data_c25189_2mtw ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID c25189_2mtw _Entry.Title ; Evidence supporting the hypothesis that specifically modifying a malaria peptide to fit into HLA-DR 1*03 molecules induces antibody production and protection ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2014-09-01 _Entry.Accession_date 2014-09-01 _Entry.Last_release_date 2014-10-07 _Entry.Original_release_date 2014-10-07 _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.Entry_ID 1 Gladys Cifuentes . . . c25189_2mtw 2 'Luz Mary' Salazar . . . c25189_2mtw 3 'Luis Eduardo' Vargas . . . c25189_2mtw 4 'Carlos Alberto' Parra . . . c25189_2mtw 5 Magnolia Vanegas . . . c25189_2mtw 6 Jimena Cortes . . . c25189_2mtw 7 'Manuel Elkin' Patarroyo . . . c25189_2mtw stop_ loop_ _SG_project.SG_project_ID _SG_project.Project_name _SG_project.Full_name_of_center _SG_project.Initial_of_center _SG_project.Entry_ID 1 'not applicable' 'not applicable' . c25189_2mtw stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID peptide . c25189_2mtw EBA-175 . c25189_2mtw NMR . c25189_2mtw stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 c25189_2mtw stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '1H chemical shifts' 123 c25189_2mtw stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 1 . . 2014-10-07 2014-09-01 original author . c25189_2mtw stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 2MTW 'BMRB Entry Tracking System' c25189_2mtw BMRB 25190 'malaria short AMA-1 peptide analogue' c25189_2mtw stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID c25189_2mtw _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 15694510 _Citation.Full_citation . _Citation.Title 'Evidence supporting the hypothesis that specifically modifying a malaria peptide to fit HLA-DR 1*03 molecules induces antibody production and protection' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev Vaccine _Citation.Journal_name_full . _Citation.Journal_volume . _Citation.Journal_issue . _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first . _Citation.Page_last . _Citation.Year 2014 _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Gladys Cifuentes G. . . c25189_2mtw 1 2 'Luz Mary' Salazar L. M. . c25189_2mtw 1 3 'Luis Eduardo' Vargas L. E. . c25189_2mtw 1 4 'Carlos Alberto' Parra C. A. . c25189_2mtw 1 5 Magnolia Vanegas M. . . c25189_2mtw 1 6 Jimena Cortes J. . . c25189_2mtw 1 7 'Manuel Elkin' Patarroyo M. E. . c25189_2mtw 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID c25189_2mtw _Assembly.ID 1 _Assembly.Name 'malaria peptide 1815' _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 entity 1 $entity A . yes native no no . . . c25189_2mtw 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity _Entity.Sf_category entity _Entity.Sf_framecode entity _Entity.Entry_ID c25189_2mtw _Entity.ID 1 _Entity.BMRB_code . _Entity.Name entity _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID A _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code YTNQNINISQERDLQKHGFH _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 20 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method man _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 2446.658 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-01-29 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 no EMBL CAA36756 . 'EBA-175 protein [Plasmodium falciparum]' . . . . . 95.00 1435 100.00 100.00 4.76e-03 . . . . c25189_2mtw 1 2 no EMBL CAD51055 . 'erythrocyte binding antigen 175 [Plasmodium falciparum 3D7]' . . . . . 95.00 1502 100.00 100.00 5.11e-03 . . . . c25189_2mtw 1 3 no GB AAA29600 . 'erythrocyte binding protein [Plasmodium falciparum]' . . . . . 95.00 1475 100.00 100.00 5.00e-03 . . . . c25189_2mtw 1 4 no GB AAA75179 . 'erythrocyte-binding antigen-175, partial [Plasmodium falciparum]' . . . . . 95.00 1421 100.00 100.00 4.89e-03 . . . . c25189_2mtw 1 5 no GB AAF72186 . 'erythrocyte binding antigen 175 [Plasmodium falciparum]' . . . . . 95.00 1435 100.00 100.00 4.85e-03 . . . . c25189_2mtw 1 6 no GB AAK96216 . 'erythrocyte-binding antigen-175 [Plasmodium falciparum]' . . . . . 95.00 1402 100.00 100.00 4.93e-03 . . . . c25189_2mtw 1 7 no GB ETW19326 . 'erythrocyte-binding antigen 175 [Plasmodium falciparum Vietnam Oak-Knoll (FVO)]' . . . . . 95.00 1502 100.00 100.00 5.06e-03 . . . . c25189_2mtw 1 8 no REF XP_001349207 . 'erythrocyte binding antigen 175 [Plasmodium falciparum 3D7]' . . . . . 95.00 1502 100.00 100.00 5.11e-03 . . . . c25189_2mtw 1 9 no SP P19214 . 'RecName: Full=Erythrocyte-binding antigen 175; Short=EBA-175 [Plasmodium falciparum CAMP/Malaysia]' . . . . . 95.00 1435 100.00 100.00 4.76e-03 . . . . c25189_2mtw 1 stop_ loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 1 TYR . c25189_2mtw 1 2 2 THR . c25189_2mtw 1 3 3 ASN . c25189_2mtw 1 4 4 GLN . c25189_2mtw 1 5 5 ASN . c25189_2mtw 1 6 6 ILE . c25189_2mtw 1 7 7 ASN . c25189_2mtw 1 8 8 ILE . c25189_2mtw 1 9 9 SER . c25189_2mtw 1 10 10 GLN . c25189_2mtw 1 11 11 GLU . c25189_2mtw 1 12 12 ARG . c25189_2mtw 1 13 13 ASP . c25189_2mtw 1 14 14 LEU . c25189_2mtw 1 15 15 GLN . c25189_2mtw 1 16 16 LYS . c25189_2mtw 1 17 17 HIS . c25189_2mtw 1 18 18 GLY . c25189_2mtw 1 19 19 PHE . c25189_2mtw 1 20 20 HIS . c25189_2mtw 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . TYR 1 1 c25189_2mtw 1 . THR 2 2 c25189_2mtw 1 . ASN 3 3 c25189_2mtw 1 . GLN 4 4 c25189_2mtw 1 . ASN 5 5 c25189_2mtw 1 . ILE 6 6 c25189_2mtw 1 . ASN 7 7 c25189_2mtw 1 . ILE 8 8 c25189_2mtw 1 . SER 9 9 c25189_2mtw 1 . GLN 10 10 c25189_2mtw 1 . GLU 11 11 c25189_2mtw 1 . ARG 12 12 c25189_2mtw 1 . ASP 13 13 c25189_2mtw 1 . LEU 14 14 c25189_2mtw 1 . GLN 15 15 c25189_2mtw 1 . LYS 16 16 c25189_2mtw 1 . HIS 17 17 c25189_2mtw 1 . GLY 18 18 c25189_2mtw 1 . PHE 19 19 c25189_2mtw 1 . HIS 20 20 c25189_2mtw 1 stop_ save_ #################### # Natural source # #################### save_natural_source _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source _Entity_natural_src_list.Entry_ID c25189_2mtw _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Subvariant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Cellular_location _Entity_natural_src.Fragment _Entity_natural_src.Fraction _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Plasmid_details _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Dev_stage _Entity_natural_src.Details _Entity_natural_src.Citation_ID _Entity_natural_src.Citation_label _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $entity . . 'not applicable' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . c25189_2mtw 1 stop_ save_ ######################### # Experimental source # ######################### save_experimental_source _Entity_experimental_src_list.Sf_category experimental_source _Entity_experimental_src_list.Sf_framecode experimental_source _Entity_experimental_src_list.Entry_ID c25189_2mtw _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_subvariant _Entity_experimental_src.Host_org_organ _Entity_experimental_src.Host_org_tissue _Entity_experimental_src.Host_org_tissue_fraction _Entity_experimental_src.Host_org_cell_line _Entity_experimental_src.Host_org_cell_type _Entity_experimental_src.Host_org_cellular_location _Entity_experimental_src.Host_org_organelle _Entity_experimental_src.Host_org_gene _Entity_experimental_src.Host_org_culture_collection _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Host_org_dev_stage _Entity_experimental_src.Details _Entity_experimental_src.Citation_ID _Entity_experimental_src.Citation_label _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $entity . 