  1 
ATOM   922  C  CG1 . ILE E 1 19 ? 66.300 -57.092 -133.744 1.00 27.87 ?  39  ILE E CG1 1 
ATOM   923  C  CG2 . ILE E 1 19 ? 68.057 -57.638 -135.435 1.00 27.20 ?  39  ILE E CG2 1 
ATOM   924  C  CD1 . ILE E 1 19 ? 67.076 -57.449 -132.490 1.00 31.26 ?  39  ILE E CD1 1 
ATOM   925  N  N   . LEU E 1 20 ? 65.994 -59.726 -137.424 1.00 25.18 ?  40  LEU E N   1 
ATOM   926  C  CA  . LEU E 1 20 ? 66.400 -60.440 -138.629 1.00 28.99 ?  40  LEU E CA  1 
ATOM   927  C  C   . LEU E 1 20 ? 65.558 -60.017 -139.824 1.00 27.22 ?  40  LEU E C   1 
ATOM   928  O  O   . LEU E 1 20 ? 66.063 -59.932 -140.949 1.00 26.59 ?  40  LEU E O   1 
ATOM   929  C  CB  . LEU E 1 20 ? 66.296 -61.949 -138.404 1.00 25.93 ?  40  LEU E CB  1 
ATOM   930  C  CG  . LEU E 1 20 ? 67.248 -62.525 -137.354 1.00 26.63 ?  40  LEU E CG  1 
ATOM   931  C  CD1 . LEU E 1 20 ? 66.898 -63.969 -137.050 1.00 27.73 ?  40  LEU E CD1 1 
ATOM   932  C  CD2 . LEU E 1 20 ? 68.698 -62.417 -137.812 1.00 29.00 ?  40  LEU E CD2 1 
ATOM   933  N  N   . TRP E 1 21 ? 64.273 -59.738 -139.598 1.00 23.79 ?  41  TRP E N   1 
ATOM   934  C  CA  . TRP E 1 21 ? 63.402 -59.290 -140.678 1.00 29.08 ?  41  TRP E CA  1 
ATOM   935  C  C   . TRP E 1 21 ? 63.830 -57.920 -141.192 1.00 29.01 ?  41  TRP E C   1 
ATOM   936  O  O   . TRP E 1 21 ? 63.800 -57.668 -142.402 1.00 28.71 ?  41  TRP E O   1 
ATOM   937  C  CB  . TRP E 1 21 ? 61.952 -59.260 -140.200 1.00 35.87 ?  41  TRP E CB  1 
ATOM   938  C  CG  . TRP E 1 21 ? 60.991 -58.815 -141.259 1.00 38.80 ?  41  TRP E CG  1 
ATOM   939  C  CD1 . TRP E 1 21 ? 60.371 -59.602 -142.184 1.00 42.70 ?  41  TRP E CD1 1 
ATOM   940  C  CD2 . TRP E 1 21 ? 60.543 -57.476 -141.508 1.00 41.60 ?  41  TRP E CD2 1 
ATOM   941  N  NE1 . TRP E 1 21 ? 59.564 -58.839 -142.991 1.00 48.02 ?  41  TRP E NE1 1 
ATOM   942  C  CE2 . TRP E 1 21 ? 59.652 -57.530 -142.597 1.00 46.25 ?  41  TRP E CE2 1 
ATOM   943  C  CE3 . TRP E 1 21 ? 60.809 -56.239 -140.913 1.00 44.71 ?  41  TRP E CE3 1 
ATOM   944  C  CZ2 . TRP E 1 21 ? 59.025 -56.394 -143.104 1.00 50.54 ?  41  TRP E CZ2 1 
ATOM   945  C  CZ3 . TRP E 1 21 ? 60.184 -55.111 -141.420 1.00 45.40 ?  41  TRP E CZ3 1 
ATOM   946  C  CH2 . TRP E 1 21 ? 59.303 -55.197 -142.504 1.00 46.78 ?  41  TRP E CH2 1 
ATOM   947  N  N   . ILE E 1 22 ? 64.219 -57.025 -140.284 1.00 27.38 ?  42  ILE E N   1 
ATOM   948  C  CA  . ILE E 1 22 ? 64.676 -55.701 -140.695 1.00 26.73 ?  42  ILE E CA  1 
ATOM   949  C  C   . ILE E 1 22 ? 65.974 -55.809 -141.485 1.00 24.36 ?  42  ILE E C   1 
ATOM   950  O  O   . ILE E 1 22 ? 66.096 -55.262 -142.587 1.00 26.11 ?  42  ILE E O   1 
ATOM   951  C  CB  . ILE E 1 22 ? 64.829 -54.784 -139.467 1.00 26.38 ?  42  ILE E CB  1 
ATOM   952  C  CG1 . ILE E 1 22 ? 63.456 -54.510 -138.850 1.00 24.32 ?  42  ILE E CG1 1 
ATOM   953  C  CG2 . ILE E 1 22 ? 65.503 -53.465 -139.852 1.00 21.95 ?  42  ILE E CG2 1 
ATOM   954  C  CD1 . ILE E 1 22 ? 63.494 -53.796 -137.515 1.00 22.30 ?  42  ILE E CD1 1 
ATOM   955  N  N   . LEU E 1 23 ? 66.961 -56.523 -140.937 1.00 28.44 ?  43  LEU E N   1 
ATOM   956  C  CA  . LEU E 1 23 ? 68.234 -56.730 -141.621 1.00 28.18 ?  43  LEU E CA  1 
ATOM   957  C  C   . LEU E 1 23 ? 68.033 -57.301 -143.018 1.00 32.92 ?  43  LEU E C   1 
ATOM   958  O  O   . LEU E 1 23 ? 68.803 -56.987 -143.933 1.00 35.68 ?  43  LEU E O   1 
ATOM   959  C  CB  . LEU E 1 23 ? 69.128 -57.660 -140.798 1.00 26.23 ?  43  LEU E CB  1 
ATOM   960  C  CG  . LEU E 1 23 ? 69.844 -57.021 -139.606 1.00 30.95 ?  43  LEU E CG  1 
ATOM   961  C  CD1 . LEU E 1 23 ? 70.350 -58.087 -138.644 1.00 36.32 ?  43  LEU E CD1 1 
ATOM   962  C  CD2 . LEU E 1 23 ? 70.997 -56.147 -140.079 1.00 28.87 ?  43  LEU E CD2 1 
ATOM   963  N  N   . ASP E 1 24 ? 67.045 -58.184 -143.168 1.00 29.78 ?  44  ASP E N   1 
ATOM   964  C  CA  . ASP E 1 24 ? 66.800 -58.801 -144.467 1.00 35.42 ?  44  ASP E CA  1 
ATOM   965  C  C   . ASP E 1 24 ? 66.282 -57.777 -145.469 1.00 34.50 ?  44  ASP E C   1 
ATOM   966  O  O   . ASP E 1 24 ? 66.654 -57.809 -146.647 1.00 29.62 ?  44  ASP E O   1 
ATOM   967  C  CB  . ASP E 1 24 ? 65.817 -59.963 -144.315 1.00 35.39 ?  44  ASP E CB  1 
ATOM   968  C  CG  . ASP E 1 24 ? 65.645 -60.756 -145.597 1.00 38.39 ?  44  ASP E CG  1 
ATOM   969  O  OD1 . ASP E 1 24 ? 65.145 -60.187 -146.587 1.00 38.13 ?  44  ASP E OD1 1 
ATOM   970  O  OD2 . ASP E 1 24 ? 66.023 -61.946 -145.616 1.00 38.09 -1 44  ASP E OD2 1 
ATOM   971  N  N   . ARG E 1 25 ? 65.394 -56.879 -145.045 1.00 28.77 ?  45  ARG E N   1 
ATOM   972  C  CA  . ARG E 1 25 ? 64.946 -55.870 -145.997 1.00 33.36 ?  45  ARG E CA  1 
ATOM   973  C  C   . ARG E 1 25 ? 65.952 -54.718 -146.117 1.00 35.12 ?  45  ARG E C   1 
ATOM   974  O  O   . ARG E 1 25 ? 65.959 -54.036 -147.147 1.00 37.52 ?  45  ARG E O   1 
ATOM   975  C  CB  . ARG E 1 25 ? 63.548 -55.367 -145.616 1.00 39.65 ?  45  ARG E CB  1 
ATOM   976  C  CG  . ARG E 1 25 ? 62.469 -56.457 -145.747 1.00 47.49 ?  45  ARG E CG  1 
ATOM   977  C  CD  . ARG E 1 25 ? 61.085 -55.916 -146.118 1.00 51.52 ?  45  ARG E CD  1 
ATOM   978  N  NE  . ARG E 1 25 ? 61.053 -55.214 -147.402 1.00 51.24 ?  45  ARG E NE  1 
ATOM   979  C  CZ  . ARG E 1 25 ? 60.288 -55.568 -148.439 1.00 54.87 ?  45  ARG E CZ  1 
ATOM   980  N  NH1 . ARG E 1 25 ? 59.494 -56.628 -148.361 1.00 50.49 1  45  ARG E NH1 1 
ATOM   981  N  NH2 . ARG E 1 25 ? 60.330 -54.870 -149.566 1.00 46.11 ?  45  ARG E NH2 1 
ATOM   982  N  N   . LEU E 1 26 ? 66.843 -54.548 -145.150 1.00 34.37 ?  46  LEU E N   1 
ATOM   983  C  CA  . LEU E 1 26 ? 67.976 -53.631 -145.312 1.00 36.62 ?  46  LEU E CA  1 
ATOM   984  C  C   . LEU E 1 26 ? 68.953 -54.180 -146.351 1.00 35.29 ?  46  LEU E C   1 
ATOM   985  O  O   . LEU E 1 26 ? 69.259 -55.372 -146.356 1.00 31.07 ?  46  LEU E O   1 
ATOM   986  C  CB  . LEU E 1 26 ? 68.706 -53.406 -143.983 1.00 31.22 ?  46  LEU E CB  1 
ATOM   987  C  CG  . LEU E 1 26 ? 67.974 -52.655 -142.872 1.00 29.75 ?  46  LEU E CG  1 
ATOM   988  C  CD1 . LEU E 1 26 ? 68.812 -52.653 -141.593 1.00 27.96 ?  46  LEU E CD1 1 
ATOM   989  C  CD2 . LEU E 1 26 ? 67.641 -51.243 -143.305 1.00 30.74 ?  46  LEU E CD2 1 
HETATM 990  N  N   . NH2 E 1 27 ? 69.437 -53.307 -147.228 1.00 34.93 ?  47  NH2 E N   1 
HETATM 991  C  C   . ACE F 1 1  ? 57.543 -65.896 -112.838 1.00 28.61 ?  21  ACE F C   1 
HETATM 992  O  O   . ACE F 1 1  ? 57.627 -67.109 -113.024 1.00 31.25 ?  21  ACE F O   1 
HETATM 993  C  CH3 . ACE F 1 1  ? 58.689 -65.071 -112.332 1.00 21.56 ?  21  ACE F CH3 1 
ATOM   994  N  N   . SER F 1 2  ? 56.425 -65.225 -113.080 1.00 22.31 ?  22  SER F N   1 
ATOM   995  C  CA  . SER F 1 2  ? 55.231 -65.898 -113.568 1.00 24.58 ?  22  SER F CA  1 
ATOM   996  C  C   . SER F 1 2  ? 54.375 -64.929 -114.371 1.00 20.80 ?  22  SER F C   1 
ATOM   997  O  O   . SER F 1 2  ? 54.538 -63.714 -114.272 1.00 20.61 ?  22  SER F O   1 
ATOM   998  C  CB  . SER F 1 2  ? 54.430 -66.486 -112.405 1.00 24.26 ?  22  SER F CB  1 
ATOM   999  O  OG  . SER F 1 2  ? 54.138 -65.499 -111.431 1.00 21.17 ?  22  SER F OG  1 
ATOM   1000 N  N   . SER F 1 3  ? 53.462 -65.476 -115.170 1.00 20.49 ?  23  SER F N   1 
ATOM   1001 C  CA  . SER F 1 3  ? 52.674 -64.681 -116.097 1.00 20.41 ?  23  SER F CA  1 
ATOM   1002 C  C   . SER F 1 3  ? 51.227 -65.149 -116.068 1.00 22.11 ?  23  SER F C   1 
ATOM   1003 O  O   . SER F 1 3  ? 50.912 -66.248 -115.603 1.00 23.14 ?  23  SER F O   1 
ATOM   1004 C  CB  . SER F 1 3  ? 53.225 -64.775 -117.529 1.00 17.65 ?  23  SER F CB  1 
ATOM   1005 O  OG  . SER F 1 3  ? 54.588 -64.394 -117.586 1.00 22.74 ?  23  SER F OG  1 
ATOM   1006 N  N   . ASP F 1 4  ? 50.351 -64.290 -116.572 1.00 18.55 ?  24  ASP F N   1 
ATOM   1007 C  CA  . ASP F 1 4  ? 48.958 -64.659 -116.751 1.00 21.90 ?  24  ASP F CA  1 
ATOM   1008 C  C   . ASP F 1 4  ? 48.868 -65.888 -117.655 1.00 18.96 ?  24  ASP F C   1 
ATOM   1009 O  O   . ASP F 1 4  ? 49.558 -65.954 -118.680 1.00 19.27 ?  24  ASP F O   1 
ATOM   1010 C  CB  . ASP F 1 4  ? 48.186 -63.484 -117.356 1.00 21.30 ?  24  ASP F CB  1 
ATOM   1011 C  CG  . ASP F 1 4  ? 46.705 -63.768 -117.522 1.00 27.08 ?  24  ASP F CG  1 
ATOM   1012 O  OD1 . ASP F 1 4  ? 46.346 -64.867 -117.995 1.00 29.13 ?  24  ASP F OD1 1 
ATOM   1013 O  OD2 . ASP F 1 4  ? 45.895 -62.880 -117.183 1.00 31.47 -1 24  ASP F OD2 1 
ATOM   1014 N  N   . PRO F 1 5  ? 48.044 -66.884 -117.309 1.00 24.63 ?  25  PRO F N   1 
ATOM   1015 C  CA  . PRO F 1 5  ? 47.938 -68.071 -118.177 1.00 22.52 ?  25  PRO F CA  1 
ATOM   1016 C  C   . PRO F 1 5  ? 47.583 -67.740 -119.615 1.00 20.35 ?  25  PRO F C   1 
ATOM   1017 O  O   . PRO F 1 5  ? 47.968 -68.484 -120.525 1.00 20.40 ?  25  PRO F O   1 
ATOM   1018 C  CB  . PRO F 1 5  ? 46.840 -68.903 -117.500 1.00 24.87 ?  25  PRO F CB  1 
ATOM   1019 C  CG  . PRO F 1 5  ? 46.853 -68.472 -116.078 1.00 27.96 ?  25  PRO F CG  1 
ATOM   1020 C  CD  . PRO F 1 5  ? 47.217 -67.015 -116.094 1.00 20.65 ?  25  PRO F CD  1 
ATOM   1021 N  N   . LEU F 1 6  ? 46.848 -66.650 -119.848 1.00 20.05 ?  26  LEU F N   1 
ATOM   1022 C  CA  . LEU F 1 6  ? 46.550 -66.280 -121.227 1.00 26.50 ?  26  LEU F CA  1 
ATOM   1023 C  C   . LEU F 1 6  ? 47.800 -65.782 -121.942 1.00 20.26 ?  26  LEU F C   1 
ATOM   1024 O  O   . LEU F 1 6  ? 48.034 -66.121 -123.108 1.00 19.89 ?  26  LEU F O   1 
ATOM   1025 C  CB  . LEU F 1 6  ? 45.454 -65.216 -121.250 1.00 24.87 ?  26  LEU F CB  1 
ATOM   1026 C  CG  . LEU F 1 6  ? 45.305 -64.391 -122.530 1.00 28.73 ?  26  LEU F CG  1 
ATOM   1027 C  CD1 . LEU F 1 6  ? 45.164 -65.293 -123.746 1.00 37.45 ?  26  LEU F CD1 1 
ATOM   1028 C  CD2 . LEU F 1 6  ? 44.113 -63.464 -122.408 1.00 25.28 ?  26  LEU F CD2 1 
ATOM   1029 N  N   . VAL F 1 7  ? 48.656 -65.022 -121.260 1.00 20.72 ?  27  VAL F N   1 
ATOM   1030 C  CA  . VAL F 1 7  ? 49.915 -64.591 -121.860 1.00 23.32 ?  27  VAL F CA  1 
ATOM   1031 C  C   . VAL F 1 7  ? 50.794 -65.800 -122.150 1.00 16.57 ?  27  VAL F C   1 
ATOM   1032 O  O   . VAL F 1 7  ? 51.380 -65.920 -123.233 1.00 16.98 ?  27  VAL F O   1 
ATOM   1033 C  CB  . VAL F 1 7  ? 50.620 -63.577 -120.940 1.00 18.85 ?  27  VAL F CB  1 
ATOM   1034 C  CG1 . VAL F 1 7  ? 51.987 -63.187 -121.497 1.00 22.16 ?  27  VAL F CG1 1 
ATOM   1035 C  CG2 . VAL F 1 7  ? 49.751 -62.342 -120.762 1.00 17.69 ?  27  VAL F CG2 1 
ATOM   1036 N  N   . VAL F 1 8  ? 50.893 -66.717 -121.184 1.00 21.03 ?  28  VAL F N   1 
ATOM   1037 C  CA  . VAL F 1 8  ? 51.620 -67.967 -121.406 1.00 18.56 ?  28  VAL F CA  1 
ATOM   1038 C  C   . VAL F 1 8  ? 51.099 -68.658 -122.660 1.00 20.91 ?  28  VAL F C   1 
ATOM   1039 O  O   . VAL F 1 8  ? 51.868 -69.038 -123.551 1.00 24.00 ?  28  VAL F O   1 
ATOM   1040 C  CB  . VAL F 1 8  ? 51.502 -68.882 -120.172 1.00 25.04 ?  28  VAL F CB  1 
ATOM   1041 C  CG1 . VAL F 1 8  ? 52.232 -70.202 -120.404 1.00 27.06 ?  28  VAL F CG1 1 
ATOM   1042 C  CG2 . VAL F 1 8  ? 52.047 -68.191 -118.928 1.00 17.21 ?  28  VAL F CG2 1 
ATOM   1043 N  N   . ALA F 1 9  ? 49.777 -68.825 -122.748 1.00 18.74 ?  29  ALA F N   1 
ATOM   1044 C  CA  . ALA F 1 9  ? 49.188 -69.505 -123.898 1.00 22.09 ?  29  ALA F CA  1 
ATOM   1045 C  C   . ALA F 1 9  ? 49.506 -68.768 -125.194 1.00 20.56 ?  29  ALA F C   1 
ATOM   1046 O  O   . ALA F 1 9  ? 49.919 -69.381 -126.185 1.00 22.94 ?  29  ALA F O   1 
ATOM   1047 C  CB  . ALA F 1 9  ? 47.676 -69.633 -123.710 1.00 23.23 ?  29  ALA F CB  1 
ATOM   1048 N  N   . ALA F 1 10 ? 49.313 -67.448 -125.208 1.00 23.16 ?  30  ALA F N   1 
ATOM   1049 C  CA  . ALA F 1 10 ? 49.541 -66.684 -126.430 1.00 20.48 ?  30  ALA F CA  1 
ATOM   1050 C  C   . ALA F 1 10 ? 50.996 -66.778 -126.874 1.00 21.66 ?  30  ALA F C   1 
ATOM   1051 O  O   . ALA F 1 10 ? 51.282 -66.871 -128.073 1.00 22.59 ?  30  ALA F O   1 
ATOM   1052 C  CB  . ALA F 1 10 ? 49.134 -65.225 -126.219 1.00 22.70 ?  30  ALA F CB  1 
ATOM   1053 N  N   . ASN F 1 11 ? 51.929 -66.763 -125.920 1.00 20.78 ?  31  ASN F N   1 
ATOM   1054 C  CA  . ASN F 1 11 ? 53.343 -66.859 -126.267 1.00 23.42 ?  31  ASN F CA  1 
ATOM   1055 C  C   . ASN F 1 11 ? 53.707 -68.243 -126.792 1.00 24.53 ?  31  ASN F C   1 
ATOM   1056 O  O   . ASN F 1 11 ? 54.613 -68.366 -127.624 1.00 28.02 ?  31  ASN F O   1 
ATOM   1057 C  CB  . ASN F 1 11 ? 54.202 -66.503 -125.055 1.00 19.33 ?  31  ASN F CB  1 
ATOM   1058 C  CG  . ASN F 1 11 ? 54.440 -65.013 -124.934 1.00 25.85 ?  31  ASN F CG  1 
ATOM   1059 O  OD1 . ASN F 1 11 ? 55.498 -64.515 -125.310 1.00 27.49 ?  31  ASN F OD1 1 
ATOM   1060 N  ND2 . ASN F 1 11 ? 53.447 -64.289 -124.421 1.00 22.48 ?  31  ASN F ND2 1 
ATOM   1061 N  N   . ILE F 1 12 ? 53.030 -69.291 -126.316 1.00 22.82 ?  32  ILE F N   1 
ATOM   1062 C  CA  . ILE F 1 12 ? 53.231 -70.623 -126.883 1.00 26.20 ?  32  ILE F CA  1 
ATOM   1063 C  C   . ILE F 1 12 ? 52.688 -70.676 -128.307 1.00 19.44 ?  32  ILE F C   1 
ATOM   1064 O  O   . ILE F 1 12 ? 53.336 -71.210 -129.216 1.00 21.89 ?  32  ILE F O   1 
ATOM   1065 C  CB  . ILE F 1 12 ? 52.575 -71.692 -125.987 1.00 19.98 ?  32  ILE F CB  1 
ATOM   1066 C  CG1 . ILE F 1 12 ? 53.237 -71.722 -124.609 1.00 26.79 ?  32  ILE F CG1 1 
ATOM   1067 C  CG2 . ILE F 1 12 ? 52.666 -73.074 -126.634 1.00 28.88 ?  32  ILE F CG2 1 
ATOM   1068 C  CD1 . ILE F 1 12 ? 52.458 -72.511 -123.577 1.00 25.32 ?  32  ILE F CD1 1 
ATOM   1069 N  N   . ILE F 1 13 ? 51.492 -70.124 -128.522 1.00 23.14 ?  33  ILE F N   1 
ATOM   1070 C  CA  . ILE F 1 13 ? 50.914 -70.077 -129.864 1.00 20.33 ?  33  ILE F CA  1 
ATOM   1071 C  C   . ILE F 1 13 ? 51.820 -69.288 -130.801 1.00 22.45 ?  33  ILE F C   1 
ATOM   1072 O  O   . ILE F 1 13 ? 52.031 -69.675 -131.958 1.00 22.55 ?  33  ILE F O   1 
ATOM   1073 C  CB  . ILE F 1 13 ? 49.495 -69.481 -129.804 1.00 23.68 ?  33  ILE F CB  1 
ATOM   1074 C  CG1 . ILE F 1 13 ? 48.581 -70.390 -128.979 1.00 26.23 ?  33  ILE F CG1 1 
ATOM   1075 C  CG2 . ILE F 1 13 ? 48.922 -69.287 -131.206 1.00 19.75 ?  33  ILE F CG2 1 
ATOM   1076 C  CD1 . ILE F 1 13 ? 47.239 -69.778 -128.639 1.00 28.77 ?  33  ILE F CD1 1 
ATOM   1077 N  N   . GLY F 1 14 ? 52.367 -68.170 -130.320 1.00 19.86 ?  34  GLY F N   1 
ATOM   1078 C  CA  . GLY F 1 14 ? 53.326 -67.425 -131.120 1.00 23.97 ?  34  GLY F CA  1 
ATOM   1079 C  C   . GLY F 1 14 ? 54.505 -68.278 -131.551 1.00 22.26 ?  34  GLY F C   1 
ATOM   1080 O  O   . GLY F 1 14 ? 54.846 -68.337 -132.735 1.00 24.92 ?  34  GLY F O   1 
ATOM   1081 N  N   . ILE F 1 15 ? 55.146 -68.950 -130.592 1.00 21.46 ?  35  ILE F N   1 
ATOM   1082 C  CA  . ILE F 1 15 ? 56.278 -69.816 -130.920 1.00 27.27 ?  35  ILE F CA  1 
ATOM   1083 C  C   . ILE F 1 15 ? 55.858 -70.862 -131.944 1.00 18.80 ?  35  ILE F C   1 
ATOM   1084 O  O   . ILE F 1 15 ? 56.571 -71.126 -132.920 1.00 21.01 ?  35  ILE F O   1 
ATOM   1085 C  CB  . ILE F 1 15 ? 56.844 -70.469 -129.645 1.00 22.74 ?  35  ILE F CB  1 
ATOM   1086 C  CG1 . ILE F 1 15 ? 57.479 -69.410 -128.741 1.00 27.42 ?  35  ILE F CG1 1 
ATOM   1087 C  CG2 . ILE F 1 15 ? 57.874 -71.547 -129.997 1.00 23.85 ?  35  ILE F CG2 1 
ATOM   1088 C  CD1 . ILE F 1 15 ? 57.892 -69.934 -127.376 1.00 31.54 ?  35  ILE F CD1 1 
ATOM   1089 N  N   . LEU F 1 16 ? 54.698 -71.485 -131.729 1.00 24.29 ?  36  LEU F N   1 
ATOM   1090 C  CA  . LEU F 1 16 ? 54.202 -72.478 -132.675 1.00 17.16 ?  36  LEU F CA  1 
ATOM   1091 C  C   . LEU F 1 16 ? 54.036 -71.867 -134.060 1.00 20.97 ?  36  LEU F C   1 
ATOM   1092 O  O   . LEU F 1 16 ? 54.459 -72.451 -135.066 1.00 21.40 ?  36  LEU F O   1 
ATOM   1093 C  CB  . LEU F 1 16 ? 52.878 -73.055 -132.173 1.00 24.68 ?  36  LEU F CB  1 
ATOM   1094 C  CG  . LEU F 1 16 ? 52.170 -74.047 -133.100 1.00 26.92 ?  36  LEU F CG  1 
ATOM   1095 C  CD1 . LEU F 1 16 ? 53.080 -75.203 -133.454 1.00 21.30 ?  36  LEU F CD1 1 
ATOM   1096 C  CD2 . LEU F 1 16 ? 50.898 -74.553 -132.447 1.00 29.20 ?  36  LEU F CD2 1 
ATOM   1097 N  N   . HIS F 1 17 ? 53.420 -70.686 -134.129 1.00 20.99 ?  37  HIS F N   1 
ATOM   1098 C  CA  . HIS F 1 17 ? 53.284 -69.984 -135.399 1.00 21.22 ?  37  HIS F CA  1 
ATOM   1099 C  C   . HIS F 1 17 ? 54.638 -69.827 -136.076 1.00 21.91 ?  37  HIS F C   1 
ATOM   1100 O  O   . HIS F 1 17 ? 54.792 -70.120 -137.267 1.00 24.47 ?  37  HIS F O   1 
ATOM   1101 C  CB  . HIS F 1 17 ? 52.633 -68.618 -135.165 1.00 26.25 ?  37  HIS F CB  1 
ATOM   1102 C  CG  . HIS F 1 17 ? 52.430 -67.820 -136.414 1.00 25.02 ?  37  HIS F CG  1 
ATOM   1103 N  ND1 . HIS F 1 17 ? 52.160 -66.469 -136.396 1.00 33.98 ?  37  HIS F ND1 1 
ATOM   1104 C  CD2 . HIS F 1 17 ? 52.455 -68.181 -137.718 1.00 27.08 ?  37  HIS F CD2 1 
ATOM   1105 C  CE1 . HIS F 1 17 ? 52.029 -66.031 -137.635 1.00 26.97 ?  37  HIS F CE1 1 
ATOM   1106 N  NE2 . HIS F 1 17 ? 52.204 -67.051 -138.457 1.00 24.65 ?  37  HIS F NE2 1 
ATOM   1107 N  N   . LEU F 1 18 ? 55.640 -69.374 -135.319 1.00 20.30 ?  38  LEU F N   1 
ATOM   1108 C  CA  . LEU F 1 18 ? 56.979 -69.217 -135.876 1.00 25.70 ?  38  LEU F CA  1 
ATOM   1109 C  C   . LEU F 1 18 ? 57.519 -70.548 -136.386 1.00 22.96 ?  38  LEU F C   1 
ATOM   1110 O  O   . LEU F 1 18 ? 58.036 -70.633 -137.506 1.00 24.05 ?  38  LEU F O   1 
ATOM   1111 C  CB  . LEU F 1 18 ? 57.914 -68.622 -134.822 1.00 25.51 ?  38  LEU F CB  1 
ATOM   1112 C  CG  . LEU F 1 18 ? 59.387 -68.505 -135.225 1.00 21.99 ?  38  LEU F CG  1 
ATOM   1113 C  CD1 . LEU F 1 18 ? 59.548 -67.748 -136.532 1.00 28.22 ?  38  LEU F CD1 1 
ATOM   1114 C  CD2 . LEU F 1 18 ? 60.182 -67.831 -134.121 1.00 28.41 ?  38  LEU F CD2 1 
ATOM   1115 N  N   . ILE F 1 19 ? 57.413 -71.603 -135.575 1.00 18.98 ?  39  ILE F N   1 
ATOM   1116 C  CA  . ILE F 1 19 ? 57.936 -72.906 -135.985 1.00 25.74 ?  39  ILE F CA  1 
ATOM   1117 C  C   . ILE F 1 19 ? 57.288 -73.351 -137.291 1.00 24.50 ?  39  ILE F C   1 
ATOM   1118 O  O   . ILE F 1 19 ? 57.965 -73.852 -138.198 1.00 26.62 ?  39  ILE F O   1 
ATOM   1119 C  CB  . ILE F 1 19 ? 57.732 -73.944 -134.864 1.00 20.87 ?  39  ILE F CB  1 
ATOM   1120 C  CG1 . ILE F 1 19 ? 58.580 -73.583 -133.642 1.00 21.75 ?  39  ILE F CG1 1 
ATOM   1121 C  CG2 . ILE F 1 19 ? 58.100 -75.348 -135.346 1.00 29.51 ?  39  ILE F CG2 1 
ATOM   1122 C  CD1 . ILE F 1 19 ? 58.162 -74.294 -132.372 1.00 26.80 ?  39  ILE F CD1 1 
ATOM   1123 N  N   . LEU F 1 20 ? 55.970 -73.170 -137.412 1.00 25.23 ?  40  LEU F N   1 
ATOM   1124 C  CA  . LEU F 1 20 ? 55.273 -73.597 -138.621 1.00 26.58 ?  40  LEU F CA  1 
ATOM   1125 C  C   . LEU F 1 20 ? 55.677 -72.750 -139.821 1.00 29.76 ?  40  LEU F C   1 
ATOM   1126 O  O   . LEU F 1 20 ? 55.815 -73.269 -140.935 1.00 29.35 ?  40  LEU F O   1 
ATOM   1127 C  CB  . LEU F 1 20 ? 53.762 -73.534 -138.405 1.00 23.57 ?  40  LEU F CB  1 
ATOM   1128 C  CG  . LEU F 1 20 ? 53.198 -74.533 -137.394 1.00 27.43 ?  40  LEU F CG  1 
ATOM   1129 C  CD1 . LEU F 1 20 ? 51.751 -74.200 -137.069 1.00 24.74 ?  40  LEU F CD1 1 
ATOM   1130 C  CD2 . LEU F 1 20 ? 53.313 -75.962 -137.912 1.00 30.96 ?  40  LEU F CD2 1 
ATOM   1131 N  N   . TRP F 1 21 ? 55.867 -71.446 -139.618 1.00 23.56 ?  41  TRP F N   1 
ATOM   1132 C  CA  . TRP F 1 21 ? 56.314 -70.585 -140.708 1.00 32.08 ?  41  TRP F CA  1 
ATOM   1133 C  C   . TRP F 1 21 ? 57.665 -71.045 -141.241 1.00 32.07 ?  41  TRP F C   1 
ATOM   1134 O  O   . TRP F 1 21 ? 57.841 -71.221 -142.453 1.00 35.20 ?  41  TRP F O   1 
ATOM   1135 C  CB  . TRP F 1 21 ? 56.385 -69.133 -140.234 1.00 32.54 ?  41  TRP F CB  1 
ATOM   1136 C  CG  . TRP F 1 21 ? 56.876 -68.193 -141.287 1.00 33.70 ?  41  TRP F CG  1 
ATOM   1137 C  CD1 . TRP F 1 21 ? 56.142 -67.624 -142.284 1.00 41.42 ?  41  TRP F CD1 1 
ATOM   1138 C  CD2 . TRP F 1 21 ? 58.215 -67.711 -141.449 1.00 39.32 ?  41  TRP F CD2 1 
ATOM   1139 N  NE1 . TRP F 1 21 ? 56.939 -66.817 -143.059 1.00 48.05 ?  41  TRP F NE1 1 
ATOM   1140 C  CE2 . TRP F 1 21 ? 58.217 -66.853 -142.567 1.00 44.09 ?  41  TRP F CE2 1 
ATOM   1141 C  CE3 . TRP F 1 21 ? 59.412 -67.921 -140.758 1.00 37.91 ?  41  TRP F CE3 1 
ATOM   1142 C  CZ2 . TRP F 1 21 ? 59.368 -66.206 -143.009 1.00 47.12 ?  41  TRP F CZ2 1 
ATOM   1143 C  CZ3 . TRP F 1 21 ? 60.554 -67.278 -141.199 1.00 35.46 ?  41  TRP F CZ3 1 
ATOM   1144 C  CH2 . TRP F 1 21 ? 60.524 -66.431 -142.314 1.00 40.25 ?  41  TRP F CH2 1 
ATOM   1145 N  N   . ILE F 1 22 ? 58.637 -71.240 -140.348 1.00 29.13 ?  42  ILE F N   1 
ATOM   1146 C  CA  . ILE F 1 22 ? 59.930 -71.781 -140.760 1.00 32.02 ?  42  ILE F CA  1 
ATOM   1147 C  C   . ILE F 1 22 ? 59.737 -73.112 -141.472 1.00 26.95 ?  42  ILE F C   1 
ATOM   1148 O  O   . ILE F 1 22 ? 60.339 -73.369 -142.521 1.00 26.63 ?  42  ILE F O   1 
ATOM   1149 C  CB  . ILE F 1 22 ? 60.865 -71.927 -139.543 1.00 25.23 ?  42  ILE F CB  1 
ATOM   1150 C  CG1 . ILE F 1 22 ? 61.150 -70.563 -138.913 1.00 21.52 ?  42  ILE F CG1 1 
ATOM   1151 C  CG2 . ILE F 1 22 ? 62.178 -72.596 -139.947 1.00 28.07 ?  42  ILE F CG2 1 
ATOM   1152 C  CD1 . ILE F 1 22 ? 61.790 -70.643 -137.542 1.00 24.10 ?  42  ILE F CD1 1 
ATOM   1153 N  N   . LEU F 1 23 ? 58.893 -73.963 -140.898 1.00 28.38 ?  43  LEU F N   1 
ATOM   1154 C  CA  . LEU F 1 23 ? 58.615 -75.273 -141.474 1.00 30.80 ?  43  LEU F CA  1 
ATOM   1155 C  C   . LEU F 1 23 ? 58.012 -75.143 -142.868 1.00 33.40 ?  43  LEU F C   1 
ATOM   1156 O  O   . LEU F 1 23 ? 58.214 -76.004 -143.725 1.00 35.10 ?  43  LEU F O   1 
ATOM   1157 C  CB  . LEU F 1 23 ? 57.675 -76.069 -140.566 1.00 32.32 ?  43  LEU F CB  1 
ATOM   1158 C  CG  . LEU F 1 23 ? 57.783 -77.593 -140.648 1.00 39.94 ?  43  LEU F CG  1 
ATOM   1159 C  CD1 . LEU F 1 23 ? 59.229 -78.038 -140.494 1.00 24.81 ?  43  LEU F CD1 1 
ATOM   1160 C  CD2 . LEU F 1 23 ? 56.901 -78.251 -139.598 1.00 43.45 ?  43  LEU F CD2 1 
ATOM   1161 N  N   . ASP F 1 24 ? 57.272 -74.062 -143.089 1.00 31.30 ?  44  ASP F N   1 
ATOM   1162 C  CA  . ASP F 1 24 ? 56.639 -73.817 -144.379 1.00 35.25 ?  44  ASP F CA  1 