'chemical synthesis' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . c25189_2mtw 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID c25189_2mtw _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system DMSO _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 DMSO 'natural abundance' . . . . . . 100 . . % . . . . c25189_2mtw 1 2 Entity 'natural abundance' . . 1 $entity . . . . . mM . . . . c25189_2mtw 1 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID c25189_2mtw _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID temperature 295 . K c25189_2mtw 1 pH 3.7 . pH c25189_2mtw 1 pressure 1 . atm c25189_2mtw 1 stop_ save_ ############################ # Computer software used # ############################ save_InsightII _Software.Sf_category software _Software.Sf_framecode InsightII _Software.Entry_ID c25189_2mtw _Software.ID 1 _Software.Name InsightII _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Accelrys Software Inc.' . . c25189_2mtw 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'geometry optimization' c25189_2mtw 1 refinement c25189_2mtw 1 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_1 _NMR_spectrometer.Entry_ID c25189_2mtw _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model DRX _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID c25189_2mtw _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 Bruker DRX . 600 . . . c25189_2mtw 1 stop_ save_ ############################# # NMR applied experiments # ############################# save_experiment_list _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode experiment_list _Experiment_list.Entry_ID c25189_2mtw _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D DQF-COSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . c25189_2mtw 1 2 '2D 1H-1H TOCSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . c25189_2mtw 1 3 '2D 1H-1H NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . c25189_2mtw 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_reference_1 _Chem_shift_reference.Entry_ID c25189_2mtw _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . . . . . c25189_2mtw 1 C 13 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.251449530 . . . . . . . . . c25189_2mtw 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.101329118 . . . . . . . . . c25189_2mtw 1 P 31 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.404808636 . . . . . . . . . c25189_2mtw 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID c25189_2mtw _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 2 '2D 1H-1H TOCSY' . . . c25189_2mtw 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 1 1 TYR HA H 1 4.508 0.02 . . . . . A 1 TYR HA . c25189_2mtw 1 2 . 1 1 1 1 TYR HB2 H 1 3.080 0.02 . . . . . A 1 TYR HB2 . c25189_2mtw 1 3 . 1 1 1 1 TYR HB3 H 1 2.900 0.02 . . . . . A 1 TYR HB3 . c25189_2mtw 1 4 . 1 1 1 1 TYR HD1 H 1 7.020 0.02 . . . . . A 1 TYR HD1 . c25189_2mtw 1 5 . 1 1 1 1 TYR HD2 H 1 7.020 0.02 . . . . . A 1 TYR HD2 . c25189_2mtw 1 6 . 1 1 1 1 TYR HE1 H 1 6.750 0.02 . . . . . A 1 TYR HE1 . c25189_2mtw 1 7 . 1 1 1 1 TYR HE2 H 1 6.750 0.02 . . . . . A 1 TYR HE2 . c25189_2mtw 1 8 . 1 1 1 1 TYR H H 1 8.510 0.02 . . . . . A 1 TYR H1 . c25189_2mtw 1 9 . 1 1 2 2 THR H H 1 7.920 0.02 . . . . . A 2 THR H . c25189_2mtw 1 10 . 1 1 2 2 THR HA H 1 4.220 0.02 . . . . . A 2 THR HA . c25189_2mtw 1 11 . 1 1 2 2 THR HB H 1 4.160 0.02 . . . . . A 2 THR HB . c25189_2mtw 1 12 . 1 1 2 2 THR HG21 H 1 1.090 0.02 . . . . . A 2 THR HG21 . c25189_2mtw 1 13 . 1 1 2 2 THR HG22 H 1 1.090 0.02 . . . . . A 2 THR HG22 . c25189_2mtw 1 14 . 1 1 2 2 THR HG23 H 1 1.090 0.02 . . . . . A 2 THR HG23 . c25189_2mtw 1 15 . 1 1 3 3 ASN H H 1 8.110 0.02 . . . . . A 3 ASN H . c25189_2mtw 1 16 . 1 1 3 3 ASN HA H 1 4.560 0.02 . . . . . A 3 ASN HA . c25189_2mtw 1 17 . 1 1 3 3 ASN HB2 H 1 2.560 0.02 . . . . . A 3 ASN HB2 . c25189_2mtw 1 18 . 1 1 3 3 ASN HB3 H 1 2.560 0.02 . . . . . A 3 ASN HB3 . c25189_2mtw 1 19 . 1 1 3 3 ASN HD21 H 1 7.340 0.02 . . . . . A 3 ASN HD21 . c25189_2mtw 1 20 . 1 1 3 3 ASN HD22 H 1 6.710 0.02 . . . . . A 3 ASN HD22 . c25189_2mtw 1 21 . 1 1 4 4 GLN H H 1 7.980 0.02 . . . . . A 4 GLN H . c25189_2mtw 1 22 . 1 1 4 4 GLN HA H 1 4.210 0.02 . . . . . A 4 GLN HA . c25189_2mtw 1 23 . 1 1 4 4 GLN HB2 H 1 1.900 0.02 . . . . . A 4 GLN HB2 . c25189_2mtw 1 24 . 1 1 4 4 GLN HB3 H 1 2.050 0.02 . . . . . A 4 GLN HB3 . c25189_2mtw 1 25 . 1 1 4 4 GLN HG2 H 1 2.280 0.02 . . . . . A 4 GLN HG2 . c25189_2mtw 1 26 . 1 1 4 4 GLN HG3 H 1 2.280 0.02 . . . . . A 4 GLN HG3 . c25189_2mtw 1 27 . 1 1 5 5 ASN H H 1 8.210 0.02 . . . . . A 5 ASN H . c25189_2mtw 1 28 . 1 1 5 5 ASN HA H 1 4.590 0.02 . . . . . A 5 ASN HA . c25189_2mtw 1 29 . 1 1 5 5 ASN HB2 H 1 2.420 0.02 . . . . . A 5 ASN HB2 . c25189_2mtw 1 30 . 1 1 5 5 ASN HB3 H 1 2.580 0.02 . . . . . A 5 ASN HB3 . c25189_2mtw 1 31 . 1 1 5 5 ASN HD21 H 1 7.420 0.02 . . . . . A 5 ASN HD21 . c25189_2mtw 1 32 . 1 1 5 5 ASN HD22 H 1 6.750 0.02 . . . . . A 5 ASN HD22 . c25189_2mtw 1 33 . 1 1 6 6 ILE H H 1 7.620 0.02 . . . . . A 6 ILE H . c25189_2mtw 1 34 . 1 1 6 6 ILE HA H 1 4.180 0.02 . . . . . A 6 ILE HA . c25189_2mtw 1 35 . 1 1 6 6 ILE HB H 1 1.800 0.02 . . . . . A 6 ILE HB . c25189_2mtw 1 36 . 1 1 6 6 ILE HG12 H 1 1.100 0.02 . . . . . A 6 ILE HG12 . c25189_2mtw 1 37 . 1 1 6 6 ILE HG13 H 1 1.600 0.02 . . . . . A 6 ILE HG13 . c25189_2mtw 1 38 . 1 1 6 6 ILE HG21 H 1 0.800 0.02 . . . . . A 6 ILE HG21 . c25189_2mtw 1 39 . 1 1 6 6 ILE HG22 H 1 0.800 0.02 . . . . . A 6 ILE HG22 . c25189_2mtw 1 40 . 1 1 6 6 ILE HG23 H 1 0.800 0.02 . . . . . A 6 ILE HG23 . c25189_2mtw 1 41 . 1 1 7 7 ASN H H 1 8.250 0.02 . . . . . A 7 ASN H . c25189_2mtw 1 42 . 1 1 7 7 ASN HA H 1 4.620 0.02 . . . . . A 7 ASN HA . c25189_2mtw 1 43 . 1 1 7 7 ASN HB2 H 1 2.570 0.02 . . . . . A 7 ASN HB2 . c25189_2mtw 1 44 . 1 1 7 7 ASN HB3 H 1 2.570 0.02 . . . . . A 7 ASN HB3 . c25189_2mtw 1 45 . 1 1 7 7 ASN HD21 H 1 6.980 0.02 . . . . . A 7 ASN HD21 . c25189_2mtw 1 46 . 1 1 7 7 ASN HD22 H 1 6.730 0.02 . . . . . A 7 ASN HD22 . c25189_2mtw 1 47 . 1 1 8 8 ILE H H 1 7.990 0.02 . . . . . A 8 ILE H . c25189_2mtw 1 48 . 1 1 8 8 ILE HA H 1 4.050 0.02 . . . . . A 8 ILE HA . c25189_2mtw 1 49 . 1 1 8 8 ILE HB H 1 1.850 0.02 . . . . . A 8 ILE HB . c25189_2mtw 1 50 . 1 1 8 8 ILE HG12 H 1 1.510 0.02 . . . . . A 8 ILE HG12 . c25189_2mtw 1 51 . 1 1 8 8 ILE HG13 H 1 1.200 0.02 . . . . . A 8 ILE HG13 . c25189_2mtw 1 52 . 1 1 8 8 ILE HG21 H 1 0.850 0.02 . . . . . A 8 ILE HG21 . c25189_2mtw 1 53 . 1 1 8 8 ILE HG22 H 1 0.850 0.02 . . . . . A 8 ILE HG22 . c25189_2mtw 1 54 . 1 1 8 8 ILE HG23 H 1 0.850 0.02 . . . . . A 8 ILE HG23 . c25189_2mtw 1 55 . 1 1 9 9 SER H H 1 7.990 0.02 . . . . . A 9 SER H . c25189_2mtw 1 56 . 1 1 9 9 SER HA H 1 4.180 0.02 . . . . . A 9 SER HA . c25189_2mtw 1 57 . 1 1 9 9 SER HB2 H 1 3.620 0.02 . . . . . A 9 SER HB2 . c25189_2mtw 1 58 . 1 1 9 9 SER HB3 H 1 3.700 0.02 . . . . . A 9 SER HB3 . c25189_2mtw 1 59 . 1 1 10 10 GLN H H 1 7.980 0.02 . . . . . A 10 GLN H . c25189_2mtw 1 60 . 1 1 10 10 GLN HA H 1 4.190 0.02 . . . . . A 10 GLN HA . c25189_2mtw 1 61 . 1 1 10 10 GLN HB2 H 1 2.020 0.02 . . . . . A 10 GLN HB2 . c25189_2mtw 1 62 . 1 1 10 10 GLN HB3 H 1 2.120 0.02 . . . . . A 10 GLN HB3 . c25189_2mtw 1 63 . 1 1 10 10 GLN HG2 H 1 2.300 0.02 . . . . . A 10 GLN HG2 . c25189_2mtw 1 64 . 1 1 10 10 GLN HG3 H 1 2.300 0.02 . . . . . A 10 GLN HG3 . c25189_2mtw 1 65 . 1 1 11 11 GLU H H 1 7.850 0.02 . . . . . A 11 GLU H . c25189_2mtw 1 66 . 1 1 11 11 GLU HA H 1 4.180 0.02 . . . . . A 11 GLU HA . c25189_2mtw 1 67 . 1 1 11 11 GLU HB2 H 1 2.110 0.02 . . . . . A 11 GLU HB2 . c25189_2mtw 1 68 . 1 1 11 11 GLU HB3 H 1 2.110 0.02 . . . . . A 11 GLU HB3 . c25189_2mtw 1 69 . 1 1 11 11 GLU HG2 H 1 2.360 0.02 . . . . . A 11 GLU HG2 . c25189_2mtw 1 70 . 1 1 11 11 GLU HG3 H 1 2.450 0.02 . . . . . A 11 GLU HG3 . c25189_2mtw 1 71 . 1 1 12 12 ARG H H 1 7.890 0.02 . . . . . A 12 ARG H . c25189_2mtw 1 72 . 1 1 12 12 ARG HA H 1 4.160 0.02 . . . . . A 12 ARG HA . c25189_2mtw 1 73 . 1 1 12 12 ARG HB2 H 1 1.790 0.02 . . . . . A 12 ARG HB2 . c25189_2mtw 1 74 . 1 1 12 12 ARG HB3 H 1 1.880 0.02 . . . . . A 12 ARG HB3 . c25189_2mtw 1 75 . 1 1 12 12 ARG HG2 H 1 1.610 0.02 . . . . . A 12 ARG HG2 . c25189_2mtw 1 76 . 1 1 12 12 ARG HG3 H 1 1.610 0.02 . . . . . A 12 ARG HG3 . c25189_2mtw 1 77 . 1 1 13 13 ASP H H 1 8.210 0.02 . . . . . A 13 ASP H . c25189_2mtw 1 78 . 1 1 13 13 ASP HA H 1 4.600 0.02 . . . . . A 13 ASP HA . c25189_2mtw 1 79 . 1 1 13 13 ASP HB2 H 1 2.920 0.02 . . . . . A 13 ASP HB2 . c25189_2mtw 1 80 . 1 1 13 13 ASP HB3 H 1 2.900 0.02 . . . . . A 13 ASP HB3 . c25189_2mtw 1 81 . 1 1 14 14 LEU H H 1 7.940 0.02 . . . . . A 14 LEU H . c25189_2mtw 1 82 . 1 1 14 14 LEU HA H 1 4.120 0.02 . . . . . A 14 LEU HA . c25189_2mtw 1 83 . 1 1 14 14 LEU HB2 H 1 1.850 0.02 . . . . . A 14 LEU HB2 . c25189_2mtw 1 84 . 1 1 14 14 LEU HB3 H 1 1.850 0.02 . . . . . A 14 LEU HB3 . c25189_2mtw 1 85 . 1 1 14 14 LEU HD11 H 1 0.750 0.02 . . . . . A 14 LEU HD11 . c25189_2mtw 1 86 . 1 1 14 14 LEU HD12 H 1 0.750 0.02 . . . . . A 14 LEU HD12 . c25189_2mtw 1 87 . 1 1 14 14 LEU HD13 H 1 0.750 0.02 . . . . . A 14 LEU HD13 . c25189_2mtw 1 88 . 1 1 14 14 LEU HD21 H 1 0.680 0.02 . . . . . A 14 LEU HD21 . c25189_2mtw 1 89 . 1 1 14 14 LEU HD22 H 1 0.680 0.02 . . . . . A 14 LEU HD22 . c25189_2mtw 1 90 . 1 1 14 14 LEU HD23 H 1 0.680 0.02 . . . . . A 14 LEU HD23 . c25189_2mtw 1 91 . 1 1 15 15 GLN H H 1 8.000 0.02 . . . . . A 15 GLN H . c25189_2mtw 1 92 . 1 1 15 15 GLN HA H 1 4.180 0.02 . . . . . A 15 GLN HA . c25189_2mtw 1 93 . 1 1 15 15 GLN HB2 H 1 2.120 0.02 . . . . . A 15 GLN HB2 . c25189_2mtw 1 94 . 1 1 15 15 GLN HB3 H 1 2.120 0.02 . . . . . A 15 GLN HB3 . c25189_2mtw 1 95 . 1 1 15 15 GLN HG2 H 1 2.400 0.02 . . . . . A 15 GLN HG2 . c25189_2mtw 1 96 . 1 1 15 15 GLN HG3 H 1 2.340 0.02 . . . . . A 15 GLN HG3 . c25189_2mtw 1 97 . 1 1 16 16 LYS H H 1 7.760 0.02 . . . . . A 16 LYS H . c25189_2mtw 1 98 . 1 1 16 16 LYS HA H 1 4.120 0.02 . . . . . A 16 LYS HA . c25189_2mtw 1 99 . 1 1 16 16 LYS HB2 H 1 1.780 0.02 . . . . . A 16 LYS HB2 . c25189_2mtw 1 100 . 1 1 16 16 LYS HB3 H 1 1.840 0.02 . . . . . A 16 LYS HB3 . c25189_2mtw 1 101 . 1 1 16 16 LYS HG2 H 1 1.420 0.02 . . . . . A 16 LYS HG2 . c25189_2mtw 1 102 . 1 1 16 16 LYS HG3 H 1 1.380 0.02 . . . . . A 16 LYS HG3 . c25189_2mtw 1 103 . 1 1 16 16 LYS HD2 H 1 1.600 0.02 . . . . . A 16 LYS HD2 . c25189_2mtw 1 104 . 1 1 16 16 LYS HD3 H 1 1.600 0.02 . . . . . A 16 LYS HD3 . c25189_2mtw 1 105 . 1 1 17 17 HIS H H 1 8.110 0.02 . . . . . A 17 HIS H . c25189_2mtw 1 106 . 1 1 17 17 HIS HA H 1 4.580 0.02 . . . . . A 17 HIS HA . c25189_2mtw 1 107 . 1 1 17 17 HIS HB2 H 1 2.960 0.02 . . . . . A 17 HIS HB2 . c25189_2mtw 1 108 . 1 1 17 17 HIS HB3 H 1 3.150 0.02 . . . . . A 17 HIS HB3 . c25189_2mtw 1 109 . 1 1 17 17 HIS HD2 H 1 7.300 0.02 . . . . . A 17 HIS HD2 . c25189_2mtw 1 110 . 1 1 18 18 GLY H H 1 8.210 0.02 . . . . . A 18 GLY H . c25189_2mtw 1 111 . 1 1 18 18 GLY HA2 H 1 3.700 0.02 . . . . . A 18 GLY HA2 . c25189_2mtw 1 112 . 1 1 18 18 GLY HA3 H 1 3.700 0.02 . . . . . A 18 GLY HA3 . c25189_2mtw 1 113 . 1 1 19 19 PHE H H 1 8.280 0.02 . . . . . A 19 PHE H . c25189_2mtw 1 114 . 1 1 19 19 PHE HA H 1 4.410 0.02 . . . . . A 19 PHE HA . c25189_2mtw 1 115 . 1 1 19 19 PHE HB2 H 1 3.000 0.02 . . . . . A 19 PHE HB2 . c25189_2mtw 1 116 . 1 1 19 19 PHE HB3 H 1 2.800 0.02 . . . . . A 19 PHE HB3 . c25189_2mtw 1 117 . 1 1 19 19 PHE HD1 H 1 7.150 0.02 . . . . . A 19 PHE HD1 . c25189_2mtw 1 118 . 1 1 19 19 PHE HD2 H 1 7.150 0.02 . . . . . A 19 PHE HD2 . c25189_2mtw 1 119 . 1 1 20 20 HIS H H 1 8.400 0.02 . . . . . A 20 HIS H . c25189_2mtw 1 120 . 1 1 20 20 HIS HA H 1 4.540 0.02 . . . . . A 20 HIS HA . c25189_2mtw 1 121 . 1 1 20 20 HIS HB2 H 1 2.960 0.02 . . . . . A 20 HIS HB2 . c25189_2mtw 1 122 . 1 1 20 20 HIS HB3 H 1 3.120 0.02 . . . . . A 20 HIS HB3 . c25189_2mtw 1 123 . 1 1 20 20 HIS HD2 H 1 7.300 0.02 . . . . . A 20 HIS HD2 . c25189_2mtw 1 stop_ save_ ############################## # Structure determinations # ############################## ########################## # Conformer statistics # ########################## save_conformer_statistics _Conformer_stat_list.Sf_category conformer_statistics _Conformer_stat_list.Sf_framecode conformer_statistics _Conformer_stat_list.Entry_ID c25189_2mtw _Conformer_stat_list.ID 1 _Conformer_stat_list.Conf_family_coord_set_ID 1 _Conformer_stat_list.Conf_family_coord_set_label $Original_constraints_and_structures _Conformer_stat_list.Conformer_submitted_total_num 1 save_ ##################################### # Conformer family coordinate set # ##################################### save_ensemble_of_conformers _Conformer_family_coord_set.Sf_category conformer_family_coord_set _Conformer_family_coord_set.Sf_framecode ensemble_of_conformers _Conformer_family_coord_set.Entry_ID c25189_2mtw _Conformer_family_coord_set.ID 1 loop_ _Conformer_family_refinement.Refine_method _Conformer_family_refinement.Refine_details _Conformer_family_refinement.Software_ID _Conformer_family_refinement.Software_label _Conformer_family_refinement.Entry_ID _Conformer_family_refinement.Conformer_family_coord_set_ID 1 . . . c25189_2mtw 1 stop_ loop_ _Conformer_family_software.Software_ID _Conformer_family_software.Software_label _Conformer_family_software.Method_ID _Conformer_family_software.Method_label _Conformer_family_software.Entry_ID _Conformer_family_software.Conformer_family_coord_set_ID . . . . c25189_2mtw 1 stop_ loop_ _Atom_site.Assembly_ID _Atom_site.Model_ID _Atom_site.Model_site_ID _Atom_site.ID _Atom_site.Assembly_atom_ID _Atom_site.Label_entity_assembly_ID _Atom_site.Label_entity_ID _Atom_site.Label_comp_index_ID _Atom_site.Label_comp_ID _Atom_site.Label_atom_ID _Atom_site.Type_symbol _Atom_site.Cartn_x _Atom_site.Cartn_y _Atom_site.Cartn_z _Atom_site.Cartn_x_esd _Atom_site.Cartn_y_esd _Atom_site.Cartn_z_esd _Atom_site.Occupancy _Atom_site.Occupancy_esd _Atom_site.Uncertainty _Atom_site.Ordered_flag _Atom_site.Footnote_ID _Atom_site.PDBX_label_asym_ID _Atom_site.PDBX_label_seq_ID _Atom_site.PDBX_label_comp_ID _Atom_site.PDBX_label_atom_ID _Atom_site.PDBX_formal_charge _Atom_site.PDBX_label_entity_ID _Atom_site.PDB_record_ID _Atom_site.PDB_model_num _Atom_site.PDB_strand_ID _Atom_site.PDB_ins_code _Atom_site.PDB_residue_no _Atom_site.PDB_residue_name _Atom_site.PDB_atom_name _Atom_site.Auth_entity_assembly_ID _Atom_site.Auth_asym_ID _Atom_site.Auth_chain_ID _Atom_site.Auth_seq_ID _Atom_site.Auth_comp_ID _Atom_site.Auth_atom_ID _Atom_site.Auth_alt_ID _Atom_site.Auth_atom_name _Atom_site.Details _Atom_site.Entry_ID _Atom_site.Conformer_family_coord_set_ID . 