ATOM   1163 C  C   . ASP F 1 24 ? 57.653 -73.321 -145.404 1.00 43.00 ?  44  ASP F C   1 
ATOM   1164 O  O   . ASP F 1 24 ? 57.424 -73.406 -146.610 1.00 41.15 ?  44  ASP F O   1 
ATOM   1165 C  CB  . ASP F 1 24 ? 55.500 -72.806 -144.234 1.00 40.89 ?  44  ASP F CB  1 
ATOM   1166 C  CG  . ASP F 1 24 ? 54.920 -72.386 -145.570 1.00 41.36 ?  44  ASP F CG  1 
ATOM   1167 O  OD1 . ASP F 1 24 ? 53.995 -73.067 -146.059 1.00 51.28 ?  44  ASP F OD1 1 
ATOM   1168 O  OD2 . ASP F 1 24 ? 55.390 -71.373 -146.132 1.00 52.39 -1 44  ASP F OD2 1 
ATOM   1169 N  N   . ARG F 1 25 ? 58.775 -72.802 -144.915 1.00 34.82 ?  45  ARG F N   1 
ATOM   1170 C  CA  . ARG F 1 25 ? 59.825 -72.292 -145.786 1.00 36.48 ?  45  ARG F CA  1 
ATOM   1171 C  C   . ARG F 1 25 ? 60.883 -73.337 -146.101 1.00 40.71 ?  45  ARG F C   1 
ATOM   1172 O  O   . ARG F 1 25 ? 61.486 -73.289 -147.179 1.00 45.10 ?  45  ARG F O   1 
ATOM   1173 C  CB  . ARG F 1 25 ? 60.483 -71.065 -145.150 1.00 34.45 ?  45  ARG F CB  1 
ATOM   1174 C  CG  . ARG F 1 25 ? 59.643 -69.799 -145.235 1.00 40.70 ?  45  ARG F CG  1 
ATOM   1175 C  CD  . ARG F 1 25 ? 60.241 -68.792 -146.213 1.00 45.94 ?  45  ARG F CD  1 
ATOM   1176 N  NE  . ARG F 1 25 ? 59.215 -67.941 -146.812 1.00 57.24 ?  45  ARG F NE  1 
ATOM   1177 C  CZ  . ARG F 1 25 ? 59.448 -66.758 -147.376 1.00 52.24 ?  45  ARG F CZ  1 
ATOM   1178 N  NH1 . ARG F 1 25 ? 60.680 -66.268 -147.424 1.00 46.30 1  45  ARG F NH1 1 
ATOM   1179 N  NH2 . ARG F 1 25 ? 58.445 -66.061 -147.892 1.00 54.63 ?  45  ARG F NH2 1 
ATOM   1180 N  N   . LEU F 1 26 ? 61.118 -74.280 -145.191 1.00 32.73 ?  46  LEU F N   1 
ATOM   1181 C  CA  . LEU F 1 26 ? 62.107 -75.333 -145.404 1.00 32.57 ?  46  LEU F CA  1 
ATOM   1182 C  C   . LEU F 1 26 ? 61.600 -76.368 -146.401 1.00 41.39 ?  46  LEU F C   1 
ATOM   1183 O  O   . LEU F 1 26 ? 60.411 -76.688 -146.422 1.00 36.28 ?  46  LEU F O   1 
ATOM   1184 C  CB  . LEU F 1 26 ? 62.459 -76.020 -144.082 1.00 30.52 ?  46  LEU F CB  1 
ATOM   1185 C  CG  . LEU F 1 26 ? 62.958 -75.145 -142.931 1.00 27.49 ?  46  LEU F CG  1 
ATOM   1186 C  CD1 . LEU F 1 26 ? 62.591 -75.780 -141.601 1.00 28.15 ?  46  LEU F CD1 1 
ATOM   1187 C  CD2 . LEU F 1 26 ? 64.457 -74.937 -143.025 1.00 32.64 ?  46  LEU F CD2 1 
HETATM 1188 N  N   . NH2 F 1 27 ? 62.506 -76.894 -147.220 1.00 35.05 ?  47  NH2 F N   1 
HETATM 1189 C  C   . ACE G 1 1  ? 49.859 -64.845 -112.753 1.00 25.41 ?  21  ACE G C   1 
HETATM 1190 O  O   . ACE G 1 1  ? 48.657 -64.972 -112.972 1.00 26.05 ?  21  ACE G O   1 
HETATM 1191 C  CH3 . ACE G 1 1  ? 50.695 -65.960 -112.194 1.00 18.24 ?  21  ACE G CH3 1 
ATOM   1192 N  N   . SER G 1 2  ? 50.508 -63.714 -113.009 1.00 24.62 ?  22  SER G N   1 
ATOM   1193 C  CA  . SER G 1 2  ? 49.824 -62.547 -113.554 1.00 22.88 ?  22  SER G CA  1 
ATOM   1194 C  C   . SER G 1 2  ? 50.786 -61.712 -114.396 1.00 21.07 ?  22  SER G C   1 
ATOM   1195 O  O   . SER G 1 2  ? 52.001 -61.886 -114.322 1.00 17.76 ?  22  SER G O   1 
ATOM   1196 C  CB  . SER G 1 2  ? 49.220 -61.702 -112.426 1.00 22.83 ?  22  SER G CB  1 
ATOM   1197 O  OG  . SER G 1 2  ? 50.186 -61.396 -111.434 1.00 19.74 ?  22  SER G OG  1 
ATOM   1198 N  N   . SER G 1 3  ? 50.231 -60.809 -115.201 1.00 20.40 ?  23  SER G N   1 
ATOM   1199 C  CA  . SER G 1 3  ? 51.018 -60.023 -116.138 1.00 20.59 ?  23  SER G CA  1 
ATOM   1200 C  C   . SER G 1 3  ? 50.532 -58.583 -116.133 1.00 21.00 ?  23  SER G C   1 
ATOM   1201 O  O   . SER G 1 3  ? 49.398 -58.284 -115.747 1.00 16.47 ?  23  SER G O   1 
ATOM   1202 C  CB  . SER G 1 3  ? 50.929 -60.591 -117.563 1.00 17.11 ?  23  SER G CB  1 
ATOM   1203 O  OG  . SER G 1 3  ? 51.246 -61.968 -117.587 1.00 18.50 ?  23  SER G OG  1 
ATOM   1204 N  N   . ASP G 1 4  ? 51.413 -57.693 -116.573 1.00 21.47 ?  24  ASP G N   1 
ATOM   1205 C  CA  . ASP G 1 4  ? 51.038 -56.304 -116.783 1.00 23.59 ?  24  ASP G CA  1 
ATOM   1206 C  C   . ASP G 1 4  ? 49.808 -56.234 -117.686 1.00 21.90 ?  24  ASP G C   1 
ATOM   1207 O  O   . ASP G 1 4  ? 49.738 -56.959 -118.689 1.00 22.59 ?  24  ASP G O   1 
ATOM   1208 C  CB  . ASP G 1 4  ? 52.213 -55.543 -117.408 1.00 22.31 ?  24  ASP G CB  1 
ATOM   1209 C  CG  . ASP G 1 4  ? 51.959 -54.049 -117.525 1.00 27.53 ?  24  ASP G CG  1 
ATOM   1210 O  OD1 . ASP G 1 4  ? 50.883 -53.655 -118.018 1.00 27.79 ?  24  ASP G OD1 1 
ATOM   1211 O  OD2 . ASP G 1 4  ? 52.847 -53.266 -117.128 1.00 32.56 -1 24  ASP G OD2 1 
ATOM   1212 N  N   . PRO G 1 5  ? 48.813 -55.393 -117.366 1.00 24.44 ?  25  PRO G N   1 
ATOM   1213 C  CA  . PRO G 1 5  ? 47.626 -55.309 -118.237 1.00 24.78 ?  25  PRO G CA  1 
ATOM   1214 C  C   . PRO G 1 5  ? 47.960 -54.971 -119.678 1.00 20.53 ?  25  PRO G C   1 
ATOM   1215 O  O   . PRO G 1 5  ? 47.296 -55.466 -120.597 1.00 24.52 ?  25  PRO G O   1 
ATOM   1216 C  CB  . PRO G 1 5  ? 46.783 -54.204 -117.578 1.00 31.55 ?  25  PRO G CB  1 
ATOM   1217 C  CG  . PRO G 1 5  ? 47.237 -54.154 -116.171 1.00 27.24 ?  25  PRO G CG  1 
ATOM   1218 C  CD  . PRO G 1 5  ? 48.698 -54.500 -116.199 1.00 24.95 ?  25  PRO G CD  1 
ATOM   1219 N  N   . LEU G 1 6  ? 48.967 -54.127 -119.904 1.00 25.71 ?  26  LEU G N   1 
ATOM   1220 C  CA  . LEU G 1 6  ? 49.379 -53.825 -121.270 1.00 21.40 ?  26  LEU G CA  1 
ATOM   1221 C  C   . LEU G 1 6  ? 49.818 -55.090 -121.997 1.00 22.88 ?  26  LEU G C   1 
ATOM   1222 O  O   . LEU G 1 6  ? 49.468 -55.299 -123.165 1.00 18.74 ?  26  LEU G O   1 
ATOM   1223 C  CB  . LEU G 1 6  ? 50.502 -52.790 -121.255 1.00 23.38 ?  26  LEU G CB  1 
ATOM   1224 C  CG  . LEU G 1 6  ? 51.197 -52.503 -122.587 1.00 30.92 ?  26  LEU G CG  1 
ATOM   1225 C  CD1 . LEU G 1 6  ? 51.979 -51.199 -122.530 1.00 28.42 ?  26  LEU G CD1 1 
ATOM   1226 C  CD2 . LEU G 1 6  ? 52.112 -53.659 -122.952 1.00 25.70 ?  26  LEU G CD2 1 
ATOM   1227 N  N   . VAL G 1 7  ? 50.582 -55.949 -121.319 1.00 21.75 ?  27  VAL G N   1 
ATOM   1228 C  CA  . VAL G 1 7  ? 50.990 -57.220 -121.911 1.00 23.85 ?  27  VAL G CA  1 
ATOM   1229 C  C   . VAL G 1 7  ? 49.771 -58.089 -122.192 1.00 16.01 ?  27  VAL G C   1 
ATOM   1230 O  O   . VAL G 1 7  ? 49.668 -58.715 -123.253 1.00 21.09 ?  27  VAL G O   1 
ATOM   1231 C  CB  . VAL G 1 7  ? 51.996 -57.934 -120.989 1.00 18.61 ?  27  VAL G CB  1 
ATOM   1232 C  CG1 . VAL G 1 7  ? 52.314 -59.331 -121.504 1.00 16.22 ?  27  VAL G CG1 1 
ATOM   1233 C  CG2 . VAL G 1 7  ? 53.269 -57.117 -120.874 1.00 21.86 ?  27  VAL G CG2 1 
ATOM   1234 N  N   . VAL G 1 8  ? 48.831 -58.146 -121.246 1.00 22.45 ?  28  VAL G N   1 
ATOM   1235 C  CA  . VAL G 1 8  ? 47.605 -58.915 -121.455 1.00 21.42 ?  28  VAL G CA  1 
ATOM   1236 C  C   . VAL G 1 8  ? 46.878 -58.416 -122.698 1.00 20.08 ?  28  VAL G C   1 
ATOM   1237 O  O   . VAL G 1 8  ? 46.468 -59.202 -123.560 1.00 23.77 ?  28  VAL G O   1 
ATOM   1238 C  CB  . VAL G 1 8  ? 46.703 -58.842 -120.209 1.00 25.29 ?  28  VAL G CB  1 
ATOM   1239 C  CG1 . VAL G 1 8  ? 45.411 -59.625 -120.431 1.00 25.43 ?  28  VAL G CG1 1 
ATOM   1240 C  CG2 . VAL G 1 8  ? 47.432 -59.376 -118.981 1.00 20.92 ?  28  VAL G CG2 1 
ATOM   1241 N  N   . ALA G 1 9  ? 46.710 -57.097 -122.810 1.00 23.30 ?  29  ALA G N   1 
ATOM   1242 C  CA  . ALA G 1 9  ? 46.005 -56.540 -123.959 1.00 23.90 ?  29  ALA G CA  1 
ATOM   1243 C  C   . ALA G 1 9  ? 46.775 -56.782 -125.251 1.00 20.06 ?  29  ALA G C   1 
ATOM   1244 O  O   . ALA G 1 9  ? 46.175 -57.068 -126.293 1.00 21.66 ?  29  ALA G O   1 
ATOM   1245 C  CB  . ALA G 1 9  ? 45.765 -55.045 -123.752 1.00 18.24 ?  29  ALA G CB  1 
ATOM   1246 N  N   . ALA G 1 10 ? 48.104 -56.673 -125.204 1.00 24.67 ?  30  ALA G N   1 
ATOM   1247 C  CA  . ALA G 1 10 ? 48.905 -56.887 -126.406 1.00 22.91 ?  30  ALA G CA  1 
ATOM   1248 C  C   . ALA G 1 10 ? 48.813 -58.332 -126.878 1.00 20.87 ?  30  ALA G C   1 
ATOM   1249 O  O   . ALA G 1 10 ? 48.734 -58.595 -128.083 1.00 19.38 ?  30  ALA G O   1 
ATOM   1250 C  CB  . ALA G 1 10 ? 50.360 -56.505 -126.138 1.00 22.05 ?  30  ALA G CB  1 
ATOM   1251 N  N   . ASN G 1 11 ? 48.825 -59.282 -125.942 1.00 18.87 ?  31  ASN G N   1 
ATOM   1252 C  CA  . ASN G 1 11 ? 48.725 -60.687 -126.317 1.00 23.96 ?  31  ASN G CA  1 
ATOM   1253 C  C   . ASN G 1 11 ? 47.347 -61.010 -126.881 1.00 17.25 ?  31  ASN G C   1 
ATOM   1254 O  O   . ASN G 1 11 ? 47.230 -61.796 -127.826 1.00 25.96 ?  31  ASN G O   1 
ATOM   1255 C  CB  . ASN G 1 11 ? 49.047 -61.569 -125.113 1.00 25.52 ?  31  ASN G CB  1 
ATOM   1256 C  CG  . ASN G 1 11 ? 50.528 -61.594 -124.797 1.00 23.71 ?  31  ASN G CG  1 
ATOM   1257 O  OD1 . ASN G 1 11 ? 51.213 -62.576 -125.076 1.00 26.98 ?  31  ASN G OD1 1 
ATOM   1258 N  ND2 . ASN G 1 11 ? 51.035 -60.504 -124.228 1.00 23.26 ?  31  ASN G ND2 1 
ATOM   1259 N  N   . ILE G 1 12 ? 46.294 -60.410 -126.325 1.00 24.83 ?  32  ILE G N   1 
ATOM   1260 C  CA  . ILE G 1 12 ? 44.957 -60.594 -126.887 1.00 26.41 ?  32  ILE G CA  1 
ATOM   1261 C  C   . ILE G 1 12 ? 44.915 -60.077 -128.319 1.00 18.80 ?  32  ILE G C   1 
ATOM   1262 O  O   . ILE G 1 12 ? 44.406 -60.746 -129.226 1.00 26.47 ?  32  ILE G O   1 
ATOM   1263 C  CB  . ILE G 1 12 ? 43.900 -59.903 -126.004 1.00 20.92 ?  32  ILE G CB  1 
ATOM   1264 C  CG1 . ILE G 1 12 ? 43.780 -60.618 -124.657 1.00 28.91 ?  32  ILE G CG1 1 
ATOM   1265 C  CG2 . ILE G 1 12 ? 42.538 -59.894 -126.695 1.00 23.13 ?  32  ILE G CG2 1 
ATOM   1266 C  CD1 . ILE G 1 12 ? 43.017 -59.833 -123.609 1.00 27.00 ?  32  ILE G CD1 1 
ATOM   1267 N  N   . ILE G 1 13 ? 45.451 -58.874 -128.543 1.00 21.97 ?  33  ILE G N   1 
ATOM   1268 C  CA  . ILE G 1 13 ? 45.483 -58.292 -129.884 1.00 23.04 ?  33  ILE G CA  1 
ATOM   1269 C  C   . ILE G 1 13 ? 46.295 -59.174 -130.824 1.00 21.50 ?  33  ILE G C   1 
ATOM   1270 O  O   . ILE G 1 13 ? 45.920 -59.380 -131.985 1.00 22.78 ?  33  ILE G O   1 
ATOM   1271 C  CB  . ILE G 1 13 ? 46.040 -56.857 -129.829 1.00 21.80 ?  33  ILE G CB  1 
ATOM   1272 C  CG1 . ILE G 1 13 ? 45.019 -55.912 -129.194 1.00 23.45 ?  33  ILE G CG1 1 
ATOM   1273 C  CG2 . ILE G 1 13 ? 46.401 -56.359 -131.225 1.00 24.00 ?  33  ILE G CG2 1 
ATOM   1274 C  CD1 . ILE G 1 13 ? 45.636 -54.823 -128.341 1.00 24.95 ?  33  ILE G CD1 1 
ATOM   1275 N  N   . GLY G 1 14 ? 47.416 -59.676 -130.317 1.00 20.23 ?  34  GLY G N   1 
ATOM   1276 C  CA  . GLY G 1 14 ? 48.287 -60.533 -131.099 1.00 19.40 ?  34  GLY G CA  1 
ATOM   1277 C  C   . GLY G 1 14 ? 47.540 -61.766 -131.566 1.00 23.10 ?  34  GLY G C   1 
ATOM   1278 O  O   . GLY G 1 14 ? 47.672 -62.189 -132.714 1.00 26.10 ?  34  GLY G O   1 
ATOM   1279 N  N   . ILE G 1 15 ? 46.749 -62.342 -130.666 1.00 21.32 ?  35  ILE G N   1 
ATOM   1280 C  CA  . ILE G 1 15 ? 45.965 -63.528 -130.983 1.00 20.98 ?  35  ILE G CA  1 
ATOM   1281 C  C   . ILE G 1 15 ? 44.870 -63.170 -131.980 1.00 16.91 ?  35  ILE G C   1 
ATOM   1282 O  O   . ILE G 1 15 ? 44.602 -63.919 -132.920 1.00 22.99 ?  35  ILE G O   1 