1 . 1 . 1 1 1 TYR C C -16.054 -0.327 0.276 . . . 1.0 . . . . . . . . . . . . A . 1 TYR C . . . . . . . . . c25189_2mtw 1 . 1 . 2 . 1 1 1 TYR CA C -17.031 -0.690 -0.882 . . . 1.0 . . . . . . . . . . . . A . 1 TYR CA . . . . . . . . . c25189_2mtw 1 . 1 . 3 . 1 1 1 TYR CB C -18.264 -1.546 -0.499 . . . 1.0 . . . . . . . . . . . . A . 1 TYR CB . . . . . . . . . c25189_2mtw 1 . 1 . 4 . 1 1 1 TYR CD1 C -20.128 0.046 0.210 . . . 1.0 . . . . . . . . . . . . A . 1 TYR CD1 . . . . . . . . . c25189_2mtw 1 . 1 . 5 . 1 1 1 TYR CD2 C -19.136 -1.373 1.894 . . . 1.0 . . . . . . . . . . . . A . 1 TYR CD2 . . . . . . . . . c25189_2mtw 1 . 1 . 6 . 1 1 1 TYR CE1 C -20.971 0.598 1.173 . . . 1.0 . . . . . . . . . . . . A . 1 TYR CE1 . . . . . . . . . c25189_2mtw 1 . 1 . 7 . 1 1 1 TYR CE2 C -19.978 -0.819 2.856 . . . 1.0 . . . . . . . . . . . . A . 1 TYR CE2 . . . . . . . . . c25189_2mtw 1 . 1 . 8 . 1 1 1 TYR CG C -19.202 -0.942 0.564 . . . 1.0 . . . . . . . . . . . . A . 1 TYR CG . . . . . . . . . c25189_2mtw 1 . 1 . 9 . 1 1 1 TYR CZ C -20.895 0.166 2.496 . . . 1.0 . . . . . . . . . . . . A . 1 TYR CZ . . . . . . . . . c25189_2mtw 1 . 1 . 10 . 1 1 1 TYR H1 H -16.209 -2.352 -2.084 . . . 1.0 . . . . . . . . . . . . A . 1 TYR H1 . . . . . . . . . c25189_2mtw 1 . 1 . 11 . 1 1 1 TYR HA H -17.483 0.242 -1.221 . . . 1.0 . . . . . . . . . . . . A . 1 TYR HA . . . . . . . . . c25189_2mtw 1 . 1 . 12 . 1 1 1 TYR HB2 H -18.865 -1.763 -1.409 . . . 1.0 . . . . . . . . . . . . A . 1 TYR HB2 . . . . . . . . . c25189_2mtw 1 . 1 . 13 . 1 1 1 TYR HB3 H -17.884 -2.520 -0.165 . . . 1.0 . . . . . . . . . . . . A . 1 TYR HB3 . . . . . . . . . c25189_2mtw 1 . 1 . 14 . 1 1 1 TYR HD1 H -20.196 0.393 -0.811 . . . 1.0 . . . . . . . . . . . . A . 1 TYR HD1 . . . . . . . . . c25189_2mtw 1 . 1 . 15 . 1 1 1 TYR HD2 H -18.429 -2.135 2.190 . . . 1.0 . . . . . . . . . . . . A . 1 TYR HD2 . . . . . . . . . c25189_2mtw 1 . 1 . 16 . 1 1 1 TYR HE1 H -21.681 1.362 0.890 . . . 1.0 . . . . . . . . . . . . A . 1 TYR HE1 . . . . . . . . . c25189_2mtw 1 . 1 . 17 . 1 1 1 TYR HE2 H -19.916 -1.156 3.881 . . . 1.0 . . . . . . . . . . . . A . 1 TYR HE2 . . . . . . . . . c25189_2mtw 1 . 1 . 18 . 1 1 1 TYR HH H -22.287 1.367 3.026 . . . 1.0 . . . . . . . . . . . . A . 1 TYR HH . . . . . . . . . c25189_2mtw 1 . 1 . 19 . 1 1 1 TYR N N -16.319 -1.334 -2.021 . . . 1.0 . . . . . . . . . . . . A . 1 TYR N . . . . . . . . . c25189_2mtw 1 . 1 . 20 . 1 1 1 TYR O O -15.774 0.857 0.485 . . . 1.0 . . . . . . . . . . . . A . 1 TYR O . . . . . . . . . c25189_2mtw 1 . 1 . 21 . 1 1 1 TYR OH O -21.725 0.710 3.443 . . . 1.0 . . . . . . . . . . . . A . 1 TYR OH . . . . . . . . . c25189_2mtw 1 . 1 . 22 . 1 1 2 THR C C -13.153 -0.845 1.651 . . . 1.0 . . . . . . . . . . . . A . 2 THR C . . . . . . . . . c25189_2mtw 1 . 1 . 23 . 1 1 2 THR CA C -14.602 -1.145 2.140 . . . 1.0 . . . . . . . . . . . . A . 2 THR CA . . . . . . . . . c25189_2mtw 1 . 1 . 24 . 1 1 2 THR CB C -14.760 -2.331 3.132 . . . 1.0 . . . . . . . . . . . . A . 2 THR CB . . . . . . . . . c25189_2mtw 1 . 1 . 25 . 1 1 2 THR CG2 C -13.774 -2.359 4.313 . . . 1.0 . . . . . . . . . . . . A . 2 THR CG2 . . . . . . . . . c25189_2mtw 1 . 1 . 26 . 1 1 2 THR H H -15.894 -2.262 0.746 . . . 1.0 . . . . . . . . . . . . A . 2 THR H . . . . . . . . . c25189_2mtw 1 . 1 . 27 . 1 1 2 THR HA H -14.928 -0.284 2.727 . . . 1.0 . . . . . . . . . . . . A . 2 THR HA . . . . . . . . . c25189_2mtw 1 . 1 . 28 . 1 1 2 THR HB H -14.614 -3.248 2.556 . . . 1.0 . . . . . . . . . . . . A . 2 THR HB . . . . . . . . . c25189_2mtw 1 . 1 . 29 . 1 1 2 THR HG1 H -16.172 -1.538 4.176 . . . 1.0 . . . . . . . . . . . . A . 2 THR HG1 . . . . . . . . . c25189_2mtw 1 . 1 . 30 . 1 1 2 THR HG21 H -13.844 -1.441 4.925 . . . 1.0 . . . . . . . . . . . . A . 2 THR HG21 . . . . . . . . . c25189_2mtw 1 . 1 . 31 . 1 1 2 THR HG22 H -12.728 -2.451 3.967 . . . 1.0 . . . . . . . . . . . . A . 2 THR HG22 . . . . . . . . . c25189_2mtw 1 . 1 . 32 . 1 1 2 THR HG23 H -13.967 -3.223 4.973 . . . 1.0 . . . . . . . . . . . . A . 2 THR HG23 . . . . . . . . . c25189_2mtw 1 . 1 . 33 . 1 1 2 THR N N -15.543 -1.336 1.004 . . . 1.0 . . . . . . . . . . . . A . 2 THR N . . . . . . . . . c25189_2mtw 1 . 1 . 34 . 1 1 2 THR O O -12.686 0.289 1.792 . . . 1.0 . . . . . . . . . . . . A . 2 THR O . . . . . . . . . c25189_2mtw 1 . 1 . 35 . 1 1 2 THR OG1 O -16.079 -2.352 3.675 . . . 1.0 . . . . . . . . . . . . A . 2 THR OG1 . . . . . . . . . c25189_2mtw 1 . 1 . 36 . 1 1 3 ASN C C -10.038 -1.533 1.724 . . . 1.0 . . . . . . . . . . . . A . 3 ASN C . . . . . . . . . c25189_2mtw 1 . 1 . 37 . 1 1 3 ASN CA C -11.068 -1.759 0.571 . . . 1.0 . . . . . . . . . . . . A . 3 ASN CA . . . . . . . . . c25189_2mtw 1 . 1 . 38 . 1 1 3 ASN CB C -10.876 -0.762 -0.617 . . . 1.0 . . . . . . . . . . . . A . 3 ASN CB . . . . . . . . . c25189_2mtw 1 . 1 . 39 . 1 1 3 ASN CG C -11.775 -0.987 -1.849 . . . 1.0 . . . . . . . . . . . . A . 3 ASN CG . . . . . . . . . c25189_2mtw 1 . 1 . 40 . 1 1 3 ASN H H -12.994 -2.737 1.059 . . . 1.0 . . . . . . . . . . . . A . 3 ASN H . . . . . . . . . c25189_2mtw 1 . 1 . 41 . 1 1 3 ASN HA H -10.842 -2.757 0.146 . . . 1.0 . . . . . . . . . . . . A . 3 ASN HA . . . . . . . . . c25189_2mtw 1 . 1 . 42 . 1 1 3 ASN HB2 H -11.032 0.275 -0.263 . . . 1.0 . . . . . . . . . . . . A . 3 ASN HB2 . . . . . . . . . c25189_2mtw 1 . 1 . 43 . 1 1 3 ASN HB3 H -9.816 -0.778 -0.938 . . . 1.0 . . . . . . . . . . . . A . 3 ASN HB3 . . . . . . . . . c25189_2mtw 1 . 1 . 44 . 1 1 3 ASN HD21 H -10.486 -2.332 -2.595 . . . 1.0 . . . . . . . . . . . . A . 3 ASN HD21 . . . . . . . . . c25189_2mtw 1 . 1 . 45 . 1 1 3 ASN HD22 H -12.000 -1.986 -3.573 . . . 1.0 . . . . . . . . . . . . A . 3 ASN HD22 . . . . . . . . . c25189_2mtw 1 . 1 . 46 . 1 1 3 ASN N N -12.465 -1.860 1.090 . . . 1.0 . . . . . . . . . . . . A . 3 ASN N . . . . . . . . . c25189_2mtw 1 . 1 . 47 . 1 1 3 ASN ND2 N -11.382 -1.861 -2.764 . . . 1.0 . . . . . . . . . . . . A . 3 ASN ND2 . . . . . . . . . c25189_2mtw 1 . 1 . 48 . 1 1 3 ASN O O -9.457 -0.452 1.860 . . . 1.0 . . . . . . . . . . . . A . 3 ASN O . . . . . . . . . c25189_2mtw 1 . 1 . 49 . 1 1 3 ASN OD1 O -12.830 -0.368 -1.981 . . . 1.0 . . . . . . . . . . . . A . 3 ASN OD1 . . . . . . . . . c25189_2mtw 1 . 1 . 50 . 1 1 4 GLN C C -7.481 -3.067 3.203 . . . 1.0 . . . . . . . . . . . . A . 4 GLN C . . . . . . . . . c25189_2mtw 1 . 1 . 51 . 1 1 4 GLN CA C -8.868 -2.554 3.683 . . . 1.0 . . . . . . . . . . . . A . 4 GLN CA . . . . . . . . . c25189_2mtw 1 . 1 . 