ATOM   1283 C  CB  . ILE G 1 15 ? 45.324 -64.137 -129.723 1.00 20.02 ?  35  ILE G CB  1 
ATOM   1284 C  CG1 . ILE G 1 15 ? 46.407 -64.601 -128.745 1.00 27.97 ?  35  ILE G CG1 1 
ATOM   1285 C  CG2 . ILE G 1 15 ? 44.407 -65.292 -130.096 1.00 16.49 ?  35  ILE G CG2 1 
ATOM   1286 C  CD1 . ILE G 1 15 ? 47.348 -65.636 -129.322 1.00 22.83 ?  35  ILE G CD1 1 
ATOM   1287 N  N   . LEU G 1 16 ? 44.242 -62.018 -131.767 1.00 21.57 ?  36  LEU G N   1 
ATOM   1288 C  CA  . LEU G 1 16 ? 43.182 -61.552 -132.650 1.00 19.49 ?  36  LEU G CA  1 
ATOM   1289 C  C   . LEU G 1 16 ? 43.733 -61.352 -134.056 1.00 22.88 ?  36  LEU G C   1 
ATOM   1290 O  O   . LEU G 1 16 ? 43.082 -61.688 -135.044 1.00 21.67 ?  36  LEU G O   1 
ATOM   1291 C  CB  . LEU G 1 16 ? 42.581 -60.246 -132.127 1.00 22.02 ?  36  LEU G CB  1 
ATOM   1292 C  CG  . LEU G 1 16 ? 41.642 -59.503 -133.080 1.00 29.57 ?  36  LEU G CG  1 
ATOM   1293 C  CD1 . LEU G 1 16 ? 40.400 -60.332 -133.365 1.00 22.03 ?  36  LEU G CD1 1 
ATOM   1294 C  CD2 . LEU G 1 16 ? 41.266 -58.143 -132.511 1.00 26.51 ?  36  LEU G CD2 1 
ATOM   1295 N  N   . HIS G 1 17 ? 44.941 -60.803 -134.135 1.00 22.24 ?  37  HIS G N   1 
ATOM   1296 C  CA  . HIS G 1 17 ? 45.590 -60.564 -135.417 1.00 23.56 ?  37  HIS G CA  1 
ATOM   1297 C  C   . HIS G 1 17 ? 45.754 -61.880 -136.166 1.00 21.95 ?  37  HIS G C   1 
ATOM   1298 O  O   . HIS G 1 17 ? 45.479 -61.965 -137.363 1.00 22.48 ?  37  HIS G O   1 
ATOM   1299 C  CB  . HIS G 1 17 ? 46.951 -59.898 -135.216 1.00 25.79 ?  37  HIS G CB  1 
ATOM   1300 C  CG  . HIS G 1 17 ? 47.642 -59.535 -136.494 1.00 30.63 ?  37  HIS G CG  1 
ATOM   1301 N  ND1 . HIS G 1 17 ? 49.009 -59.386 -136.585 1.00 33.37 ?  37  HIS G ND1 1 
ATOM   1302 C  CD2 . HIS G 1 17 ? 47.154 -59.293 -137.733 1.00 36.81 ?  37  HIS G CD2 1 
ATOM   1303 C  CE1 . HIS G 1 17 ? 49.333 -59.067 -137.825 1.00 43.27 ?  37  HIS G CE1 1 
ATOM   1304 N  NE2 . HIS G 1 17 ? 48.226 -59.004 -138.542 1.00 33.28 ?  37  HIS G NE2 1 
ATOM   1305 N  N   . LEU G 1 18 ? 46.201 -62.907 -135.450 1.00 20.38 ?  38  LEU G N   1 
ATOM   1306 C  CA  . LEU G 1 18 ? 46.394 -64.226 -136.042 1.00 25.87 ?  38  LEU G CA  1 
ATOM   1307 C  C   . LEU G 1 18 ? 45.062 -64.837 -136.464 1.00 20.84 ?  38  LEU G C   1 
ATOM   1308 O  O   . LEU G 1 18 ? 44.966 -65.458 -137.528 1.00 23.60 ?  38  LEU G O   1 
ATOM   1309 C  CB  . LEU G 1 18 ? 47.122 -65.141 -135.057 1.00 28.41 ?  38  LEU G CB  1 
ATOM   1310 C  CG  . LEU G 1 18 ? 47.296 -66.600 -135.486 1.00 27.95 ?  38  LEU G CG  1 
ATOM   1311 C  CD1 . LEU G 1 18 ? 47.963 -66.697 -136.850 1.00 29.30 ?  38  LEU G CD1 1 
ATOM   1312 C  CD2 . LEU G 1 18 ? 48.101 -67.356 -134.443 1.00 29.00 ?  38  LEU G CD2 1 
ATOM   1313 N  N   . ILE G 1 19 ? 44.021 -64.669 -135.647 1.00 20.17 ?  39  ILE G N   1 
ATOM   1314 C  CA  . ILE G 1 19 ? 42.699 -65.169 -136.021 1.00 21.76 ?  39  ILE G CA  1 
ATOM   1315 C  C   . ILE G 1 19 ? 42.238 -64.511 -137.317 1.00 25.02 ?  39  ILE G C   1 
ATOM   1316 O  O   . ILE G 1 19 ? 41.754 -65.179 -138.238 1.00 22.27 ?  39  ILE G O   1 
ATOM   1317 C  CB  . ILE G 1 19 ? 41.693 -64.939 -134.878 1.00 24.42 ?  39  ILE G CB  1 
ATOM   1318 C  CG1 . ILE G 1 19 ? 42.071 -65.788 -133.662 1.00 23.66 ?  39  ILE G CG1 1 
ATOM   1319 C  CG2 . ILE G 1 19 ? 40.276 -65.284 -135.328 1.00 22.79 ?  39  ILE G CG2 1 
ATOM   1320 C  CD1 . ILE G 1 19 ? 41.261 -65.482 -132.416 1.00 27.55 ?  39  ILE G CD1 1 
ATOM   1321 N  N   . LEU G 1 20 ? 42.387 -63.188 -137.407 1.00 24.03 ?  40  LEU G N   1 
ATOM   1322 C  CA  . LEU G 1 20 ? 41.981 -62.478 -138.616 1.00 27.00 ?  40  LEU G CA  1 
ATOM   1323 C  C   . LEU G 1 20 ? 42.798 -62.933 -139.819 1.00 24.81 ?  40  LEU G C   1 
ATOM   1324 O  O   . LEU G 1 20 ? 42.266 -63.055 -140.929 1.00 21.97 ?  40  LEU G O   1 
ATOM   1325 C  CB  . LEU G 1 20 ? 42.125 -60.970 -138.412 1.00 21.76 ?  40  LEU G CB  1 
ATOM   1326 C  CG  . LEU G 1 20 ? 41.127 -60.307 -137.462 1.00 27.72 ?  40  LEU G CG  1 
ATOM   1327 C  CD1 . LEU G 1 20 ? 41.531 -58.866 -137.204 1.00 24.11 ?  40  LEU G CD1 1 
ATOM   1328 C  CD2 . LEU G 1 20 ? 39.711 -60.369 -138.022 1.00 17.69 ?  40  LEU G CD2 1 
ATOM   1329 N  N   . TRP G 1 21 ? 44.091 -63.193 -139.618 1.00 29.11 ?  41  TRP G N   1 
ATOM   1330 C  CA  . TRP G 1 21 ? 44.932 -63.673 -140.709 1.00 24.97 ?  41  TRP G CA  1 
ATOM   1331 C  C   . TRP G 1 21 ? 44.432 -65.017 -141.229 1.00 30.52 ?  41  TRP G C   1 
ATOM   1332 O  O   . TRP G 1 21 ? 44.314 -65.225 -142.442 1.00 31.86 ?  41  TRP G O   1 
ATOM   1333 C  CB  . TRP G 1 21 ? 46.383 -63.778 -140.235 1.00 30.50 ?  41  TRP G CB  1 
ATOM   1334 C  CG  . TRP G 1 21 ? 47.355 -64.098 -141.328 1.00 38.04 ?  41  TRP G CG  1 
ATOM   1335 C  CD1 . TRP G 1 21 ? 47.964 -63.212 -142.168 1.00 43.41 ?  41  TRP G CD1 1 
ATOM   1336 C  CD2 . TRP G 1 21 ? 47.835 -65.396 -141.699 1.00 40.51 ?  41  TRP G CD2 1 
ATOM   1337 N  NE1 . TRP G 1 21 ? 48.792 -63.877 -143.039 1.00 48.86 ?  41  TRP G NE1 1 
ATOM   1338 C  CE2 . TRP G 1 21 ? 48.730 -65.219 -142.772 1.00 49.73 ?  41  TRP G CE2 1 
ATOM   1339 C  CE3 . TRP G 1 21 ? 47.594 -66.689 -141.228 1.00 41.73 ?  41  TRP G CE3 1 
ATOM   1340 C  CZ2 . TRP G 1 21 ? 49.385 -66.287 -143.383 1.00 53.61 ?  41  TRP G CZ2 1 
ATOM   1341 C  CZ3 . TRP G 1 21 ? 48.245 -67.749 -141.836 1.00 45.21 ?  41  TRP G CZ3 1 
ATOM   1342 C  CH2 . TRP G 1 21 ? 49.129 -67.541 -142.901 1.00 48.48 ?  41  TRP G CH2 1 
ATOM   1343 N  N   . ILE G 1 22 ? 44.132 -65.945 -140.318 1.00 30.24 ?  42  ILE G N   1 
ATOM   1344 C  CA  . ILE G 1 22 ? 43.615 -67.250 -140.723 1.00 25.42 ?  42  ILE G CA  1 
ATOM   1345 C  C   . ILE G 1 22 ? 42.323 -67.084 -141.513 1.00 22.36 ?  42  ILE G C   1 
ATOM   1346 O  O   . ILE G 1 22 ? 42.145 -67.683 -142.579 1.00 27.79 ?  42  ILE G O   1 
ATOM   1347 C  CB  . ILE G 1 22 ? 43.416 -68.153 -139.490 1.00 23.06 ?  42  ILE G CB  1 
ATOM   1348 C  CG1 . ILE G 1 22 ? 44.769 -68.477 -138.853 1.00 25.58 ?  42  ILE G CG1 1 
ATOM   1349 C  CG2 . ILE G 1 22 ? 42.696 -69.442 -139.872 1.00 26.82 ?  42  ILE G CG2 1 
ATOM   1350 C  CD1 . ILE G 1 22 ? 44.673 -69.118 -137.484 1.00 25.19 ?  42  ILE G CD1 1 
ATOM   1351 N  N   . LEU G 1 23 ? 41.400 -66.264 -141.002 1.00 29.74 ?  43  LEU G N   1 
ATOM   1352 C  CA  . LEU G 1 23 ? 40.124 -66.074 -141.685 1.00 30.36 ?  43  LEU G CA  1 
ATOM   1353 C  C   . LEU G 1 23 ? 40.324 -65.506 -143.084 1.00 30.72 ?  43  LEU G C   1 
ATOM   1354 O  O   . LEU G 1 23 ? 39.645 -65.917 -144.032 1.00 32.48 ?  43  LEU G O   1 
ATOM   1355 C  CB  . LEU G 1 23 ? 39.217 -65.160 -140.860 1.00 31.15 ?  43  LEU G CB  1 
ATOM   1356 C  CG  . LEU G 1 23 ? 38.495 -65.820 -139.682 1.00 28.99 ?  43  LEU G CG  1 
ATOM   1357 C  CD1 . LEU G 1 23 ? 37.852 -64.771 -138.787 1.00 30.34 ?  43  LEU G CD1 1 
ATOM   1358 C  CD2 . LEU G 1 23 ? 37.444 -66.816 -140.170 1.00 24.46 ?  43  LEU G CD2 1 
ATOM   1359 N  N   . ASP G 1 24 ? 41.254 -64.561 -143.236 1.00 30.32 ?  44  ASP G N   1 
ATOM   1360 C  CA  . ASP G 1 24 ? 41.499 -63.992 -144.557 1.00 34.88 ?  44  ASP G CA  1 
ATOM   1361 C  C   . ASP G 1 24 ? 41.990 -65.059 -145.528 1.00 32.37 ?  44  ASP G C   1 
ATOM   1362 O  O   . ASP G 1 24 ? 41.609 -65.062 -146.705 1.00 28.48 ?  44  ASP G O   1 
ATOM   1363 C  CB  . ASP G 1 24 ? 42.506 -62.846 -144.453 1.00 34.92 ?  44  ASP G CB  1 
ATOM   1364 C  CG  . ASP G 1 24 ? 42.787 -62.193 -145.794 1.00 33.20 ?  44  ASP G CG  1 
ATOM   1365 O  OD1 . ASP G 1 24 ? 41.860 -61.589 -146.372 1.00 41.10 ?  44  ASP G OD1 1 
ATOM   1366 O  OD2 . ASP G 1 24 ? 43.939 -62.274 -146.265 1.00 41.18 -1 44  ASP G OD2 1 
ATOM   1367 N  N   . ARG G 1 25 ? 42.830 -65.984 -145.059 1.00 30.43 ?  45  ARG G N   1 
ATOM   1368 C  CA  . ARG G 1 25 ? 43.292 -67.049 -145.943 1.00 34.16 ?  45  ARG G CA  1 
ATOM   1369 C  C   . ARG G 1 25 ? 42.171 -68.028 -146.277 1.00 34.75 ?  45  ARG G C   1 
ATOM   1370 O  O   . ARG G 1 25 ? 42.050 -68.481 -147.413 1.00 39.15 ?  45  ARG G O   1 
ATOM   1371 C  CB  . ARG G 1 25 ? 44.487 -67.780 -145.324 1.00 34.32 ?  45  ARG G CB  1 
ATOM   1372 C  CG  . ARG G 1 25 ? 45.606 -66.872 -144.833 1.00 35.03 ?  45  ARG G CG  1 
ATOM   1373 C  CD  . ARG G 1 25 ? 46.577 -66.505 -145.944 1.00 46.96 ?  45  ARG G CD  1 
ATOM   1374 N  NE  . ARG G 1 25 ? 47.347 -67.652 -146.416 1.00 56.07 ?  45  ARG G NE  1 
ATOM   1375 C  CZ  . ARG G 1 25 ? 48.272 -67.590 -147.371 1.00 52.94 ?  45  ARG G CZ  1 
ATOM   1376 N  NH1 . ARG G 1 25 ? 48.542 -66.434 -147.964 1.00 45.67 1  45  ARG G NH1 1 
ATOM   1377 N  NH2 . ARG G 1 25 ? 48.925 -68.685 -147.738 1.00 53.14 ?  45  ARG G NH2 1 
ATOM   1378 N  N   . LEU G 1 26 ? 41.333 -68.366 -145.289 1.00 33.97 ?  46  LEU G N   1 
ATOM   1379 C  CA  . LEU G 1 26 ? 40.224 -69.281 -145.578 1.00 36.39 ?  46  LEU G CA  1 
ATOM   1380 C  C   . LEU G 1 26 ? 39.173 -68.608 -146.453 1.00 33.81 ?  46  LEU G C   1 
ATOM   1381 O  O   . LEU G 1 26 ? 38.872 -67.430 -146.278 1.00 35.19 ?  46  LEU G O   1 
ATOM   1382 C  CB  . LEU G 1 26 ? 39.577 -69.802 -144.286 1.00 36.40 ?  46  LEU G CB  1 
ATOM   1383 C  CG  . LEU G 1 26 ? 40.489 -70.349 -143.188 1.00 31.66 ?  46  LEU G CG  1 
ATOM   1384 C  CD1 . LEU G 1 26 ? 39.689 -70.658 -141.927 1.00 24.54 ?  46  LEU G CD1 1 
ATOM   1385 C  CD2 . LEU G 1 26 ? 41.223 -71.573 -143.683 1.00 33.46 ?  46  LEU G CD2 1 
HETATM 1386 N  N   . NH2 G 1 27 ? 38.622 -69.384 -147.378 1.00 35.53 ?  47  NH2 G N   1 
HETATM 1387 C  C   . ACE H 1 1  ? 50.740 -57.093 -112.879 1.00 26.12 ?  21  ACE H C   1 
HETATM 1388 O  O   . ACE H 1 1  ? 50.577 -55.896 -113.112 1.00 28.13 ?  21  ACE H O   1 
HETATM 1389 C  CH3 . ACE H 1 1  ? 49.645 -57.961 -112.337 1.00 20.79 ?  21  ACE H CH3 1 
ATOM   1390 N  N   . SER H 1 2  ? 51.893 -57.715 -113.097 1.00 19.55 ?  22  SER H N   1 
ATOM   1391 C  CA  . SER H 1 2  ? 53.059 -57.018 -113.622 1.00 18.97 ?  22  SER H CA  1 
ATOM   1392 C  C   . SER H 1 2  ? 53.942 -57.993 -114.386 1.00 17.55 ?  22  SER H C   1 
ATOM   1393 O  O   . SER H 1 2  ? 53.828 -59.206 -114.221 1.00 18.20 ?  22  SER H O   1 
ATOM   1394 C  CB  . SER H 1 2  ? 53.847 -56.350 -112.492 1.00 19.78 ?  22  SER H CB  1 
ATOM   1395 O  OG  . SER H 1 2  ? 54.146 -57.275 -111.461 1.00 18.53 ?  22  SER H OG  1 
ATOM   1396 N  N   . SER H 1 3  ? 54.819 -57.454 -115.229 1.00 21.56 ?  23  SER H N   1 
ATOM   1397 C  CA  . SER H 1 3  ? 55.623 -58.258 -116.135 1.00 20.63 ?  23  SER H CA  1 
ATOM   1398 C  C   . SER H 1 3  ? 57.079 -57.816 -116.080 1.00 21.81 ?  23  SER H C   1 
ATOM   1399 O  O   . SER H 1 3  ? 57.411 -56.737 -115.583 1.00 22.08 ?  23  SER H O   1 
ATOM   1400 C  CB  . SER H 1 3  ? 55.107 -58.150 -117.578 1.00 20.20 ?  23  SER H CB  1 
ATOM   1401 O  OG  . SER H 1 3  ? 53.728 -58.469 -117.654 1.00 21.42 ?  23  SER H OG  1 
ATOM   1402 N  N   . ASP H 1 4  ? 57.943 -58.673 -116.605 1.00 23.55 ?  24  ASP H N   1 
ATOM   1403 C  CA  . ASP H 1 4  ? 59.345 -58.325 -116.754 1.00 21.62 ?  24  ASP H CA  1 
ATOM   1404 C  C   . ASP H 1 4  ? 59.470 -57.099 -117.657 1.00 19.69 ?  24  ASP H C   1 
ATOM   1405 O  O   . ASP H 1 4  ? 58.813 -57.042 -118.706 1.00 19.34 ?  24  ASP H O   1 
ATOM   1406 C  CB  . ASP H 1 4  ? 60.111 -59.509 -117.344 1.00 24.45 ?  24  ASP H CB  1 
ATOM   1407 C  CG  . ASP H 1 4  ? 61.608 -59.274 -117.399 1.00 30.84 ?  24  ASP H CG  1 
ATOM   1408 O  OD1 . ASP H 1 4  ? 62.032 -58.188 -117.849 1.00 31.74 ?  24  ASP H OD1 1 
ATOM   1409 O  OD2 . ASP H 1 4  ? 62.364 -60.181 -116.991 1.00 37.74 -1 24  ASP H OD2 1 
ATOM   1410 N  N   . PRO H 1 5  ? 60.281 -56.102 -117.291 1.00 21.50 ?  25  PRO H N   1 
ATOM   1411 C  CA  . PRO H 1 5  ? 60.433 -54.925 -118.165 1.00 24.34 ?  25  PRO H CA  1 
ATOM   1412 C  C   . PRO H 1 5  ? 60.799 -55.268 -119.596 1.00 23.01 ?  25  PRO H C   1 
ATOM   1413 O  O   . PRO H 1 5  ? 60.398 -54.548 -120.520 1.00 24.30 ?  25  PRO H O   1 
ATOM   1414 C  CB  . PRO H 1 5  ? 61.547 -54.127 -117.476 1.00 29.76 ?  25  PRO H CB  1 
ATOM   1415 C  CG  . PRO H 1 5  ? 61.444 -54.509 -116.043 1.00 26.65 ?  25  PRO H CG  1 
ATOM   1416 C  CD  . PRO H 1 5  ? 61.048 -55.957 -116.041 1.00 24.64 ?  25  PRO H CD  1 
ATOM   1417 N  N   . LEU H 1 6  ? 61.560 -56.342 -119.811 1.00 22.79 ?  26  LEU H N   1 
ATOM   1418 C  CA  . LEU H 1 6  ? 61.872 -56.767 -121.171 1.00 22.58 ?  26  LEU H CA  1 
ATOM   1419 C  C   . LEU H 1 6  ? 60.611 -57.182 -121.919 1.00 21.63 ?  26  LEU H C   1 
ATOM   1420 O  O   . LEU H 1 6  ? 60.472 -56.911 -123.117 1.00 23.90 ?  26  LEU H O   1 
ATOM   1421 C  CB  . LEU H 1 6  ? 62.884 -57.911 -121.133 1.00 26.23 ?  26  LEU H CB  1 
ATOM   1422 C  CG  . LEU H 1 6  ? 63.300 -58.532 -122.466 1.00 28.34 ?  26  LEU H CG  1 
ATOM   1423 C  CD1 . LEU H 1 6  ? 63.915 -57.498 -123.391 1.00 30.26 ?  26  LEU H CD1 1 
ATOM   1424 C  CD2 . LEU H 1 6  ? 64.275 -59.664 -122.213 1.00 29.07 ?  26  LEU H CD2 1 
ATOM   1425 N  N   . VAL H 1 7  ? 59.677 -57.840 -121.229 1.00 24.27 ?  27  VAL H N   1 
ATOM   1426 C  CA  . VAL H 1 7  ? 58.432 -58.257 -121.868 1.00 23.19 ?  27  VAL H CA  1 
ATOM   1427 C  C   . VAL H 1 7  ? 57.554 -57.047 -122.163 1.00 18.51 ?  27  VAL H C   1 
ATOM   1428 O  O   . VAL H 1 7  ? 56.967 -56.939 -123.246 1.00 21.11 ?  27  VAL H O   1 
ATOM   1429 C  CB  . VAL H 1 7  ? 57.710 -59.291 -120.984 1.00 18.76 ?  27  VAL H CB  1 
ATOM   1430 C  CG1 . VAL H 1 7  ? 56.328 -59.618 -121.533 1.00 21.96 ?  27  VAL H CG1 1 
ATOM   1431 C  CG2 . VAL H 1 7  ? 58.544 -60.558 -120.877 1.00 20.28 ?  27  VAL H CG2 1 
ATOM   1432 N  N   . VAL H 1 8  ? 57.445 -56.120 -121.207 1.00 19.82 ?  28  VAL H N   1 
ATOM   1433 C  CA  . VAL H 1 8  ? 56.671 -54.898 -121.426 1.00 21.53 ?  28  VAL H CA  1 
ATOM   1434 C  C   . VAL H 1 8  ? 57.150 -54.200 -122.693 1.00 23.38 ?  28  VAL H C   1 
ATOM   1435 O  O   . VAL H 1 8  ? 56.375 -53.954 -123.625 1.00 24.23 ?  28  VAL H O   1 
ATOM   1436 C  CB  . VAL H 1 8  ? 56.772 -53.967 -120.204 1.00 26.64 ?  28  VAL H CB  1 
ATOM   1437 C  CG1 . VAL H 1 8  ? 55.990 -52.678 -120.439 1.00 25.49 ?  28  VAL H CG1 1 
ATOM   1438 C  CG2 . VAL H 1 8  ? 56.262 -54.668 -118.953 1.00 19.05 ?  28  VAL H CG2 1 
ATOM   1439 N  N   . ALA H 1 9  ? 58.446 -53.878 -122.746 1.00 18.43 ?  29  ALA H N   1 
ATOM   1440 C  CA  . ALA H 1 9  ? 58.997 -53.201 -123.916 1.00 26.96 ?  29  ALA H CA  1 
ATOM   1441 C  C   . ALA H 1 9  ? 58.747 -54.001 -125.189 1.00 24.05 ?  29  ALA H C   1 
ATOM   1442 O  O   . ALA H 1 9  ? 58.367 -53.436 -126.222 1.00 24.57 ?  29  ALA H O   1 
ATOM   1443 C  CB  . ALA H 1 9  ? 60.495 -52.960 -123.725 1.00 24.91 ?  29  ALA H CB  1 
ATOM   1444 N  N   . ALA H 1 10 ? 58.962 -55.318 -125.138 1.00 25.05 ?  30  ALA H N   1 
ATOM   1445 C  CA  . ALA H 1 10 ? 58.749 -56.148 -126.320 1.00 23.79 ?  30  ALA H CA  1 
ATOM   1446 C  C   . ALA H 1 10 ? 57.310 -56.049 -126.809 1.00 22.70 ?  30  ALA H C   1 
ATOM   1447 O  O   . ALA H 1 10 ? 57.060 -55.959 -128.017 1.00 18.77 ?  30  ALA H O   1 
ATOM   1448 C  CB  . ALA H 1 10 ? 59.107 -57.601 -126.008 1.00 26.10 ?  30  ALA H CB  1 
ATOM   1449 N  N   . ASN H 1 11 ? 56.349 -56.067 -125.883 1.00 19.18 ?  31  ASN H N   1 
ATOM   1450 C  CA  . ASN H 1 11 ? 54.945 -55.989 -126.273 1.00 27.55 ?  31  ASN H CA  1 
ATOM   1451 C  C   . ASN H 1 11 ? 54.600 -54.611 -126.823 1.00 22.65 ?  31  ASN H C   1 
ATOM   1452 O  O   . ASN H 1 11 ? 53.796 -54.495 -127.756 1.00 29.50 ?  31  ASN H O   1 
ATOM   1453 C  CB  . ASN H 1 11 ? 54.055 -56.340 -125.082 1.00 21.55 ?  31  ASN H CB  1 
ATOM   1454 C  CG  . ASN H 1 11 ? 53.881 -57.840 -124.910 1.00 28.09 ?  31  ASN H CG  1 
ATOM   1455 O  OD1 . ASN H 1 11 ? 52.845 -58.398 -125.270 1.00 29.07 ?  31  ASN H OD1 1 
ATOM   1456 N  ND2 . ASN H 1 11 ? 54.902 -58.501 -124.371 1.00 23.96 ?  31  ASN H ND2 1 
ATOM   1457 N  N   . ILE H 1 12 ? 55.188 -53.554 -126.259 1.00 25.44 ?  32  ILE H N   1 
ATOM   1458 C  CA  . ILE H 1 12 ? 55.030 -52.222 -126.838 1.00 22.69 ?  32  ILE H CA  1 
ATOM   1459 C  C   . ILE H 1 12 ? 55.551 -52.212 -128.270 1.00 20.11 ?  32  ILE H C   1 
ATOM   1460 O  O   . ILE H 1 12 ? 54.884 -51.728 -129.192 1.00 20.71 ?  32  ILE H O   1 
ATOM   1461 C  CB  . ILE H 1 12 ? 55.746 -51.169 -125.971 1.00 24.14 ?  32  ILE H CB  1 
ATOM   1462 C  CG1 . ILE H 1 12 ? 55.090 -51.079 -124.592 1.00 24.85 ?  32  ILE H CG1 1 
ATOM   1463 C  CG2 . ILE H 1 12 ? 55.725 -49.793 -126.656 1.00 24.94 ?  32  ILE H CG2 1 
ATOM   1464 C  CD1 . ILE H 1 12 ? 55.863 -50.241 -123.590 1.00 22.04 ?  32  ILE H CD1 1 
ATOM   1465 N  N   . ILE H 1 13 ? 56.756 -52.750 -128.474 1.00 22.78 ?  33  ILE H N   1 
ATOM   1466 C  CA  . ILE H 1 13 ? 57.338 -52.812 -129.812 1.00 21.50 ?  33  ILE H CA  1 
ATOM   1467 C  C   . ILE H 1 13 ? 56.426 -53.595 -130.748 1.00 22.06 ?  33  ILE H C   1 
ATOM   1468 O  O   . ILE H 1 13 ? 56.184 -53.185 -131.890 1.00 23.30 ?  33  ILE H O   1 
ATOM   1469 C  CB  . ILE H 1 13 ? 58.750 -53.426 -129.745 1.00 23.77 ?  33  ILE H CB  1 
ATOM   1470 C  CG1 . ILE H 1 13 ? 59.685 -52.511 -128.951 1.00 25.95 ?  33  ILE H CG1 1 
ATOM   1471 C  CG2 . ILE H 1 13 ? 59.315 -53.660 -131.143 1.00 23.00 ?  33  ILE H CG2 1 
ATOM   1472 C  CD1 . ILE H 1 13 ? 60.984 -53.171 -128.539 1.00 25.66 ?  33  ILE H CD1 1 
ATOM   1473 N  N   . GLY H 1 14 ? 55.907 -54.732 -130.281 1.00 18.24 ?  34  GLY H N   1 
ATOM   1474 C  CA  . GLY H 1 14 ? 54.990 -55.508 -131.100 1.00 20.08 ?  34  GLY H CA  1 
ATOM   1475 C  C   . GLY H 1 14 ? 53.794 -54.695 -131.557 1.00 22.89 ?  34  GLY H C   1 
ATOM   1476 O  O   . GLY H 1 14 ? 53.409 -54.736 -132.728 1.00 23.75 ?  34  GLY H O   1 
ATOM   1477 N  N   . ILE H 1 15 ? 53.191 -53.939 -130.637 1.00 19.03 ?  35  ILE H N   1 
ATOM   1478 C  CA  . ILE H 1 15 ? 52.044 -53.084 -130.924 1.00 22.28 ?  35  ILE H CA  1 
ATOM   1479 C  C   . ILE H 1 15 ? 52.412 -52.031 -131.961 1.00 20.39 ?  35  ILE H C   1 
ATOM   1480 O  O   . ILE H 1 15 ? 51.592 -51.669 -132.813 1.00 22.45 ?  35  ILE H O   1 
ATOM   1481 C  CB  . ILE H 1 15 ? 51.509 -52.453 -129.625 1.00 21.98 ?  35  ILE H CB  1 
ATOM   1482 C  CG1 . ILE H 1 15 ? 50.804 -53.521 -128.784 1.00 26.76 ?  35  ILE H CG1 1 
ATOM   1483 C  CG2 . ILE H 1 15 ? 50.544 -51.308 -129.930 1.00 25.19 ?  35  ILE H CG2 1 
ATOM   1484 C  CD1 . ILE H 1 15 ? 49.857 -54.412 -129.566 1.00 28.35 ?  35  ILE H CD1 1 
ATOM   1485 N  N   . LEU H 1 16 ? 53.602 -51.454 -131.788 1.00 19.77 ?  36  LEU H N   1 
ATOM   1486 C  CA  . LEU H 1 16 ? 54.085 -50.457 -132.737 1.00 21.32 ?  36  LEU H CA  1 
ATOM   1487 C  C   . LEU H 1 16 ? 54.226 -51.062 -134.127 1.00 19.47 ?  36  LEU H C   1 
ATOM   1488 O  O   . LEU H 1 16 ? 53.799 -50.468 -135.124 1.00 21.87 ?  36  LEU H O   1 
ATOM   1489 C  CB  . LEU H 1 16 ? 55.418 -49.881 -132.254 1.00 23.25 ?  36  LEU H CB  1 
ATOM   1490 C  CG  . LEU H 1 16 ? 56.139 -48.907 -133.192 1.00 29.79 ?  36  LEU H CG  1 
ATOM   1491 C  CD1 . LEU H 1 16 ? 55.304 -47.668 -133.445 1.00 26.03 ?  36  LEU H CD1 1 
ATOM   1492 C  CD2 . LEU H 1 16 ? 57.490 -48.529 -132.619 1.00 30.68 ?  36  LEU H CD2 1 
ATOM   1493 N  N   . HIS H 1 17 ? 54.826 -52.251 -134.210 1.00 18.88 ?  37  HIS H N   1 
ATOM   1494 C  CA  . HIS H 1 17 ? 54.960 -52.925 -135.495 1.00 18.52 ?  37  HIS H CA  1 
ATOM   1495 C  C   . HIS H 1 17 ? 53.602 -53.105 -136.159 1.00 20.10 ?  37  HIS H C   1 
ATOM   1496 O  O   . HIS H 1 17 ? 53.457 -52.883 -137.368 1.00 27.79 ?  37  HIS H O   1 
ATOM   1497 C  CB  . HIS H 1 17 ? 55.649 -54.278 -135.303 1.00 26.47 ?  37  HIS H CB  1 
ATOM   1498 C  CG  . HIS H 1 17 ? 55.871 -55.029 -136.578 1.00 27.24 ?  37  HIS H CG  1 
ATOM   1499 N  ND1 . HIS H 1 17 ? 55.910 -56.405 -136.634 1.00 36.72 ?  37  HIS H ND1 1 
ATOM   1500 C  CD2 . HIS H 1 17 ? 56.067 -54.595 -137.845 1.00 28.88 ?  37  HIS H CD2 1 
ATOM   1501 C  CE1 . HIS H 1 17 ? 56.119 -56.786 -137.882 1.00 35.50 ?  37  HIS H CE1 1 
ATOM   1502 N  NE2 . HIS H 1 17 ? 56.219 -55.707 -138.636 1.00 30.74 ?  37  HIS H NE2 1 
ATOM   1503 N  N   . LEU H 1 18 ? 52.592 -53.500 -135.384 1.00 18.91 ?  38  LEU H N   1 
ATOM   1504 C  CA  . LEU H 1 18 ? 51.251 -53.642 -135.938 1.00 25.66 ?  38  LEU H CA  1 
ATOM   1505 C  C   . LEU H 1 18 ? 50.727 -52.304 -136.443 1.00 21.83 ?  38  LEU H C   1 
ATOM   1506 O  O   . LEU H 1 18 ? 50.236 -52.203 -137.573 1.00 26.58 ?  38  LEU H O   1 
ATOM   1507 C  CB  . LEU H 1 18 ? 50.309 -54.230 -134.885 1.00 24.18 ?  38  LEU H CB  1 
ATOM   1508 C  CG  . LEU H 1 18 ? 48.848 -54.401 -135.309 1.00 26.29 ?  38  LEU H CG  1 
ATOM   1509 C  CD1 . LEU H 1 18 ? 48.728 -55.226 -136.582 1.00 27.28 ?  38  LEU H CD1 1 
ATOM   1510 C  CD2 . LEU H 1 18 ? 48.049 -55.045 -134.187 1.00 31.88 ?  38  LEU H CD2 1 
ATOM   1511 N  N   . ILE H 1 19 ? 50.825 -51.259 -135.616 1.00 22.72 ?  39  ILE H N   1 
ATOM   1512 C  CA  . ILE H 1 19 ? 50.365 -49.934 -136.030 1.00 27.52 ?  39  ILE H CA  1 
ATOM   1513 C  C   . ILE H 1 19 ? 51.043 -49.526 -137.334 1.00 27.23 ?  39  ILE H C   1 
ATOM   1514 O  O   . ILE H 1 19 ? 50.391 -49.068 -138.280 1.00 27.09 ?  39  ILE H O   1 
ATOM   1515 C  CB  . ILE H 1 19 ? 50.617 -48.903 -134.912 1.00 22.15 ?  39  ILE H CB  1 
ATOM   1516 C  CG1 . ILE H 1 19 ? 49.732 -49.205 -133.702 1.00 20.55 ?  39  ILE H CG1 1 
ATOM   1517 C  CG2 . ILE H 1 19 ? 50.339 -47.483 -135.403 1.00 20.73 ?  39  ILE H CG2 1 
ATOM   1518 C  CD1 . ILE H 1 19 ? 50.164 -48.507 -132.430 1.00 29.45 ?  39  ILE H CD1 1 
ATOM   1519 N  N   . LEU H 1 20 ? 52.366 -49.691 -137.404 1.00 25.06 ?  40  LEU H N   1 
ATOM   1520 C  CA  . LEU H 1 20 ? 53.162 -49.375 -138.584 1.00 26.00 ?  40  LEU H CA  1 
ATOM   1521 C  C   . LEU H 1 20 ? 52.643 -50.112 -139.811 1.00 29.06 ?  40  LEU H C   1 
ATOM   1522 O  O   . LEU H 1 20 ? 52.580 -49.541 -140.907 1.00 22.27 ?  40  LEU H O   1 