52 . 1 1 4 GLN CB C -9.465 -3.257 4.925 . . . 1.0 . . . . . . . . . . . . A . 4 GLN CB . . . . . . . . . c25189_2mtw 1 . 1 . 53 . 1 1 4 GLN CD C -8.151 -1.903 6.746 . . . 1.0 . . . . . . . . . . . . A . 4 GLN CD . . . . . . . . . c25189_2mtw 1 . 1 . 54 . 1 1 4 GLN CG C -8.596 -3.277 6.209 . . . 1.0 . . . . . . . . . . . . A . 4 GLN CG . . . . . . . . . c25189_2mtw 1 . 1 . 55 . 1 1 4 GLN H H -10.463 -3.363 2.441 . . . 1.0 . . . . . . . . . . . . A . 4 GLN H . . . . . . . . . c25189_2mtw 1 . 1 . 56 . 1 1 4 GLN HA H -8.766 -1.530 4.012 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HA . . . . . . . . . c25189_2mtw 1 . 1 . 57 . 1 1 4 GLN HB2 H -10.443 -2.795 5.177 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HB2 . . . . . . . . . c25189_2mtw 1 . 1 . 58 . 1 1 4 GLN HB3 H -9.685 -4.291 4.638 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HB3 . . . . . . . . . c25189_2mtw 1 . 1 . 59 . 1 1 4 GLN HE21 H -10.027 -1.477 7.296 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HE21 . . . . . . . . . c25189_2mtw 1 . 1 . 60 . 1 1 4 GLN HE22 H -8.745 -0.214 7.652 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HE22 . . . . . . . . . c25189_2mtw 1 . 1 . 61 . 1 1 4 GLN HG2 H -9.141 -3.821 7.003 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HG2 . . . . . . . . . c25189_2mtw 1 . 1 . 62 . 1 1 4 GLN HG3 H -7.696 -3.892 6.024 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HG3 . . . . . . . . . c25189_2mtw 1 . 1 . 63 . 1 1 4 GLN N N -9.837 -2.570 2.562 . . . 1.0 . . . . . . . . . . . . A . 4 GLN N . . . . . . . . . c25189_2mtw 1 . 1 . 64 . 1 1 4 GLN NE2 N -9.063 -1.129 7.315 . . . 1.0 . . . . . . . . . . . . A . 4 GLN NE2 . . . . . . . . . c25189_2mtw 1 . 1 . 65 . 1 1 4 GLN O O -6.518 -2.297 3.180 . . . 1.0 . . . . . . . . . . . . A . 4 GLN O . . . . . . . . . c25189_2mtw 1 . 1 . 66 . 1 1 4 GLN OE1 O -6.982 -1.529 6.651 . . . 1.0 . . . . . . . . . . . . A . 4 GLN OE1 . . . . . . . . . c25189_2mtw 1 . 1 . 67 . 1 1 5 ASN C C -5.707 -4.471 0.889 . . . 1.0 . . . . . . . . . . . . A . 5 ASN C . . . . . . . . . c25189_2mtw 1 . 1 . 68 . 1 1 5 ASN CA C -6.164 -4.990 2.286 . . . 1.0 . . . . . . . . . . . . A . 5 ASN CA . . . . . . . . . c25189_2mtw 1 . 1 . 69 . 1 1 5 ASN CB C -6.375 -6.527 2.271 . . . 1.0 . . . . . . . . . . . . A . 5 ASN CB . . . . . . . . . c25189_2mtw 1 . 1 . 70 . 1 1 5 ASN CG C -5.089 -7.357 2.449 . . . 1.0 . . . . . . . . . . . . A . 5 ASN CG . . . . . . . . . c25189_2mtw 1 . 1 . 71 . 1 1 5 ASN H H -8.301 -4.852 2.857 . . . 1.0 . . . . . . . . . . . . A . 5 ASN H . . . . . . . . . c25189_2mtw 1 . 1 . 72 . 1 1 5 ASN HA H -5.354 -4.727 2.989 . . . 1.0 . . . . . . . . . . . . A . 5 ASN HA . . . . . . . . . c25189_2mtw 1 . 1 . 73 . 1 1 5 ASN HB2 H -7.068 -6.818 3.080 . . . 1.0 . . . . . . . . . . . . A . 5 ASN HB2 . . . . . . . . . c25189_2mtw 1 . 1 . 74 . 1 1 5 ASN HB3 H -6.916 -6.826 1.348 . . . 1.0 . . . . . . . . . . . . A . 5 ASN HB3 . . . . . . . . . c25189_2mtw 1 . 1 . 75 . 1 1 5 ASN HD21 H -4.689 -7.153 0.512 . . . 1.0 . . . . . . . . . . . . A . 5 ASN HD21 . . . . . . . . . c25189_2mtw 1 . 1 . 76 . 1 1 5 ASN HD22 H -3.501 -8.144 1.505 . . . 1.0 . . . . . . . . . . . . A . 5 ASN HD22 . . . . . . . . . c25189_2mtw 1 . 1 . 77 . 1 1 5 ASN N N -7.405 -4.355 2.818 . . . 1.0 . . . . . . . . . . . . A . 5 ASN N . . . . . . . . . c25189_2mtw 1 . 1 . 78 . 1 1 5 ASN ND2 N -4.366 -7.609 1.372 . . . 1.0 . . . . . . . . . . . . A . 5 ASN ND2 . . . . . . . . . c25189_2mtw 1 . 1 . 79 . 1 1 5 ASN O O -4.506 -4.354 0.628 . . . 1.0 . . . . . . . . . . . . A . 5 ASN O . . . . . . . . . c25189_2mtw 1 . 1 . 80 . 1 1 5 ASN OD1 O -4.741 -7.774 3.553 . . . 1.0 . . . . . . . . . . . . A . 5 ASN OD1 . . . . . . . . . c25189_2mtw 1 . 1 . 81 . 1 1 6 ILE C C -5.724 -2.220 -1.273 . . . 1.0 . . . . . . . . . . . . A . 6 ILE C . . . . . . . . . c25189_2mtw 1 . 1 . 82 . 1 1 6 ILE CA C -6.411 -3.628 -1.359 . . . 1.0 . . . . . . . . . . . . A . 6 ILE CA . . . . . . . . . c25189_2mtw 1 . 1 . 83 . 1 1 6 ILE CB C -7.714 -3.676 -2.209 . . . 1.0 . . . . . . . . . . . . A . 6 ILE CB . . . . . . . . . c25189_2mtw 1 . 1 . 84 . 1 1 6 ILE CD1 C -7.487 -6.175 -3.096 . . . 1.0 . . . . . . . . . . . . A . 6 ILE CD1 . . . . . . . . . c25189_2mtw 1 . 1 . 85 . 1 1 6 ILE CG1 C -8.311 -5.109 -2.348 . . . 1.0 . . . . . . . . . . . . A . 6 ILE CG1 . . . . . . . . . c25189_2mtw 1 . 1 . 86 . 1 1 6 ILE CG2 C -7.597 -3.014 -3.608 . . . 1.0 . . . . . . . . . . . . A . 6 ILE CG2 . . . . . . . . . c25189_2mtw 1 . 1 . 87 . 1 1 6 ILE H H -7.571 -4.599 0.256 . . . 1.0 . . . . . . . . . . . . A . 6 ILE H . . . . . . . . . c25189_2mtw 1 . 1 . 88 . 1 1 6 ILE HA H -5.783 -4.328 -1.903 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HA . . . . . . . . . c25189_2mtw 1 . 1 . 89 . 1 1 6 ILE HB H -8.448 -3.080 -1.652 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HB . . . . . . . . . c25189_2mtw 1 . 1 . 90 . 1 1 6 ILE HD11 H -7.247 -5.865 -4.129 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HD11 . . . . . . . . . c25189_2mtw 1 . 1 . 91 . 1 1 6 ILE HD12 H -6.534 -6.397 -2.582 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HD12 . . . . . . . . . c25189_2mtw 1 . 1 . 92 . 1 1 6 ILE HD13 H -8.045 -7.126 -3.165 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HD13 . . . . . . . . . c25189_2mtw 1 . 1 . 93 . 1 1 6 ILE HG12 H -8.565 -5.510 -1.345 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HG12 . . . . . . . . . c25189_2mtw 1 . 1 . 94 . 1 1 6 ILE HG13 H -9.269 -4.997 -2.857 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HG13 . . . . . . . . . c25189_2mtw 1 . 1 . 95 . 1 1 6 ILE HG21 H -6.805 -3.479 -4.224 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HG21 . . . . . . . . . c25189_2mtw 1 . 1 . 96 . 1 1 6 ILE HG22 H -7.359 -1.939 -3.531 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HG22 . . . . . . . . . c25189_2mtw 1 . 1 . 97 . 1 1 6 ILE HG23 H -8.543 -3.081 -4.177 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HG23 . . . . . . . . . c25189_2mtw 1 . 1 . 98 . 1 1 6 ILE N N -6.670 -4.183 0.000 . . . 1.0 . . . . . . . . . . . . A . 6 ILE N . . . . . . . . . c25189_2mtw 1 . 1 . 99 . 1 1 6 ILE O O -4.730 -1.976 -1.962 . . . 1.0 . . . . . . . . . . . . A . 6 ILE O . . . . . . . . . c25189_2mtw 1 . 1 . 100 . 1 1 7 ASN C C -4.338 0.084 0.562 . . . 1.0 . . . . . . . . . . . . A . 7 ASN C . . . . . . . . . c25189_2mtw 1 . 1 . 101 . 1 1 7 ASN CA C -5.715 0.015 -0.152 . . . 1.0 . . . . . . . . . . . . A . 7 ASN CA . . . . . . . . . c25189_2mtw 1 . 1 . 102 . 1 1 7 ASN CB C -6.812 0.884 0.524 . . . 1.0 . . . . . . . . . . . . A . 7 ASN CB . . . . . . . . . c25189_2mtw 1 . 1 . 103 . 1 1 7 ASN CG C -6.560 2.406 0.534 . . . 1.0 . . . . . . . . . . . . A . 7 ASN CG . . . . . . . . . c25189_2mtw 1 . 1 . 104 . 1 1 7 ASN H H -6.975 -1.755 0.194 . . . 1.0 . . . . . . . . . . . . A . 7 ASN H . . . . . . . . . c25189_2mtw 1 . 1 . 105 . 1 1 7 ASN HA H -5.534 0.412 -1.151 . . . 1.0 . . . . . . . . . . . . A . 7 ASN HA . . . . . . . . . c25189_2mtw 1 . 1 . 106 . 1 1 7 ASN HB2 H -7.794 0.706 0.040 . . . 1.0 . . . . . . . . . . . . A . 7 ASN HB2 . . . . . . . . . c25189_2mtw 1 . 1 . 107 . 1 1 7 ASN HB3 H -6.956 0.545 1.568 . . . 