ATOM   1523 C  CB  . LEU H 1 20 ? 54.630 -49.716 -138.337 1.00 24.85 ?  40  LEU H CB  1 
ATOM   1524 C  CG  . LEU H 1 20 ? 55.423 -48.704 -137.502 1.00 33.39 ?  40  LEU H CG  1 
ATOM   1525 C  CD1 . LEU H 1 20 ? 56.909 -48.831 -137.794 1.00 37.30 ?  40  LEU H CD1 1 
ATOM   1526 C  CD2 . LEU H 1 20 ? 54.952 -47.272 -137.759 1.00 34.06 ?  40  LEU H CD2 1 
ATOM   1527 N  N   . TRP H 1 21 ? 52.417 -51.414 -139.622 1.00 27.18 ?  41  TRP H N   1 
ATOM   1528 C  CA  . TRP H 1 21 ? 51.965 -52.229 -140.744 1.00 31.06 ?  41  TRP H CA  1 
ATOM   1529 C  C   . TRP H 1 21 ? 50.586 -51.790 -141.220 1.00 29.83 ?  41  TRP H C   1 
ATOM   1530 O  O   . TRP H 1 21 ? 50.329 -51.722 -142.428 1.00 33.65 ?  41  TRP H O   1 
ATOM   1531 C  CB  . TRP H 1 21 ? 51.952 -53.705 -140.349 1.00 33.56 ?  41  TRP H CB  1 
ATOM   1532 C  CG  . TRP H 1 21 ? 51.286 -54.583 -141.360 1.00 34.06 ?  41  TRP H CG  1 
ATOM   1533 C  CD1 . TRP H 1 21 ? 51.895 -55.323 -142.329 1.00 42.75 ?  41  TRP H CD1 1 
ATOM   1534 C  CD2 . TRP H 1 21 ? 49.881 -54.813 -141.501 1.00 36.70 ?  41  TRP H CD2 1 
ATOM   1535 N  NE1 . TRP H 1 21 ? 50.955 -56.001 -143.067 1.00 47.30 ?  41  TRP H NE1 1 
ATOM   1536 C  CE2 . TRP H 1 21 ? 49.710 -55.704 -142.578 1.00 46.90 ?  41  TRP H CE2 1 
ATOM   1537 C  CE3 . TRP H 1 21 ? 48.750 -54.351 -140.823 1.00 42.45 ?  41  TRP H CE3 1 
ATOM   1538 C  CZ2 . TRP H 1 21 ? 48.454 -56.143 -142.993 1.00 45.76 ?  41  TRP H CZ2 1 
ATOM   1539 C  CZ3 . TRP H 1 21 ? 47.502 -54.788 -141.236 1.00 49.50 ?  41  TRP H CZ3 1 
ATOM   1540 C  CH2 . TRP H 1 21 ? 47.366 -55.675 -142.310 1.00 47.40 ?  41  TRP H CH2 1 
ATOM   1541 N  N   . ILE H 1 22 ? 49.683 -51.444 -140.300 1.00 31.33 ?  42  ILE H N   1 
ATOM   1542 C  CA  . ILE H 1 22 ? 48.375 -50.937 -140.703 1.00 33.24 ?  42  ILE H CA  1 
ATOM   1543 C  C   . ILE H 1 22 ? 48.530 -49.626 -141.464 1.00 27.93 ?  42  ILE H C   1 
ATOM   1544 O  O   . ILE H 1 22 ? 47.898 -49.417 -142.506 1.00 32.01 ?  42  ILE H O   1 
ATOM   1545 C  CB  . ILE H 1 22 ? 47.460 -50.781 -139.473 1.00 27.52 ?  42  ILE H CB  1 
ATOM   1546 C  CG1 . ILE H 1 22 ? 47.144 -52.154 -138.875 1.00 23.78 ?  42  ILE H CG1 1 
ATOM   1547 C  CG2 . ILE H 1 22 ? 46.160 -50.069 -139.847 1.00 29.40 ?  42  ILE H CG2 1 
ATOM   1548 C  CD1 . ILE H 1 22 ? 46.532 -52.102 -137.494 1.00 22.38 ?  42  ILE H CD1 1 
ATOM   1549 N  N   . LEU H 1 23 ? 49.378 -48.725 -140.961 1.00 27.97 ?  43  LEU H N   1 
ATOM   1550 C  CA  . LEU H 1 23 ? 49.599 -47.456 -141.646 1.00 32.34 ?  43  LEU H CA  1 
ATOM   1551 C  C   . LEU H 1 23 ? 50.203 -47.663 -143.028 1.00 34.02 ?  43  LEU H C   1 
ATOM   1552 O  O   . LEU H 1 23 ? 49.969 -46.855 -143.934 1.00 33.26 ?  43  LEU H O   1 
ATOM   1553 C  CB  . LEU H 1 23 ? 50.497 -46.553 -140.802 1.00 31.07 ?  43  LEU H CB  1 
ATOM   1554 C  CG  . LEU H 1 23 ? 49.747 -45.491 -139.996 1.00 31.64 ?  43  LEU H CG  1 
ATOM   1555 C  CD1 . LEU H 1 23 ? 50.629 -44.903 -138.906 1.00 36.03 ?  43  LEU H CD1 1 
ATOM   1556 C  CD2 . LEU H 1 23 ? 49.242 -44.394 -140.915 1.00 34.55 ?  43  LEU H CD2 1 
ATOM   1557 N  N   . ASP H 1 24 ? 50.977 -48.735 -143.212 1.00 35.48 ?  44  ASP H N   1 
ATOM   1558 C  CA  . ASP H 1 24 ? 51.528 -49.072 -144.519 1.00 36.26 ?  44  ASP H CA  1 
ATOM   1559 C  C   . ASP H 1 24 ? 50.422 -49.451 -145.497 1.00 37.40 ?  44  ASP H C   1 
ATOM   1560 O  O   . ASP H 1 24 ? 50.454 -49.050 -146.666 1.00 36.37 ?  44  ASP H O   1 
ATOM   1561 C  CB  . ASP H 1 24 ? 52.542 -50.207 -144.381 1.00 37.38 ?  44  ASP H CB  1 
ATOM   1562 C  CG  . ASP H 1 24 ? 53.377 -50.400 -145.633 1.00 38.13 ?  44  ASP H CG  1 
ATOM   1563 O  OD1 . ASP H 1 24 ? 54.051 -49.440 -146.060 1.00 44.65 ?  44  ASP H OD1 1 
ATOM   1564 O  OD2 . ASP H 1 24 ? 53.369 -51.520 -146.185 1.00 50.21 -1 44  ASP H OD2 1 
ATOM   1565 N  N   . ARG H 1 25 ? 49.471 -50.273 -145.055 1.00 33.82 ?  45  ARG H N   1 
ATOM   1566 C  CA  . ARG H 1 25 ? 48.470 -50.665 -146.035 1.00 34.79 ?  45  ARG H CA  1 
ATOM   1567 C  C   . ARG H 1 25 ? 47.392 -49.601 -146.193 1.00 37.80 ?  45  ARG H C   1 
ATOM   1568 O  O   . ARG H 1 25 ? 46.845 -49.440 -147.289 1.00 39.16 ?  45  ARG H O   1 
ATOM   1569 C  CB  . ARG H 1 25 ? 47.853 -52.012 -145.645 1.00 44.04 ?  45  ARG H CB  1 
ATOM   1570 C  CG  . ARG H 1 25 ? 48.876 -53.137 -145.466 1.00 42.91 ?  45  ARG H CG  1 
ATOM   1571 C  CD  . ARG H 1 25 ? 49.135 -53.868 -146.781 1.00 43.79 ?  45  ARG H CD  1 
ATOM   1572 N  NE  . ARG H 1 25 ? 48.084 -54.834 -147.096 1.00 51.31 ?  45  ARG H NE  1 
ATOM   1573 C  CZ  . ARG H 1 25 ? 46.914 -54.515 -147.641 1.00 54.82 ?  45  ARG H CZ  1 
ATOM   1574 N  NH1 . ARG H 1 25 ? 46.630 -53.249 -147.918 1.00 51.27 1  45  ARG H NH1 1 
ATOM   1575 N  NH2 . ARG H 1 25 ? 46.021 -55.462 -147.898 1.00 55.54 ?  45  ARG H NH2 1 
ATOM   1576 N  N   . LEU H 1 26 ? 47.177 -48.727 -145.214 1.00 34.43 ?  46  LEU H N   1 
ATOM   1577 C  CA  . LEU H 1 26 ? 46.236 -47.637 -145.470 1.00 39.61 ?  46  LEU H CA  1 
ATOM   1578 C  C   . LEU H 1 26 ? 46.849 -46.587 -146.392 1.00 40.29 ?  46  LEU H C   1 
ATOM   1579 O  O   . LEU H 1 26 ? 47.958 -46.103 -146.150 1.00 37.27 ?  46  LEU H O   1 
ATOM   1580 C  CB  . LEU H 1 26 ? 45.794 -46.980 -144.160 1.00 33.34 ?  46  LEU H CB  1 
ATOM   1581 C  CG  . LEU H 1 26 ? 44.913 -47.790 -143.209 1.00 29.76 ?  46  LEU H CG  1 
ATOM   1582 C  CD1 . LEU H 1 26 ? 45.120 -47.311 -141.785 1.00 29.26 ?  46  LEU H CD1 1 
ATOM   1583 C  CD2 . LEU H 1 26 ? 43.454 -47.667 -143.601 1.00 34.78 ?  46  LEU H CD2 1 
HETATM 1584 N  N   . NH2 H 1 27 ? 46.035 -46.213 -147.374 1.00 43.09 ?  47  NH2 H N   1 
HETATM 1585 CA CA  . CA  I 2 .  ? 35.358 -52.335 -147.428 1.00 50.63 ?  101 CA  A CA  1 
HETATM 1586 CA CA  . CA  J 2 .  ? 26.857 -43.034 -147.249 1.00 45.71 ?  101 CA  B CA  1 
HETATM 1587 CA CA  . CA  K 2 .  ? 45.090 -43.964 -147.258 1.00 48.15 ?  101 CA  D CA  1 
HETATM 1588 CA CA  . CA  L 2 .  ? 54.198 -61.397 -113.242 1.00 18.94 ?  101 CA  E CA  1 
HETATM 1589 CL CL  . CL  M 3 .  ? 54.121 -61.421 -118.324 1.00 23.35 ?  101 CL  G CL  1 
HETATM 1590 O  O   . HOH N 4 .  ? 30.663 -44.382 -113.629 1.00 16.46 ?  201 HOH A O   1 
HETATM 1591 O  O   . HOH N 4 .  ? 34.196 -44.533 -114.053 1.00 20.49 ?  202 HOH A O   1 
HETATM 1592 O  O   . HOH N 4 .  ? 36.889 -50.546 -107.807 1.00 34.91 ?  203 HOH A O   1 
HETATM 1593 O  O   . HOH N 4 .  ? 33.360 -44.927 -131.636 1.00 21.63 ?  204 HOH A O   1 
HETATM 1594 O  O   . HOH N 4 .  ? 36.872 -50.305 -107.690 1.00 34.36 ?  205 HOH A O   1 
HETATM 1595 O  O   . HOH N 4 .  ? 35.466 -46.946 -143.753 1.00 29.18 ?  206 HOH A O   1 
HETATM 1596 O  O   . HOH N 4 .  ? 37.971 -46.210 -131.414 1.00 23.65 ?  207 HOH A O   1 
HETATM 1597 O  O   . HOH N 4 .  ? 40.822 -58.100 -146.133 1.00 42.75 ?  208 HOH A O   1 
HETATM 1598 O  O   . HOH O 4 .  ? 34.938 -41.430 -113.896 1.00 20.80 ?  201 HOH B O   1 
HETATM 1599 O  O   . HOH O 4 .  ? 34.991 -37.885 -113.670 1.00 22.31 ?  202 HOH B O   1 
HETATM 1600 O  O   . HOH O 4 .  ? 29.085 -44.184 -107.643 1.00 27.89 ?  203 HOH B O   1 
HETATM 1601 O  O   . HOH O 4 .  ? 33.030 -35.887 -112.853 1.00 38.84 ?  204 HOH B O   1 
HETATM 1602 O  O   . HOH O 4 .  ? 24.344 -44.200 -146.256 1.00 31.94 ?  205 HOH B O   1 
HETATM 1603 O  O   . HOH O 4 .  ? 25.476 -44.631 -148.764 1.00 41.02 ?  206 HOH B O   1 
HETATM 1604 O  O   . HOH O 4 .  ? 31.481 -43.275 -146.826 1.00 40.29 ?  207 HOH B O   1 
HETATM 1605 O  O   . HOH O 4 .  ? 35.727 -43.006 -138.803 1.00 33.85 ?  208 HOH B O   1 
HETATM 1606 O  O   . HOH O 4 .  ? 27.684 -47.154 -110.706 1.00 35.00 ?  209 HOH B O   1 
HETATM 1607 O  O   . HOH O 4 .  ? 34.669 -42.184 -129.319 1.00 32.86 ?  210 HOH B O   1 
HETATM 1608 O  O   . HOH P 4 .  ? 36.220 -34.175 -147.220 1.00 26.23 ?  101 HOH C O   1 
HETATM 1609 O  O   . HOH P 4 .  ? 35.123 -36.395 -107.687 1.00 21.81 ?  102 HOH C O   1 
HETATM 1610 O  O   . HOH P 4 .  ? 41.344 -42.259 -113.589 1.00 23.06 ?  103 HOH C O   1 
HETATM 1611 O  O   . HOH P 4 .  ? 37.685 -42.455 -113.969 1.00 20.73 ?  104 HOH C O   1 
HETATM 1612 O  O   . HOH P 4 .  ? 34.158 -40.405 -131.515 1.00 17.41 ?  105 HOH C O   1 
HETATM 1613 O  O   . HOH P 4 .  ? 43.331 -39.870 -113.116 1.00 40.33 ?  106 HOH C O   1 
HETATM 1614 O  O   . HOH P 4 .  ? 35.357 -31.562 -145.921 1.00 35.18 ?  107 HOH C O   1 
HETATM 1615 O  O   . HOH P 4 .  ? 32.526 -34.900 -110.279 1.00 39.43 ?  108 HOH C O   1 
HETATM 1616 O  O   . HOH Q 4 .  ? 37.179 -48.821 -113.491 1.00 23.15 ?  201 HOH D O   1 
HETATM 1617 O  O   . HOH Q 4 .  ? 38.977 -41.700 -131.649 1.00 20.48 ?  202 HOH D O   1 
HETATM 1618 O  O   . HOH Q 4 .  ? 36.928 -45.109 -113.920 1.00 23.01 ?  203 HOH D O   1 
HETATM 1619 O  O   . HOH Q 4 .  ? 47.663 -42.566 -146.025 1.00 34.16 ?  204 HOH D O   1 
HETATM 1620 O  O   . HOH Q 4 .  ? 46.300 -42.053 -148.965 1.00 44.69 ?  205 HOH D O   1 
HETATM 1621 O  O   . HOH Q 4 .  ? 47.654 -46.260 -112.078 1.00 35.19 ?  206 HOH D O   1 
HETATM 1622 O  O   . HOH Q 4 .  ? 38.894 -43.184 -143.958 1.00 40.63 ?  207 HOH D O   1 
HETATM 1623 O  O   . HOH Q 4 .  ? 37.703 -44.466 -129.276 1.00 34.40 ?  208 HOH D O   1 
HETATM 1624 O  O   . HOH Q 4 .  ? 44.486 -39.245 -110.423 1.00 39.30 ?  209 HOH D O   1 
HETATM 1625 O  O   . HOH Q 4 .  ? 36.271 -43.330 -125.455 1.00 29.87 ?  210 HOH D O   1 
HETATM 1626 O  O   . HOH R 4 .  ? 55.762 -62.734 -111.558 1.00 16.67 ?  201 HOH E O   1 
HETATM 1627 O  O   . HOH R 4 .  ? 61.735 -65.247 -115.299 1.00 28.59 ?  202 HOH E O   1 
HETATM 1628 O  O   . HOH R 4 .  ? 58.883 -63.599 -141.341 1.00 45.16 ?  203 HOH E O   1 
HETATM 1629 O  O   . HOH R 4 .  ? 55.224 -72.232 -118.648 1.00 36.08 ?  204 HOH E O   1 
HETATM 1630 O  O   . HOH R 4 .  ? 64.469 -64.646 -146.548 1.00 44.52 ?  205 HOH E O   1 
HETATM 1631 O  O   . HOH R 4 .  ? 57.956 -63.968 -133.492 1.00 33.01 ?  206 HOH E O   1 
HETATM 1632 O  O   . HOH R 4 .  ? 58.343 -60.054 -138.481 1.00 38.78 ?  207 HOH E O   1 
HETATM 1633 O  O   . HOH R 4 .  ? 56.688 -60.299 -129.283 1.00 41.28 ?  208 HOH E O   1 
HETATM 1634 O  O   . HOH R 4 .  ? 71.619 -60.822 -141.516 1.00 53.68 ?  209 HOH E O   1 
HETATM 1635 O  O   . HOH R 4 .  ? 72.301 -61.275 -138.625 1.00 36.98 ?  210 HOH E O   1 
HETATM 1636 O  O   . HOH S 4 .  ? 52.797 -63.366 -111.695 1.00 20.76 ?  101 HOH F O   1 
HETATM 1637 O  O   . HOH S 4 .  ? 52.851 -66.327 -140.843 1.00 32.61 ?  102 HOH F O   1 
HETATM 1638 O  O   . HOH S 4 .  ? 49.849 -68.710 -115.389 1.00 29.89 ?  103 HOH F O   1 
HETATM 1639 O  O   . HOH S 4 .  ? 51.417 -71.404 -145.893 1.00 55.14 ?  104 HOH F O   1 
HETATM 1640 O  O   . HOH S 4 .  ? 51.188 -64.841 -133.181 1.00 38.51 ?  105 HOH F O   1 
HETATM 1641 O  O   . HOH S 4 .  ? 55.128 -64.278 -129.031 1.00 40.95 ?  106 HOH F O   1 
HETATM 1642 O  O   . HOH S 4 .  ? 57.955 -79.397 -145.546 1.00 43.85 ?  107 HOH F O   1 
HETATM 1643 O  O   . HOH S 4 .  ? 51.799 -62.991 -129.373 1.00 34.98 ?  108 HOH F O   1 
HETATM 1644 O  O   . HOH S 4 .  ? 56.888 -65.001 -131.355 1.00 38.76 ?  109 HOH F O   1 
HETATM 1645 O  O   . HOH S 4 .  ? 55.854 -65.170 -139.305 1.00 40.66 ?  110 HOH F O   1 
HETATM 1646 O  O   . HOH S 4 .  ? 54.541 -63.895 -131.900 1.00 41.39 ?  111 HOH F O   1 
HETATM 1647 O  O   . HOH T 4 .  ? 52.260 -60.141 -111.725 1.00 20.08 ?  201 HOH G O   1 
HETATM 1648 O  O   . HOH T 4 .  ? 48.662 -59.660 -141.020 1.00 37.79 ?  202 HOH G O   1 
HETATM 1649 O  O   . HOH T 4 .  ? 50.831 -70.477 -147.874 1.00 53.79 ?  203 HOH G O   1 
HETATM 1650 O  O   . HOH T 4 .  ? 46.935 -57.282 -115.100 1.00 30.43 ?  204 HOH G O   1 
HETATM 1651 O  O   . HOH T 4 .  ? 42.591 -61.547 -149.015 1.00 36.50 ?  205 HOH G O   1 
HETATM 1652 O  O   . HOH T 4 .  ? 47.499 -60.554 -115.407 1.00 24.98 ?  206 HOH G O   1 
HETATM 1653 O  O   . HOH T 4 .  ? 46.670 -67.150 -112.620 1.00 35.33 ?  207 HOH G O   1 
HETATM 1654 O  O   . HOH T 4 .  ? 50.523 -58.921 -133.718 1.00 42.54 ?  208 HOH G O   1 
HETATM 1655 O  O   . HOH T 4 .  ? 50.280 -64.045 -131.359 1.00 34.86 ?  209 HOH G O   1 
HETATM 1656 O  O   . HOH T 4 .  ? 50.055 -62.734 -138.730 1.00 42.54 ?  210 HOH G O   1 
HETATM 1657 O  O   . HOH T 4 .  ? 51.932 -58.427 -130.818 1.00 36.92 ?  211 HOH G O   1 
HETATM 1658 O  O   . HOH T 4 .  ? 52.898 -59.291 -134.589 1.00 43.02 ?  212 HOH G O   1 
HETATM 1659 O  O   . HOH U 4 .  ? 58.333 -54.367 -115.324 1.00 30.80 ?  101 HOH H O   1 
HETATM 1660 O  O   . HOH U 4 .  ? 55.524 -59.578 -111.700 1.00 16.57 ?  102 HOH H O   1 
HETATM 1661 O  O   . HOH U 4 .  ? 54.163 -53.505 -148.074 1.00 44.32 ?  103 HOH H O   1 
HETATM 1662 O  O   . HOH U 4 .  ? 54.188 -61.377 -125.392 1.00 27.31 ?  104 HOH H O   1 
HETATM 1663 O  O   . HOH U 4 .  ? 56.500 -58.054 -140.865 1.00 41.65 ?  105 HOH H O   1 
HETATM 1664 O  O   . HOH U 4 .  ? 56.747 -57.951 -133.879 1.00 36.09 ?  106 HOH H O   1 
HETATM 1665 O  O   . HOH U 4 .  ? 56.997 -52.100 -146.254 1.00 43.50 ?  107 HOH H O   1 
HETATM 1666 O  O   . HOH U 4 .  ? 53.379 -58.725 -128.966 1.00 43.95 ?  108 HOH H O   1 
HETATM 1667 O  O   . HOH U 4 .  ? 57.638 -58.578 -131.150 1.00 39.09 ?  109 HOH H O   1 
HETATM 1668 O  O   . HOH U 4 .  ? 52.521 -57.551 -139.060 1.00 35.71 ?  110 HOH H O   1 
HETATM 1669 O  O   . HOH U 4 .  ? 54.236 -61.419 -139.296 1.00 42.51 ?  111 HOH H O   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  ACE 1  21 21 ACE ACE A . n 
A 1 2  SER 2  22 22 SER SER A . n 
A 1 3  SER 3  23 23 SER SER A . n 
A 1 4  ASP 4  24 24 ASP ASP A . n 
A 1 5  PRO 5  25 25 PRO PRO A . n 
A 1 6  LEU 6  26 26 LEU LEU A . n 
A 1 7  VAL 7  27 27 VAL VAL A . n 
A 1 8  VAL 8  28 28 VAL VAL A . n 
A 1 9  ALA 9  29 29 ALA ALA A . n 
A 1 10 ALA 10 30 30 ALA ALA A . n 
A 1 11 ASN 11 31 31 ASN ASN A . n 
A 1 12 ILE 12 32 32 ILE ILE A . n 
A 1 13 ILE 13 33 33 ILE ILE A . n 
A 1 14 GLY 14 34 34 GLY GLY A . n 
A 1 15 ILE 15 35 35 ILE ILE A . n 
A 1 16 LEU 16 36 36 LEU LEU A . n 
A 1 17 HIS 17 37 37 HIS HIS A . n 
A 1 18 LEU 18 38 38 LEU LEU A . n 
A 1 19 ILE 19 39 39 ILE ILE A . n 
A 1 20 LEU 20 40 40 LEU LEU A . n 
A 1 21 TRP 21 41 41 TRP TRP A . n 
A 1 22 ILE 22 42 42 ILE ILE A . n 
A 1 23 LEU 23 43 43 LEU LEU A . n 
A 1 24 ASP 24 44 44 ASP ASP A . n 
A 1 25 ARG 25 45 45 ARG ARG A . n 
A 1 26 LEU 26 46 46 LEU LEU A . n 
A 1 27 NH2 27 47 47 NH2 NH2 A . n 
B 1 1  ACE 1  21 21 ACE ACE B . n 
B 1 2  SER 2  22 22 SER SER B . n 
B 1 3  SER 3  23 23 SER SER B . n 
B 1 4  ASP 4  24 24 ASP ASP B . n 
B 1 5  PRO 5  25 25 PRO PRO B . n 
B 1 6  LEU 6  26 26 LEU LEU B . n 
B 1 7  VAL 7  27 27 VAL VAL B . n 
B 1 8  VAL 8  28 28 VAL VAL B . n 
B 1 9  ALA 9  29 29 ALA ALA B . n 
B 1 10 ALA 10 30 30 ALA ALA B . n 
B 1 11 ASN 11 31 31 ASN ASN B . n 
B 1 12 ILE 12 32 32 ILE ILE B . n 
B 1 13 ILE 13 33 33 ILE ILE B . n 
B 1 14 GLY 14 34 34 GLY GLY B . n 
B 1 15 ILE 15 35 35 ILE ILE B . n 
B 1 16 LEU 16 36 36 LEU LEU B . n 
B 1 17 HIS 17 37 37 HIS HIS B . n 
B 1 18 LEU 18 38 38 LEU LEU B . n 
B 1 19 ILE 19 39 39 ILE ILE B . n 
B 1 20 LEU 20 40 40 LEU LEU B . n 
B 1 21 TRP 21 41 41 TRP TRP B . n 
B 1 22 ILE 22 42 42 ILE ILE B . n 
B 1 23 LEU 23 43 43 LEU LEU B . n 
B 1 24 ASP 24 44 44 ASP ASP B . n 
B 1 25 ARG 25 45 45 ARG ARG B . n 
B 1 26 LEU 26 46 46 LEU LEU B . n 
B 1 27 NH2 27 47 47 NH2 NH2 B . n 
C 1 1  ACE 1  21 21 ACE ACE C . n 
C 1 2  SER 2  22 22 SER SER C . n 
C 1 3  SER 3  23 23 SER SER C . n 
C 1 4  ASP 4  24 24 ASP ASP C . n 
C 1 5  PRO 5  25 25 PRO PRO C . n 
C 1 6  LEU 6  26 26 LEU LEU C . n 
C 1 7  VAL 7  27 27 VAL VAL C . n 
C 1 8  VAL 8  28 28 VAL VAL C . n 
C 1 9  ALA 9  29 29 ALA ALA C . n 
C 1 10 ALA 10 30 30 ALA ALA C . n 
C 1 11 ASN 11 31 31 ASN ASN C . n 
C 1 12 ILE 12 32 32 ILE ILE C . n 
C 1 13 ILE 13 33 33 ILE ILE C . n 
C 1 14 GLY 14 34 34 GLY GLY C . n 
C 1 15 ILE 15 35 35 ILE ILE C . n 
C 1 16 LEU 16 36 36 LEU LEU C . n 
C 1 17 HIS 17 37 37 HIS HIS C . n 
C 1 18 LEU 18 38 38 LEU LEU C . n 
C 1 19 ILE 19 39 39 ILE ILE C . n 
C 1 20 LEU 20 40 40 LEU LEU C . n 
C 1 21 TRP 21 41 41 TRP TRP C . n 
C 1 22 ILE 22 42 42 ILE ILE C . n 
C 1 23 LEU 23 43 43 LEU LEU C . n 
C 1 24 ASP 24 44 44 ASP ASP C . n 
C 1 25 ARG 25 45 45 ARG ARG C . n 
C 1 26 LEU 26 46 46 LEU LEU C . n 
C 1 27 NH2 27 47 47 NH2 NH2 C . n 
D 1 1  ACE 1  21 21 ACE ACE D . n 
D 1 2  SER 2  22 22 SER SER D . n 
D 1 3  SER 3  23 23 SER SER D . n 
D 1 4  ASP 4  24 24 ASP ASP D . n 
D 1 5  PRO 5  25 25 PRO PRO D . n 
D 1 6  LEU 6  26 26 LEU LEU D . n 
D 1 7  VAL 7  27 27 VAL VAL D . n 
D 1 8  VAL 8  28 28 VAL VAL D . n 
D 1 9  ALA 9  29 29 ALA ALA D . n 
D 1 10 ALA 10 30 30 ALA ALA D . n 
D 1 11 ASN 11 31 31 ASN ASN D . n 
D 1 12 ILE 12 32 32 ILE ILE D . n 
D 1 13 ILE 13 33 33 ILE ILE D . n 
D 1 14 GLY 14 34 34 GLY GLY D . n 
D 1 15 ILE 15 35 35 ILE ILE D . n 
D 1 16 LEU 16 36 36 LEU LEU D . n 
D 1 17 HIS 17 37 37 HIS HIS D . n 
D 1 18 LEU 18 38 38 LEU LEU D . n 
D 1 19 ILE 19 39 39 ILE ILE D . n 
D 1 20 LEU 20 40 40 LEU LEU D . n 
D 1 21 TRP 21 41 41 TRP TRP D . n 
D 1 22 ILE 22 42 42 ILE ILE D . n 
D 1 23 LEU 23 43 43 LEU LEU D . n 
D 1 24 ASP 24 44 44 ASP ASP D . n 
D 1 25 ARG 25 45 45 ARG ARG D . n 
D 1 26 LEU 26 46 46 LEU LEU D . n 
D 1 27 NH2 27 47 47 NH2 NH2 D . n 
E 1 1  ACE 1  21 21 ACE ACE E . n 
E 1 2  SER 2  22 22 SER SER E . n 
E 1 3  SER 3  23 23 SER SER E . n 
E 1 4  ASP 4  24 24 ASP ASP E . n 
E 1 5  PRO 5  25 25 PRO PRO E . n 
E 1 6  LEU 6  26 26 LEU LEU E . n 
E 1 7  VAL 7  27 27 VAL VAL E . n 
E 1 8  VAL 8  28 28 VAL VAL E . n 
E 1 9  ALA 9  29 29 ALA ALA E . n 
E 1 10 ALA 10 30 30 ALA ALA E . n 
E 1 11 ASN 11 31 31 ASN ASN E . n 
E 1 12 ILE 12 32 32 ILE ILE E . n 
E 1 13 ILE 13 33 33 ILE ILE E . n 
E 1 14 GLY 14 34 34 GLY GLY E . n 
E 1 15 ILE 15 35 35 ILE ILE E . n 
E 1 16 LEU 16 36 36 LEU LEU E . n 
E 1 17 HIS 17 37 37 HIS HIS E . n 
E 1 18 LEU 18 38 38 LEU LEU E . n 
E 1 19 ILE 19 39 39 ILE ILE E . n 
E 1 20 LEU 20 40 40 LEU LEU E . n 
E 1 21 TRP 21 41 41 TRP TRP E . n 
E 1 22 ILE 22 42 42 ILE ILE E . n 
E 1 23 LEU 23 43 43 LEU LEU E . n 
E 1 24 ASP 24 44 44 ASP ASP E . n 
E 1 25 ARG 25 45 45 ARG ARG E . n 
E 1 26 LEU 26 46 46 LEU LEU E . n 
E 1 27 NH2 27 47 47 NH2 NH2 E . n 
F 1 1  ACE 1  21 21 ACE ACE F . n 
F 1 2  SER 2  22 22 SER SER F . n 
F 1 3  SER 3  23 23 SER SER F . n 
F 1 4  ASP 4  24 24 ASP ASP F . n 
F 1 5  PRO 5  25 25 PRO PRO F . n 
F 1 6  LEU 6  26 26 LEU LEU F . n 
F 1 7  VAL 7  27 27 VAL VAL F . n 
F 1 8  VAL 8  28 28 VAL VAL F . n 
F 1 9  ALA 9  29 29 ALA ALA F . n 
F 1 10 ALA 10 30 30 ALA ALA F . n 
F 1 11 ASN 11 31 31 ASN ASN F . n 
F 1 12 ILE 12 32 32 ILE ILE F . n 
F 1 13 ILE 13 33 33 ILE ILE F . n 
F 1 14 GLY 14 34 34 GLY GLY F . n 
F 1 15 ILE 15 35 35 ILE ILE F . n 
F 1 16 LEU 16 36 36 LEU LEU F . n 
F 1 17 HIS 17 37 37 HIS HIS F . n 
F 1 18 LEU 18 38 38 LEU LEU F . n 
F 1 19 ILE 19 39 39 ILE ILE F . n 
F 1 20 LEU 20 40 40 LEU LEU F . n 
F 1 21 TRP 21 41 41 TRP TRP F . n 
F 1 22 ILE 22 42 42 ILE ILE F . n 
F 1 23 LEU 23 43 43 LEU LEU F . n 
F 1 24 ASP 24 44 44 ASP ASP F . n 
F 1 25 ARG 25 45 45 ARG ARG F . n 
F 1 26 LEU 26 46 46 LEU LEU F . n 
F 1 27 NH2 27 47 47 NH2 NH2 F . n 
G 1 1  ACE 1  21 21 ACE ACE G . n 
G 1 2  SER 2  22 22 SER SER G . n 
G 1 3  SER 3  23 23 SER SER G . n 
G 1 4  ASP 4  24 24 ASP ASP G . n 
G 1 5  PRO 5  25 25 PRO PRO G . n 
G 1 6  LEU 6  26 26 LEU LEU G . n 
G 1 7  VAL 7  27 27 VAL VAL G . n 
G 1 8  VAL 8  28 28 VAL VAL G . n 
G 1 9  ALA 9  29 29 ALA ALA G . n 
G 1 10 ALA 10 30 30 ALA ALA G . n 
G 1 11 ASN 11 31 31 ASN ASN G . n 
G 1 12 ILE 12 32 32 ILE ILE G . n 
G 1 13 ILE 13 33 33 ILE ILE G . n 
G 1 14 GLY 14 34 34 GLY GLY G . n 
G 1 15 ILE 15 35 35 ILE ILE G . n 
G 1 16 LEU 16 36 36 LEU LEU G . n 
G 1 17 HIS 17 37 37 HIS HIS G . n 
G 1 18 LEU 18 38 38 LEU LEU G . n 
G 1 19 ILE 19 39 39 ILE ILE G . n 
G 1 20 LEU 20 40 40 LEU LEU G . n 
G 1 21 TRP 21 41 41 TRP TRP G . n 
G 1 22 ILE 22 42 42 ILE ILE G . n 
G 1 23 LEU 23 43 43 LEU LEU G . n 
G 1 24 ASP 24 44 44 ASP ASP G . n 
G 1 25 ARG 25 45 45 ARG ARG G . n 
G 1 26 LEU 26 46 46 LEU LEU G . n 
G 1 27 NH2 27 47 47 NH2 NH2 G . n 
H 1 1  ACE 1  21 21 ACE ACE H . n 
H 1 2  SER 2  22 22 SER SER H . n 
H 1 3  SER 3  23 23 SER SER H . n 
H 1 4  ASP 4  24 24 ASP ASP H . n 
H 1 5  PRO 5  25 25 PRO PRO H . n 
H 1 6  LEU 6  26 26 LEU LEU H . n 
H 1 7  VAL 7  27 27 VAL VAL H . n 
H 1 8  VAL 8  28 28 VAL VAL H . n 
H 1 9  ALA 9  29 29 ALA ALA H . n 
H 1 10 ALA 10 30 30 ALA ALA H . n 
H 1 11 ASN 11 31 31 ASN ASN H . n 
H 1 12 ILE 12 32 32 ILE ILE H . n 
H 1 13 ILE 13 33 33 ILE ILE H . n 
H 1 14 GLY 14 34 34 GLY GLY H . n 
H 1 15 ILE 15 35 35 ILE ILE H . n 
H 1 16 LEU 16 36 36 LEU LEU H . n 
H 1 17 HIS 17 37 37 HIS HIS H . n 
H 1 18 LEU 18 38 38 LEU LEU H . n 
H 1 19 ILE 19 39 39 ILE ILE H . n 
H 1 20 LEU 20 40 40 LEU LEU H . n 
H 1 21 TRP 21 41 41 TRP TRP H . n 
H 1 22 ILE 22 42 42 ILE ILE H . n 
H 1 23 LEU 23 43 43 LEU LEU H . n 
H 1 24 ASP 24 44 44 ASP ASP H . n 
H 1 25 ARG 25 45 45 ARG ARG H . n 
H 1 26 LEU 26 46 46 LEU LEU H . n 
H 1 27 NH2 27 47 47 NH2 NH2 H . 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 author_and_software_defined_assembly PISA tetrameric 4 
2 author_and_software_defined_assembly PISA tetrameric 4 
# 
loop_
_pdbx_struct_assembly_gen.assembly_id 
_pdbx_struct_assembly_gen.oper_expression 
_pdbx_struct_assembly_gen.asym_id_list 
1 1 A,B,C,D,I,J,K,N,O,P,Q 
2 1 E,F,G,H,L,M,R,S,T,U   
# 
loop_
_pdbx_struct_assembly_prop.biol_id 
_pdbx_struct_assembly_prop.type 
_pdbx_struct_assembly_prop.value 
_pdbx_struct_assembly_prop.details 
1 'ABSA (A^2)' 4870 ? 
1 MORE         -52  ? 
1 'SSA (A^2)'  6680 ? 
2 'ABSA (A^2)' 3650 ? 
2 MORE         -26  ? 
2 'SSA (A^2)'  7610 ? 
# 
_pdbx_struct_oper_list.id                   1 
_pdbx_struct_oper_list.type                 'identity operation' 