1.0 . . . . . . . . . . . . A . 7 ASN HB3 . . . . . . . . . c25189_2mtw 1 . 1 . 108 . 1 1 7 ASN HD21 H -7.267 2.585 -1.339 . . . 1.0 . . . . . . . . . . . . A . 7 ASN HD21 . . . . . . . . . c25189_2mtw 1 . 1 . 109 . 1 1 7 ASN HD22 H -6.680 4.113 -0.512 . . . 1.0 . . . . . . . . . . . . A . 7 ASN HD22 . . . . . . . . . c25189_2mtw 1 . 1 . 110 . 1 1 7 ASN N N -6.255 -1.338 -0.399 . . . 1.0 . . . . . . . . . . . . A . 7 ASN N . . . . . . . . . c25189_2mtw 1 . 1 . 111 . 1 1 7 ASN ND2 N -6.848 3.101 -0.557 . . . 1.0 . . . . . . . . . . . . A . 7 ASN ND2 . . . . . . . . . c25189_2mtw 1 . 1 . 112 . 1 1 7 ASN O O -3.548 0.952 0.183 . . . 1.0 . . . . . . . . . . . . A . 7 ASN O . . . . . . . . . c25189_2mtw 1 . 1 . 113 . 1 1 7 ASN OD1 O -6.113 2.972 1.531 . . . 1.0 . . . . . . . . . . . . A . 7 ASN OD1 . . . . . . . . . c25189_2mtw 1 . 1 . 114 . 1 1 8 ILE C C -1.491 -1.089 1.244 . . . 1.0 . . . . . . . . . . . . A . 8 ILE C . . . . . . . . . c25189_2mtw 1 . 1 . 115 . 1 1 8 ILE CA C -2.684 -0.785 2.212 . . . 1.0 . . . . . . . . . . . . A . 8 ILE CA . . . . . . . . . c25189_2mtw 1 . 1 . 116 . 1 1 8 ILE CB C -2.697 -1.626 3.533 . . . 1.0 . . . . . . . . . . . . A . 8 ILE CB . . . . . . . . . c25189_2mtw 1 . 1 . 117 . 1 1 8 ILE CD1 C -1.889 -4.082 3.056 . . . 1.0 . . . . . . . . . . . . A . 8 ILE CD1 . . . . . . . . . c25189_2mtw 1 . 1 . 118 . 1 1 8 ILE CG1 C -3.046 -3.137 3.412 . . . 1.0 . . . . . . . . . . . . A . 8 ILE CG1 . . . . . . . . . c25189_2mtw 1 . 1 . 119 . 1 1 8 ILE CG2 C -3.577 -0.964 4.625 . . . 1.0 . . . . . . . . . . . . A . 8 ILE CG2 . . . . . . . . . c25189_2mtw 1 . 1 . 120 . 1 1 8 ILE H H -4.809 -1.279 1.979 . . . 1.0 . . . . . . . . . . . . A . 8 ILE H . . . . . . . . . c25189_2mtw 1 . 1 . 121 . 1 1 8 ILE HA H -2.529 0.254 2.559 . . . 1.0 . . . . . . . . . . . . A . 8 ILE HA . . . . . . . . . c25189_2mtw 1 . 1 . 122 . 1 1 8 ILE HB H -1.682 -1.562 3.927 . . . 1.0 . . . . . . . . . . . . A . 8 ILE HB . . . . . . . . . c25189_2mtw 1 . 1 . 123 . 1 1 8 ILE HD11 H -1.457 -3.873 2.064 . . . 1.0 . . . . . . . . . . . . A . 8 ILE HD11 . . . . . . . . . c25189_2mtw 1 . 1 . 124 . 1 1 8 ILE HD12 H -2.233 -5.132 3.032 . . . 1.0 . . . . . . . . . . . . A . 8 ILE HD12 . . . . . . . . . c25189_2mtw 1 . 1 . 125 . 1 1 8 ILE HD13 H -1.068 -4.017 3.793 . . . 1.0 . . . . . . . . . . . . A . 8 ILE HD13 . . . . . . . . . c25189_2mtw 1 . 1 . 126 . 1 1 8 ILE HG12 H -3.483 -3.512 4.359 . . . 1.0 . . . . . . . . . . . . A . 8 ILE HG12 . . . . . . . . . c25189_2mtw 1 . 1 . 127 . 1 1 8 ILE HG13 H -3.839 -3.244 2.658 . . . 1.0 . . . . . . . . . . . . A . 8 ILE HG13 . . . . . . . . . c25189_2mtw 1 . 1 . 128 . 1 1 8 ILE HG21 H -3.285 0.088 4.803 . . . 1.0 . . . . . . . . . . . . A . 8 ILE HG21 . . . . . . . . . c25189_2mtw 1 . 1 . 129 . 1 1 8 ILE HG22 H -3.485 -1.482 5.598 . . . 1.0 . . . . . . . . . . . . A . 8 ILE HG22 . . . . . . . . . c25189_2mtw 1 . 1 . 130 . 1 1 8 ILE HG23 H -4.650 -0.962 4.358 . . . 1.0 . . . . . . . . . . . . A . 8 ILE HG23 . . . . . . . . . c25189_2mtw 1 . 1 . 131 . 1 1 8 ILE N N -4.019 -0.797 1.538 . . . 1.0 . . . . . . . . . . . . A . 8 ILE N . . . . . . . . . c25189_2mtw 1 . 1 . 132 . 1 1 8 ILE O O -0.415 -0.511 1.415 . . . 1.0 . . . . . . . . . . . . A . 8 ILE O . . . . . . . . . c25189_2mtw 1 . 1 . 133 . 1 1 9 SER C C -0.439 -1.113 -1.744 . . . 1.0 . . . . . . . . . . . . A . 9 SER C . . . . . . . . . c25189_2mtw 1 . 1 . 134 . 1 1 9 SER CA C -0.667 -2.316 -0.784 . . . 1.0 . . . . . . . . . . . . A . 9 SER CA . . . . . . . . . c25189_2mtw 1 . 1 . 135 . 1 1 9 SER CB C -1.098 -3.582 -1.554 . . . 1.0 . . . . . . . . . . . . A . 9 SER CB . . . . . . . . . c25189_2mtw 1 . 1 . 136 . 1 1 9 SER H H -2.627 -2.401 0.248 . . . 1.0 . . . . . . . . . . . . A . 9 SER H . . . . . . . . . c25189_2mtw 1 . 1 . 137 . 1 1 9 SER HA H 0.288 -2.497 -0.257 . . . 1.0 . . . . . . . . . . . . A . 9 SER HA . . . . . . . . . c25189_2mtw 1 . 1 . 138 . 1 1 9 SER HB2 H -1.515 -4.330 -0.860 . . . 1.0 . . . . . . . . . . . . A . 9 SER HB2 . . . . . . . . . c25189_2mtw 1 . 1 . 139 . 1 1 9 SER HB3 H -1.910 -3.359 -2.277 . . . 1.0 . . . . . . . . . . . . A . 9 SER HB3 . . . . . . . . . c25189_2mtw 1 . 1 . 140 . 1 1 9 SER HG H -0.331 -4.926 -2.694 . . . 1.0 . . . . . . . . . . . . A . 9 SER HG . . . . . . . . . c25189_2mtw 1 . 1 . 141 . 1 1 9 SER N N -1.691 -1.981 0.246 . . . 1.0 . . . . . . . . . . . . A . 9 SER N . . . . . . . . . c25189_2mtw 1 . 1 . 142 . 1 1 9 SER O O 0.713 -0.780 -2.035 . . . 1.0 . . . . . . . . . . . . A . 9 SER O . . . . . . . . . c25189_2mtw 1 . 1 . 143 . 1 1 9 SER OG O 0.007 -4.146 -2.247 . . . 1.0 . . . . . . . . . . . . A . 9 SER OG . . . . . . . . . c25189_2mtw 1 . 1 . 144 . 1 1 10 GLN C C -0.707 1.916 -2.404 . . . 1.0 . . . . . . . . . . . . A . 10 GLN C . . . . . . . . . c25189_2mtw 1 . 1 . 145 . 1 1 10 GLN CA C -1.481 0.733 -3.090 . . . 1.0 . . . . . . . . . . . . A . 10 GLN CA . . . . . . . . . c25189_2mtw 1 . 1 . 146 . 1 1 10 GLN CB C -2.912 1.198 -3.477 . . . 1.0 . . . . . . . . . . . . A . 10 GLN CB . . . . . . . . . c25189_2mtw 1 . 1 . 147 . 1 1 10 GLN CD C -5.060 0.791 -4.835 . . . 1.0 . . . . . . . . . . . . A . 10 GLN CD . . . . . . . . . c25189_2mtw 1 . 1 . 148 . 1 1 10 GLN CG C -3.689 0.240 -4.409 . . . 1.0 . . . . . . . . . . . . A . 10 GLN CG . . . . . . . . . c25189_2mtw 1 . 1 . 149 . 1 1 10 GLN H H -2.393 -1.023 -2.032 . . . 1.0 . . . . . . . . . . . . A . 10 GLN H . . . . . . . . . c25189_2mtw 1 . 1 . 150 . 1 1 10 GLN HA H -0.977 0.456 -4.034 . . . 1.0 . . . . . . . . . . . . A . 10 GLN HA . . . . . . . . . c25189_2mtw 1 . 1 . 151 . 1 1 10 GLN HB2 H -3.508 1.395 -2.564 . . . 1.0 . . . . . . . . . . . . A . 10 GLN HB2 . . . . . . . . . c25189_2mtw 1 . 1 . 152 . 1 1 10 GLN HB3 H -2.842 2.179 -3.988 . . . 1.0 . . . . . . . . . . . . A . 10 GLN HB3 . . . . . . . . . c25189_2mtw 1 . 1 . 153 . 1 1 10 GLN HE21 H -5.910 0.077 -3.163 . . . 1.0 . . . . . . . . . . . . A . 10 GLN HE21 . . . . . . . . . c25189_2mtw 1 . 1 . 154 . 1 1 10 GLN HE22 H -6.996 0.972 -4.341 . . . 1.0 . . . . . . . . . . . . A . 10 GLN HE22 . . . . . . . . . c25189_2mtw 1 . 1 . 155 . 1 1 10 GLN HG2 H -3.083 0.053 -5.317 . . . 1.0 . . . . . . . . . . . . A . 10 GLN HG2 . . . . . . . . . c25189_2mtw 1 . 1 . 156 . 1 1 10 GLN HG3 H -3.809 -0.750 -3.929 . . . 1.0 . . . . . . . . . . . . A . 10 GLN HG3 . . . . . . . . . c25189_2mtw 1 . 1 . 157 . 1 1 10 GLN N N -1.539 -0.477 -2.213 . . . 1.0 . . . . . . . . . . . . A . 10 GLN N . . . . . . . . . c25189_2mtw 1 . 1 . 158 . 1 1 10 GLN NE2 N -6.094 0.593 -4.031 . . . 1.0 . . . . . . . . . . . . A . 10 GLN NE2 . . . . . . . . . c25189_2mtw 1 . 1 . 159 . 1 1 10 GLN O O 0.032 2.639 -3.076 . . . 1.0 . . . . . . . . . . . . A . 10 GLN O . . . . . . . . . c25189_2mtw 1 . 1 . 160 . 1 1 10 GLN OE1 O -5.200 1.402 -5.894 . . . 1.0 . . . . . . . . . . . . A . 10 GLN OE1 . . . . . . . . . c25189_2mtw 1 . 1 . 161 . 1 1 11 GLU C C 1.315 2.831 -0.065 . . . 1.0 . . . . . . . . . . . . A . 11 GLU C . . . . . . . . . c25189_2mtw 1 . 1 . 162 . 1 1 11 GLU CA C -0.203 3.109 -0.246 . . . 1.0 . . . . . . . . . . . . A . 11 GLU CA . . . . . . . . . c25189_2mtw 1 . 1 . 163 . 1 1 11 GLU CB C -0.900 3.252 1.132 . . . 