_pdbx_struct_oper_list.name                 1_555 
_pdbx_struct_oper_list.symmetry_operation   x,y,z 
_pdbx_struct_oper_list.matrix[1][1]         1.0000000000 
_pdbx_struct_oper_list.matrix[1][2]         0.0000000000 
_pdbx_struct_oper_list.matrix[1][3]         0.0000000000 
_pdbx_struct_oper_list.vector[1]            0.0000000000 
_pdbx_struct_oper_list.matrix[2][1]         0.0000000000 
_pdbx_struct_oper_list.matrix[2][2]         1.0000000000 
_pdbx_struct_oper_list.matrix[2][3]         0.0000000000 
_pdbx_struct_oper_list.vector[2]            0.0000000000 
_pdbx_struct_oper_list.matrix[3][1]         0.0000000000 
_pdbx_struct_oper_list.matrix[3][2]         0.0000000000 
_pdbx_struct_oper_list.matrix[3][3]         1.0000000000 
_pdbx_struct_oper_list.vector[3]            0.0000000000 
# 
loop_
_pdbx_struct_conn_angle.id 
_pdbx_struct_conn_angle.ptnr1_label_atom_id 
_pdbx_struct_conn_angle.ptnr1_label_alt_id 
_pdbx_struct_conn_angle.ptnr1_label_asym_id 
_pdbx_struct_conn_angle.ptnr1_label_comp_id 
_pdbx_struct_conn_angle.ptnr1_label_seq_id 
_pdbx_struct_conn_angle.ptnr1_auth_atom_id 
_pdbx_struct_conn_angle.ptnr1_auth_asym_id 
_pdbx_struct_conn_angle.ptnr1_auth_comp_id 
_pdbx_struct_conn_angle.ptnr1_auth_seq_id 
_pdbx_struct_conn_angle.ptnr1_PDB_ins_code 
_pdbx_struct_conn_angle.ptnr1_symmetry 
_pdbx_struct_conn_angle.ptnr2_label_atom_id 
_pdbx_struct_conn_angle.ptnr2_label_alt_id 
_pdbx_struct_conn_angle.ptnr2_label_asym_id 
_pdbx_struct_conn_angle.ptnr2_label_comp_id 
_pdbx_struct_conn_angle.ptnr2_label_seq_id 
_pdbx_struct_conn_angle.ptnr2_auth_atom_id 
_pdbx_struct_conn_angle.ptnr2_auth_asym_id 
_pdbx_struct_conn_angle.ptnr2_auth_comp_id 
_pdbx_struct_conn_angle.ptnr2_auth_seq_id 
_pdbx_struct_conn_angle.ptnr2_PDB_ins_code 
_pdbx_struct_conn_angle.ptnr2_symmetry 
_pdbx_struct_conn_angle.ptnr3_label_atom_id 
_pdbx_struct_conn_angle.ptnr3_label_alt_id 
_pdbx_struct_conn_angle.ptnr3_label_asym_id 
_pdbx_struct_conn_angle.ptnr3_label_comp_id 
_pdbx_struct_conn_angle.ptnr3_label_seq_id 
_pdbx_struct_conn_angle.ptnr3_auth_atom_id 
_pdbx_struct_conn_angle.ptnr3_auth_asym_id 
_pdbx_struct_conn_angle.ptnr3_auth_comp_id 
_pdbx_struct_conn_angle.ptnr3_auth_seq_id 
_pdbx_struct_conn_angle.ptnr3_PDB_ins_code 
_pdbx_struct_conn_angle.ptnr3_symmetry 
_pdbx_struct_conn_angle.value 
_pdbx_struct_conn_angle.value_esd 
1  O   ? A ASP 24 ? A ASP 44  ? 1_555 CA ? I CA . ? A CA 101 ? 1_555 OD1 ? A ASP 24 ? A ASP 44  ? 1_555 62.8  ? 
2  O   ? A ASP 24 ? A ASP 44  ? 1_555 CA ? I CA . ? A CA 101 ? 1_555 O   ? P HOH .  ? C HOH 101 ? 2_541 114.1 ? 
3  OD1 ? A ASP 24 ? A ASP 44  ? 1_555 CA ? I CA . ? A CA 101 ? 1_555 O   ? P HOH .  ? C HOH 101 ? 2_541 145.1 ? 
4  O   ? B ASP 24 ? B ASP 44  ? 1_555 CA ? J CA . ? B CA 101 ? 1_555 OD1 ? B ASP 24 ? B ASP 44  ? 1_555 69.4  ? 
5  O   ? B ASP 24 ? B ASP 44  ? 1_555 CA ? J CA . ? B CA 101 ? 1_555 O   ? O HOH .  ? B HOH 206 ? 1_555 87.2  ? 
6  OD1 ? B ASP 24 ? B ASP 44  ? 1_555 CA ? J CA . ? B CA 101 ? 1_555 O   ? O HOH .  ? B HOH 206 ? 1_555 156.5 ? 
7  O   ? B ASP 24 ? B ASP 44  ? 1_555 CA ? J CA . ? B CA 101 ? 1_555 O   ? O HOH .  ? B HOH 205 ? 1_555 73.7  ? 
8  OD1 ? B ASP 24 ? B ASP 44  ? 1_555 CA ? J CA . ? B CA 101 ? 1_555 O   ? O HOH .  ? B HOH 205 ? 1_555 113.3 ? 
9  O   ? O HOH .  ? B HOH 206 ? 1_555 CA ? J CA . ? B CA 101 ? 1_555 O   ? O HOH .  ? B HOH 205 ? 1_555 60.0  ? 
10 O   ? B ASP 24 ? B ASP 44  ? 1_555 CA ? J CA . ? B CA 101 ? 1_555 O   ? T HOH .  ? G HOH 205 ? 2_551 79.9  ? 
11 OD1 ? B ASP 24 ? B ASP 44  ? 1_555 CA ? J CA . ? B CA 101 ? 1_555 O   ? T HOH .  ? G HOH 205 ? 2_551 73.7  ? 
12 O   ? O HOH .  ? B HOH 206 ? 1_555 CA ? J CA . ? B CA 101 ? 1_555 O   ? T HOH .  ? G HOH 205 ? 2_551 100.3 ? 
13 O   ? O HOH .  ? B HOH 205 ? 1_555 CA ? J CA . ? B CA 101 ? 1_555 O   ? T HOH .  ? G HOH 205 ? 2_551 147.2 ? 
14 O   ? D ASP 24 ? D ASP 44  ? 1_555 CA ? K CA . ? D CA 101 ? 1_555 OD1 ? D ASP 24 ? D ASP 44  ? 1_555 81.3  ? 
15 O   ? D ASP 24 ? D ASP 44  ? 1_555 CA ? K CA . ? D CA 101 ? 1_555 O   ? Q HOH .  ? D HOH 205 ? 1_555 81.4  ? 
16 OD1 ? D ASP 24 ? D ASP 44  ? 1_555 CA ? K CA . ? D CA 101 ? 1_555 O   ? Q HOH .  ? D HOH 205 ? 1_555 162.1 ? 
17 O   ? D ASP 24 ? D ASP 44  ? 1_555 CA ? K CA . ? D CA 101 ? 1_555 O   ? Q HOH .  ? D HOH 204 ? 1_555 70.8  ? 
18 OD1 ? D ASP 24 ? D ASP 44  ? 1_555 CA ? K CA . ? D CA 101 ? 1_555 O   ? Q HOH .  ? D HOH 204 ? 1_555 103.8 ? 
19 O   ? Q HOH .  ? D HOH 205 ? 1_555 CA ? K CA . ? D CA 101 ? 1_555 O   ? Q HOH .  ? D HOH 204 ? 1_555 65.9  ? 
20 O   ? E SER 2  ? E SER 22  ? 1_555 CA ? L CA . ? E CA 101 ? 1_555 O   ? F SER 2  ? F SER 22  ? 1_555 80.7  ? 
21 O   ? E SER 2  ? E SER 22  ? 1_555 CA ? L CA . ? E CA 101 ? 1_555 O   ? G SER 2  ? G SER 22  ? 1_555 127.3 ? 
22 O   ? F SER 2  ? F SER 22  ? 1_555 CA ? L CA . ? E CA 101 ? 1_555 O   ? G SER 2  ? G SER 22  ? 1_555 76.4  ? 
23 O   ? E SER 2  ? E SER 22  ? 1_555 CA ? L CA . ? E CA 101 ? 1_555 O   ? H SER 2  ? H SER 22  ? 1_555 79.3  ? 
24 O   ? F SER 2  ? F SER 22  ? 1_555 CA ? L CA . ? E CA 101 ? 1_555 O   ? H SER 2  ? H SER 22  ? 1_555 132.5 ? 
25 O   ? G SER 2  ? G SER 22  ? 1_555 CA ? L CA . ? E CA 101 ? 1_555 O   ? H SER 2  ? H SER 22  ? 1_555 82.4  ? 
26 O   ? E SER 2  ? E SER 22  ? 1_555 CA ? L CA . ? E CA 101 ? 1_555 O   ? S HOH .  ? F HOH 101 ? 1_555 141.0 ? 
27 O   ? F SER 2  ? F SER 22  ? 1_555 CA ? L CA . ? E CA 101 ? 1_555 O   ? S HOH .  ? F HOH 101 ? 1_555 70.2  ? 
28 O   ? G SER 2  ? G SER 22  ? 1_555 CA ? L CA . ? E CA 101 ? 1_555 O   ? S HOH .  ? F HOH 101 ? 1_555 70.7  ? 
29 O   ? H SER 2  ? H SER 22  ? 1_555 CA ? L CA . ? E CA 101 ? 1_555 O   ? S HOH .  ? F HOH 101 ? 1_555 139.7 ? 
30 O   ? E SER 2  ? E SER 22  ? 1_555 CA ? L CA . ? E CA 101 ? 1_555 O   ? R HOH .  ? E HOH 201 ? 1_555 81.2  ? 
31 O   ? F SER 2  ? F SER 22  ? 1_555 CA ? L CA . ? E CA 101 ? 1_555 O   ? R HOH .  ? E HOH 201 ? 1_555 73.8  ? 
32 O   ? G SER 2  ? G SER 22  ? 1_555 CA ? L CA . ? E CA 101 ? 1_555 O   ? R HOH .  ? E HOH 201 ? 1_555 133.9 ? 
33 O   ? H SER 2  ? H SER 22  ? 1_555 CA ? L CA . ? E CA 101 ? 1_555 O   ? R HOH .  ? E HOH 201 ? 1_555 143.0 ? 
34 O   ? S HOH .  ? F HOH 101 ? 1_555 CA ? L CA . ? E CA 101 ? 1_555 O   ? R HOH .  ? E HOH 201 ? 1_555 66.5  ? 
35 O   ? E SER 2  ? E SER 22  ? 1_555 CA ? L CA . ? E CA 101 ? 1_555 O   ? T HOH .  ? G HOH 201 ? 1_555 142.7 ? 
36 O   ? F SER 2  ? F SER 22  ? 1_555 CA ? L CA . ? E CA 101 ? 1_555 O   ? T HOH .  ? G HOH 201 ? 1_555 136.5 ? 
37 O   ? G SER 2  ? G SER 22  ? 1_555 CA ? L CA . ? E CA 101 ? 1_555 O   ? T HOH .  ? G HOH 201 ? 1_555 73.1  ? 
38 O   ? H SER 2  ? H SER 22  ? 1_555 CA ? L CA . ? E CA 101 ? 1_555 O   ? T HOH .  ? G HOH 201 ? 1_555 72.8  ? 
39 O   ? S HOH .  ? F HOH 101 ? 1_555 CA ? L CA . ? E CA 101 ? 1_555 O   ? T HOH .  ? G HOH 201 ? 1_555 70.9  ? 
40 O   ? R HOH .  ? E HOH 201 ? 1_555 CA ? L CA . ? E CA 101 ? 1_555 O   ? T HOH .  ? G HOH 201 ? 1_555 107.1 ? 
41 O   ? E SER 2  ? E SER 22  ? 1_555 CA ? L CA . ? E CA 101 ? 1_555 O   ? U HOH .  ? H HOH 102 ? 1_555 74.2  ? 
42 O   ? F SER 2  ? F SER 22  ? 1_555 CA ? L CA . ? E CA 101 ? 1_555 O   ? U HOH .  ? H HOH 102 ? 1_555 140.1 ? 
43 O   ? G SER 2  ? G SER 22  ? 1_555 CA ? L CA . ? E CA 101 ? 1_555 O   ? U HOH .  ? H HOH 102 ? 1_555 143.4 ? 
44 O   ? H SER 2  ? H SER 22  ? 1_555 CA ? L CA . ? E CA 101 ? 1_555 O   ? U HOH .  ? H HOH 102 ? 1_555 72.6  ? 
45 O   ? S HOH .  ? F HOH 101 ? 1_555 CA ? L CA . ? E CA 101 ? 1_555 O   ? U HOH .  ? H HOH 102 ? 1_555 113.0 ? 
46 O   ? R HOH .  ? E HOH 201 ? 1_555 CA ? L CA . ? E CA 101 ? 1_555 O   ? U HOH .  ? H HOH 102 ? 1_555 72.0  ? 
47 O   ? T HOH .  ? G HOH 201 ? 1_555 CA ? L CA . ? E CA 101 ? 1_555 O   ? U HOH .  ? H HOH 102 ? 1_555 74.2  ? 
# 
loop_
_software.citation_id 
_software.classification 
_software.compiler_name 
_software.compiler_version 
_software.contact_author 
_software.contact_author_email 
_software.date 
_software.description 
_software.dependencies 
_software.hardware 
_software.language 
_software.location 
_software.mods 
_software.name 
_software.os 
_software.os_version 
_software.type 
_software.version 
_software.pdbx_ordinal 
? refinement       ? ? ? ? ? ? ? ? ? ? ? PHENIX  ? ? ? '(1.11.1_2575: ???)' 1 
? 'data reduction' ? ? ? ? ? ? ? ? ? ? ? iMOSFLM ? ? ? .                    2 
? 'data scaling'   ? ? ? ? ? ? ? ? ? ? ? Aimless ? ? ? .                    3 
? phasing          ? ? ? ? ? ? ? ? ? ? ? PHASER  ? ? ? .                    4 
# 
loop_
_pdbx_validate_close_contact.id 
_pdbx_validate_close_contact.PDB_model_num 
_pdbx_validate_close_contact.auth_atom_id_1 
_pdbx_validate_close_contact.auth_asym_id_1 
_pdbx_validate_close_contact.auth_comp_id_1 
_pdbx_validate_close_contact.auth_seq_id_1 
_pdbx_validate_close_contact.PDB_ins_code_1 
_pdbx_validate_close_contact.label_alt_id_1 
_pdbx_validate_close_contact.auth_atom_id_2 
_pdbx_validate_close_contact.auth_asym_id_2 
_pdbx_validate_close_contact.auth_comp_id_2 
_pdbx_validate_close_contact.auth_seq_id_2 
_pdbx_validate_close_contact.PDB_ins_code_2 
_pdbx_validate_close_contact.label_alt_id_2 
_pdbx_validate_close_contact.dist 
1 1 O   A HOH 203 ? ? O A HOH 205 ? ? 0.27 
2 1 OD2 B ASP 24  ? ? O B HOH 201 ? ? 2.14 
3 1 O   F HOH 105 ? ? O G HOH 209 ? ? 2.19 
# 
loop_
_pdbx_distant_solvent_atoms.id 
_pdbx_distant_solvent_atoms.PDB_model_num 
_pdbx_distant_solvent_atoms.auth_atom_id 
_pdbx_distant_solvent_atoms.label_alt_id 
_pdbx_distant_solvent_atoms.auth_asym_id 
_pdbx_distant_solvent_atoms.auth_comp_id 
_pdbx_distant_solvent_atoms.auth_seq_id 
_pdbx_distant_solvent_atoms.PDB_ins_code 
_pdbx_distant_solvent_atoms.neighbor_macromolecule_distance 
_pdbx_distant_solvent_atoms.neighbor_ligand_distance 
1 1 O ? E HOH 210 ? 6.60 . 
2 1 O ? H HOH 111 ? 5.92 . 
# 
_pdbx_audit_support.funding_organization   'National Institutes of Health/National Human Genome Research Institute' 
_pdbx_audit_support.country                'United States' 
_pdbx_audit_support.grant_number           ? 
_pdbx_audit_support.ordinal                1 
# 
loop_
_pdbx_entity_nonpoly.entity_id 
_pdbx_entity_nonpoly.name 
_pdbx_entity_nonpoly.comp_id 
2 'CALCIUM ION'  CA  
3 'CHLORIDE ION' CL  
4 water          HOH 
# 
_pdbx_struct_assembly_auth_evidence.id                     1 
_pdbx_struct_assembly_auth_evidence.assembly_id            1 
_pdbx_struct_assembly_auth_evidence.experimental_support   none 
_pdbx_struct_assembly_auth_evidence.details                
;Inward(closed) conformation: chains A,B,C,D
Inward(open) conformation: chains E,F,G,H
;
# 
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 
I 2 CA  1  101 5  CA  CA  A . 
J 2 CA  1  101 4  CA  CA  B . 
K 2 CA  1  101 2  CA  CA  D . 
L 2 CA  1  101 1  CA  CA  E . 
M 3 CL  1  101 1  CL  CL  G . 
N 4 HOH 1  201 3  HOH HOH A . 
N 4 HOH 2  202 30 HOH HOH A . 
N 4 HOH 3  203 71 HOH HOH A . 
N 4 HOH 4  204 26 HOH HOH A . 
N 4 HOH 5  205 13 HOH HOH A . 
N 4 HOH 6  206 25 HOH HOH A . 
N 4 HOH 7  207 12 HOH HOH A . 
N 4 HOH 8  208 58 HOH HOH A . 
O 4 HOH 1  201 27 HOH HOH B . 
O 4 HOH 2  202 7  HOH HOH B . 
O 4 HOH 3  203 15 HOH HOH B . 
O 4 HOH 4  204 52 HOH HOH B . 
O 4 HOH 5  205 41 HOH HOH B . 
O 4 HOH 6  206 72 HOH HOH B . 
O 4 HOH 7  207 39 HOH HOH B . 
O 4 HOH 8  208 83 HOH HOH B . 
O 4 HOH 9  209 37 HOH HOH B . 
O 4 HOH 10 210 85 HOH HOH B . 
P 4 HOH 1  101 91 HOH HOH C . 
P 4 HOH 2  102 21 HOH HOH C . 
P 4 HOH 3  103 1  HOH HOH C . 
P 4 HOH 4  104 28 HOH HOH C . 
P 4 HOH 5  105 11 HOH HOH C . 
P 4 HOH 6  106 44 HOH HOH C . 
P 4 HOH 7  107 54 HOH HOH C . 
P 4 HOH 8  108 65 HOH HOH C . 
Q 4 HOH 1  201 6  HOH HOH D . 
Q 4 HOH 2  202 8  HOH HOH D . 
Q 4 HOH 3  203 29 HOH HOH D . 
Q 4 HOH 4  204 22 HOH HOH D . 
Q 4 HOH 5  205 90 HOH HOH D . 
Q 4 HOH 6  206 57 HOH HOH D . 
Q 4 HOH 7  207 87 HOH HOH D . 
Q 4 HOH 8  208 86 HOH HOH D . 
Q 4 HOH 9  209 38 HOH HOH D . 
Q 4 HOH 10 210 84 HOH HOH D . 
R 4 HOH 1  201 4  HOH HOH E . 
R 4 HOH 2  202 16 HOH HOH E . 
R 4 HOH 3  203 78 HOH HOH E . 
R 4 HOH 4  204 69 HOH HOH E . 
R 4 HOH 5  205 89 HOH HOH E . 
R 4 HOH 6  206 45 HOH HOH E . 
R 4 HOH 7  207 79 HOH HOH E . 
R 4 HOH 8  208 51 HOH HOH E . 
R 4 HOH 9  209 59 HOH HOH E . 
R 4 HOH 10 210 53 HOH HOH E . 
S 4 HOH 1  101 9  HOH HOH F . 
S 4 HOH 2  102 36 HOH HOH F . 
S 4 HOH 3  103 67 HOH HOH F . 
S 4 HOH 4  104 61 HOH HOH F . 
S 4 HOH 5  105 49 HOH HOH F . 
S 4 HOH 6  106 48 HOH HOH F . 
S 4 HOH 7  107 66 HOH HOH F . 
S 4 HOH 8  108 32 HOH HOH F . 
S 4 HOH 9  109 46 HOH HOH F . 
S 4 HOH 10 110 77 HOH HOH F . 
S 4 HOH 11 111 56 HOH HOH F . 
T 4 HOH 1  201 10 HOH HOH G . 
T 4 HOH 2  202 23 HOH HOH G . 
T 4 HOH 3  203 64 HOH HOH G . 
T 4 HOH 4  204 18 HOH HOH G . 
T 4 HOH 5  205 24 HOH HOH G . 
T 4 HOH 6  206 17 HOH HOH G . 
T 4 HOH 7  207 40 HOH HOH G . 
T 4 HOH 8  208 76 HOH HOH G . 
T 4 HOH 9  209 31 HOH HOH G . 
T 4 HOH 10 210 68 HOH HOH G . 
T 4 HOH 11 211 33 HOH HOH G . 
T 4 HOH 12 212 88 HOH HOH G . 
U 4 HOH 1  101 20 HOH HOH H . 
U 4 HOH 2  102 5  HOH HOH H . 
U 4 HOH 3  103 43 HOH HOH H . 
U 4 HOH 4  104 14 HOH HOH H . 
U 4 HOH 5  105 80 HOH HOH H . 
U 4 HOH 6  106 47 HOH HOH H . 
U 4 HOH 7  107 73 HOH HOH H . 
U 4 HOH 8  108 34 HOH HOH H . 
U 4 HOH 9  109 42 HOH HOH H . 
U 4 HOH 10 110 81 HOH HOH H . 
U 4 HOH 11 111 82 HOH HOH H . 
# 