1.0 . . . . . . . . . . . . A . 11 GLU CB . . . . . . . . . c25189_2mtw 1 . 1 . 164 . 1 1 11 GLU CD C -3.016 3.978 2.390 . . . 1.0 . . . . . . . . . . . . A . 11 GLU CD . . . . . . . . . c25189_2mtw 1 . 1 . 165 . 1 1 11 GLU CG C -2.254 3.980 1.062 . . . 1.0 . . . . . . . . . . . . A . 11 GLU CG . . . . . . . . . c25189_2mtw 1 . 1 . 166 . 1 1 11 GLU H H -1.462 1.330 -0.656 . . . 1.0 . . . . . . . . . . . . A . 11 GLU H . . . . . . . . . c25189_2mtw 1 . 1 . 167 . 1 1 11 GLU HA H -0.276 4.066 -0.787 . . . 1.0 . . . . . . . . . . . . A . 11 GLU HA . . . . . . . . . c25189_2mtw 1 . 1 . 168 . 1 1 11 GLU HB2 H -1.019 2.254 1.601 . . . 1.0 . . . . . . . . . . . . A . 11 GLU HB2 . . . . . . . . . c25189_2mtw 1 . 1 . 169 . 1 1 11 GLU HB3 H -0.252 3.819 1.828 . . . 1.0 . . . . . . . . . . . . A . 11 GLU HB3 . . . . . . . . . c25189_2mtw 1 . 1 . 170 . 1 1 11 GLU HE2 H -3.944 2.735 3.566 . . . 1.0 . . . . . . . . . . . . A . 11 GLU HE2 . . . . . . . . . c25189_2mtw 1 . 1 . 171 . 1 1 11 GLU HG2 H -2.060 5.022 0.749 . . . 1.0 . . . . . . . . . . . . A . 11 GLU HG2 . . . . . . . . . c25189_2mtw 1 . 1 . 172 . 1 1 11 GLU HG3 H -2.887 3.541 0.269 . . . 1.0 . . . . . . . . . . . . A . 11 GLU HG3 . . . . . . . . . c25189_2mtw 1 . 1 . 173 . 1 1 11 GLU N N -0.893 2.082 -1.072 . . . 1.0 . . . . . . . . . . . . A . 11 GLU N . . . . . . . . . c25189_2mtw 1 . 1 . 174 . 1 1 11 GLU O O 2.106 3.773 -0.158 . . . 1.0 . . . . . . . . . . . . A . 11 GLU O . . . . . . . . . c25189_2mtw 1 . 1 . 175 . 1 1 11 GLU OE1 O -3.202 4.990 3.064 . . . 1.0 . . . . . . . . . . . . A . 11 GLU OE1 . . . . . . . . . c25189_2mtw 1 . 1 . 176 . 1 1 11 GLU OE2 O -3.466 2.729 2.733 . . . 1.0 . . . . . . . . . . . . A . 11 GLU OE2 . . . . . . . . . c25189_2mtw 1 . 1 . 177 . 1 1 12 ARG C C 3.945 1.467 -0.976 . . . 1.0 . . . . . . . . . . . . A . 12 ARG C . . . . . . . . . c25189_2mtw 1 . 1 . 178 . 1 1 12 ARG CA C 3.152 1.173 0.326 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CA . . . . . . . . . c25189_2mtw 1 . 1 . 179 . 1 1 12 ARG CB C 3.223 -0.312 0.781 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CB . . . . . . . . . c25189_2mtw 1 . 1 . 180 . 1 1 12 ARG CD C 5.546 -0.269 2.041 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CD . . . . . . . . . c25189_2mtw 1 . 1 . 181 . 1 1 12 ARG CG C 4.631 -0.928 0.985 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CG . . . . . . . . . c25189_2mtw 1 . 1 . 182 . 1 1 12 ARG CZ C 5.358 -1.441 4.261 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CZ . . . . . . . . . c25189_2mtw 1 . 1 . 183 . 1 1 12 ARG H H 0.949 0.955 0.476 . . . 1.0 . . . . . . . . . . . . A . 12 ARG H . . . . . . . . . c25189_2mtw 1 . 1 . 184 . 1 1 12 ARG HA H 3.573 1.790 1.138 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HA . . . . . . . . . c25189_2mtw 1 . 1 . 185 . 1 1 12 ARG HB2 H 2.657 -0.426 1.728 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB2 . . . . . . . . . c25189_2mtw 1 . 1 . 186 . 1 1 12 ARG HB3 H 2.689 -0.941 0.039 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB3 . . . . . . . . . c25189_2mtw 1 . 1 . 187 . 1 1 12 ARG HD2 H 6.567 -0.681 1.938 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD2 . . . . . . . . . c25189_2mtw 1 . 1 . 188 . 1 1 12 ARG HD3 H 5.663 0.807 1.816 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD3 . . . . . . . . . c25189_2mtw 1 . 1 . 189 . 1 1 12 ARG HG2 H 4.517 -2.002 1.226 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG2 . . . . . . . . . c25189_2mtw 1 . 1 . 190 . 1 1 12 ARG HG3 H 5.163 -0.922 0.016 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG3 . . . . . . . . . c25189_2mtw 1 . 1 . 191 . 1 1 12 ARG HH11 H 6.496 -2.473 2.961 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH11 . . . . . . . . . c25189_2mtw 1 . 1 . 192 . 1 1 12 ARG HH12 H 6.266 -3.199 4.631 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH12 . . . . . . . . . c25189_2mtw 1 . 1 . 193 . 1 1 12 ARG HH21 H 4.274 -0.613 5.727 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH21 . . . . . . . . . c25189_2mtw 1 . 1 . 194 . 1 1 12 ARG HH22 H 5.093 -2.215 6.089 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH22 . . . . . . . . . c25189_2mtw 1 . 1 . 195 . 1 1 12 ARG N N 1.718 1.564 0.188 . . . 1.0 . . . . . . . . . . . . A . 12 ARG N . . . . . . . . . c25189_2mtw 1 . 1 . 196 . 1 1 12 ARG NE N 5.066 -0.411 3.440 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NE . . . . . . . . . c25189_2mtw 1 . 1 . 197 . 1 1 12 ARG NH1 N 6.119 -2.478 3.915 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH1 . . . . . . . . . c25189_2mtw 1 . 1 . 198 . 1 1 12 ARG NH2 N 4.858 -1.421 5.483 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH2 . . . . . . . . . c25189_2mtw 1 . 1 . 199 . 1 1 12 ARG O O 5.035 2.033 -0.907 . . . 1.0 . . . . . . . . . . . . A . 12 ARG O . . . . . . . . . c25189_2mtw 1 . 1 . 200 . 1 1 13 ASP C C 4.141 2.873 -3.754 . . . 1.0 . . . . . . . . . . . . A . 13 ASP C . . . . . . . . . c25189_2mtw 1 . 1 . 201 . 1 1 13 ASP CA C 3.962 1.347 -3.475 . . . 1.0 . . . . . . . . . . . . A . 13 ASP CA . . . . . . . . . c25189_2mtw 1 . 1 . 202 . 1 1 13 ASP CB C 3.066 0.670 -4.544 . . . 1.0 . . . . . . . . . . . . A . 13 ASP CB . . . . . . . . . c25189_2mtw 1 . 1 . 203 . 1 1 13 ASP CG C 3.773 0.408 -5.880 . . . 1.0 . . . . . . . . . . . . A . 13 ASP CG . . . . . . . . . c25189_2mtw 1 . 1 . 204 . 1 1 13 ASP H H 2.453 0.663 -2.007 . . . 1.0 . . . . . . . . . . . . A . 13 ASP H . . . . . . . . . c25189_2mtw 1 . 1 . 205 . 1 1 13 ASP HA H 4.963 0.894 -3.452 . . . 1.0 . . . . . . . . . . . . A . 13 ASP HA . . . . . . . . . c25189_2mtw 1 . 1 . 206 . 1 1 13 ASP HB2 H 2.668 -0.285 -4.155 . . . 1.0 . . . . . . . . . . . . A . 13 ASP HB2 . . . . . . . . . c25189_2mtw 1 . 1 . 207 . 1 1 13 ASP HB3 H 2.162 1.288 -4.732 . . . 1.0 . . . . . . . . . . . . A . 13 ASP HB3 . . . . . . . . . c25189_2mtw 1 . 1 . 208 . 1 1 13 ASP HD2 H 4.235 -1.317 -5.104 . . . 1.0 . . . . . . . . . . . . A . 13 ASP HD2 . . . . . . . . . c25189_2mtw 1 . 1 . 209 . 1 1 13 ASP N N 3.376 1.087 -2.137 . . . 1.0 . . . . . . . . . . . . A . 13 ASP N . . . . . . . . . c25189_2mtw 1 . 1 . 210 . 1 1 13 ASP O O 5.182 3.277 -4.281 . . . 1.0 . . . . . . . . . . . . A . 13 ASP O . . . . . . . . . c25189_2mtw 1 . 1 . 211 . 1 1 13 ASP OD1 O 3.801 1.222 -6.802 . . . 1.0 . . . . . . . . . . . . A . 13 ASP OD1 . . . . . . . . . c25189_2mtw 1 . 1 . 212 . 1 1 13 ASP OD2 O 4.366 -0.828 -5.920 . . . 1.0 . . . . . . . . . . . . A . 13 ASP OD2 . . . . . . . . . c25189_2mtw 1 . 1 . 213 . 1 1 14 LEU C C 4.356 5.814 -2.729 . . . 1.0 . . . . . . . . . . . . A . 14 LEU C . . . . . . . . . c25189_2mtw 1 . 1 . 214 . 1 1 14 LEU CA C 3.166 5.169 -3.514 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CA . . . . . . . . . c25189_2mtw 1 . 1 . 215 . 1 1 14 LEU CB C 1.792 5.762 -3.073 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CB . . . . . . . . . c25189_2mtw 1 . 1 . 216 . 1 1 14 LEU CD1 C 1.483 7.596 -4.876 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CD1 . . . . . . . . . c25189_2mtw 1 . 1 . 217 . 1 1 14 LEU CD2 C 0.259 7.758 -2.674 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CD2 . . . . . . . . . c25189_2mtw 1 . 1 . 218 . 1 1 14 LEU CG C 1.546 7.271 -3.369 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CG . . . . . . . . . c25189_2mtw 1 . 1 . 219 . 1 1 14 LEU H H 2.281 3.165 -3.139 . . . 1.0 . . . . . . . . . . . . A . 14 LEU H . . . . . . . . . c25189_2mtw 1 . 1 . 220 . 1 1 14 LEU HA H 3.258 5.379 -4.591 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HA . . . . . . . . . c25189_2mtw 1 . 1 . 221 . 1 1 14 LEU HB2 H 0.971 5.183 -3.547 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HB2 . . . . . . . . . c25189_2mtw 1 . 1 . 222 . 1 1 14 LEU HB3 H 1.672 5.605 -1.981 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HB3 . . . . . . . . . c25189_2mtw 1 . 1 . 223 . 1 1 14 LEU HD11 H 1.299 8.672 -5.055 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD11 . . . . . . . . . c25189_2mtw 1 . 1 . 224 . 1 1 14 LEU HD12 H 2.432 7.354 -5.389 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD12 . . . . . . . . . c25189_2mtw 1 . 1 . 225 . 1 1 14 LEU HD13 H 0.679 7.035 -5.389 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD13 . . . . . . . . . c25189_2mtw 1 . 1 . 226 . 1 1 14 LEU HD21 H -0.640 7.232 -3.047 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD21 . . . . . . . . . c25189_2mtw 1 . 1 . 227 . 1 1 14 LEU HD22 H 0.094 8.841 -2.830 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD22 . . . . . . . . . c25189_2mtw 1 . 1 . 228 . 1 1 14 LEU HD23 H 0.302 7.599 -1.580 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD23 . . . . . . . . . c25189_2mtw 1 . 1 . 229 . 1 1 14 LEU HG H 2.381 7.853 -2.935 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HG . . . . . . . . . c25189_2mtw 1 . 1 . 230 . 1 1 14 LEU N N 3.131 3.690 -3.372 . . . 1.0 . . . . . . . . . . . . A . 14 LEU N . . . . . . . . . c25189_2mtw 1 . 1 . 231 . 1 1 14 LEU O O 4.975 6.746 -3.251 . . . 1.0 . . . . . . . . . . . . A . 14 LEU O . . . . . . . . . c25189_2mtw 1 . 1 . 232 . 1 1 15 GLN C C 6.806 4.697 -0.290 . . . 1.0 . . . . . . . . . . . . A . 15 GLN C . . . . . . . . . c25189_2mtw 1 . 1 . 233 . 1 1 15 GLN CA C 5.799 5.824 -0.685 . . . 1.0 . . . . . . . . . . . . A . 15 GLN CA . . . . . . . . . c25189_2mtw 1 . 1 . 234 . 1 1 15 GLN CB C 5.261 6.638 0.526 . . . 1.0 . . . . . . . . . . . . A . 15 GLN CB . . . . . . . . . c25189_2mtw 1 . 1 . 235 . 1 1 15 GLN CD C 4.160 8.835 1.304 . . . 1.0 . . . . . . . . . . . . A . 15 GLN CD . . . . . . . . . c25189_2mtw 1 . 1 . 236 . 1 1 15 GLN CG C 4.552 7.945 0.115 . . . 1.0 . . . . . . . . . . . . A . 15 GLN CG . . . . . . . . . c25189_2mtw 1 . 1 . 237 . 1 1 15 GLN H H 4.106 4.470 -1.264 . . . 1.0 . . . . . . . . . . . . A . 15 GLN H . . . . . . . . . c25189_2mtw 1 . 1 . 238 . 1 1 15 GLN HA H 6.411 6.526 -1.285 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HA . . . . . . . . . c25189_2mtw 1 . 1 . 239 . 1 1 15 GLN HB2 H 4.589 6.014 1.146 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HB2 . . . . . . . . . c25189_2mtw 1 . 1 . 240 . 1 1 15 GLN HB3 H 6.108 6.903 1.188 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HB3 . . . . . . . . . c25189_2mtw 1 . 1 . 241 . 1 1 15 GLN HE21 H 2.304 8.072 1.304 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HE21 . . . . . . . . . c25189_2mtw 1 . 1 . 242 . 1 1 15 GLN HE22 H 2.686 9.348 2.566 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HE22 . . . . . . . . . c25189_2mtw 1 . 1 . 243 . 1 1 15 GLN HG2 H 5.233 8.506 -0.555 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HG2 . . . . . . . . . c25189_2mtw 1 . 1 . 244 . 1 1 15 GLN HG3 H 3.664 7.700 -0.504 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HG3 . . . . . . . . . c25189_2mtw 1 . 1 . 245 . 1 1 15 GLN N N 4.654 5.318 -1.502 . . . 1.0 . . . . . . . . . . . . A . 15 GLN N . . . . . . . . . c25189_2mtw 1 . 1 . 246 . 1 1 15 GLN NE2 N 2.924 8.742 1.773 . . . 1.0 . . . . . . . . . . . . A . 15 GLN NE2 . . . . . . . . . c25189_2mtw 1 . 1 . 247 . 1 1 15 GLN O O 7.217 4.585 0.870 . . . 1.0 . . . . . . . . . . . . A . 15 GLN O . . . . . . . . . c25189_2mtw 1 . 1 . 248 . 1 1 15 GLN OE1 O 4.965 9.618 1.809 . . . 1.0 . . . . . . . . . . . . A . 15 GLN OE1 . . . . . . . . . c25189_2mtw 1 . 1 . 249 . 1 1 16 LYS C C 9.703 3.374 -0.943 . . . 1.0 . . . . . . . . . . . . A . 16 LYS C . . . . . . . . . c25189_2mtw 1 . 1 . 250 . 1 1 16 LYS CA C 8.255 2.821 -1.064 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CA . . . . . . . . . c25189_2mtw 1 . 1 . 251 . 1 1 16 LYS CB C 8.093 1.709 -2.130 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CB . . . . . . . . . c25189_2mtw 1 . 1 . 252 . 1 1 16 LYS CD C 8.885 -0.516 -3.267 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CD . . . . . . . . . c25189_2mtw 1 . 1 . 253 . 1 1 16 LYS CE C 8.772 -0.218 -4.779 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CE . . . . . . . . . c25189_2mtw 1 . 1 . 254 . 1 1 16 LYS CG C 9.227 0.673 -2.340 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CG . . . . . . . . . c25189_2mtw 1 . 1 . 255 . 1 1 16 LYS H H 6.512 3.809 -1.995 . . . 1.0 . . . . . . . . . . . . A . 16 LYS H . . . . . . . . . c25189_2mtw 1 . 1 . 256 . 1 1 16 LYS HA H 7.965 2.294 -0.143 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HA . . . . . . . . . c25189_2mtw 1 . 1 . 257 . 1 1 16 LYS HB2 H 7.214 1.122 -1.817 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HB2 . . . . . . . . . c25189_2mtw 1 . 1 . 258 . 1 1 16 LYS HB3 H 7.846 2.180 -3.090 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HB3 . . . . . . . . . c25189_2mtw 1 . 1 . 259 . 1 1 16 LYS HD2 H 9.694 -1.260 -3.145 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HD2 . . . . . . . . . c25189_2mtw 1 . 1 . 260 . 1 1 16 LYS HD3 H 7.979 -1.038 -2.904 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HD3 . . . . . . . . . c25189_2mtw 1 . 1 . 261 . 1 1 16 LYS HE2 H 9.607 0.425 -5.112 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HE2 . . . . . . . . . c25189_2mtw 1 . 1 . 262 . 1 1 16 LYS HE3 H 8.884 -1.163 -5.341 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HE3 . . . . . . . . . c25189_2mtw 1 . 1 . 263 . 1 1 16 LYS HG2 H 10.137 1.178 -2.714 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HG2 . . . . . . . . . c25189_2mtw 1 . 1 . 264 . 1 1 16 LYS HG3 H 9.511 0.260 -1.355 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HG3 . . . . . . . . . c25189_2mtw 1 . 1 . 265 . 1 1 16 LYS HZ2 H 7.453 0.520 -6.187 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HZ2 . . . . . . . . . c25189_2mtw 1 . 1 . 266 . 1 1 16 LYS HZ3 H 6.713 -0.239 -4.943 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HZ3 . . . . . . . . . c25189_2mtw 1 . 1 . 267 . 1 1 16 LYS N N 7.257 3.907 -1.289 . . . 1.0 . . . . . . . . . . . . A . 16 LYS N . . . . . . . . . c25189_2mtw 1 . 1 . 268 . 1 1 16 LYS NZ N 7.488 0.394 -5.170 . . . 1.0 . . . . . . . . . . . . A . 16 LYS NZ . . . . . . . . . c25189_2mtw 1 . 1 . 269 . 1 1 16 LYS O O 10.136 4.280 -1.662 . . . 1.0 . . . . . . . . . . . . A . 16 LYS O . . . . . . . . . c25189_2mtw 1 . 1 . 270 . 1 1 17 HIS C C 12.754 2.024 -0.488 . . . 1.0 . . . . . . . . . . . . A . 17 HIS C . . . . . . . . . c25189_2mtw 1 . 1 . 271 . 1 1 17 HIS CA C 11.847 3.029 0.282 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CA . . . . . . . . . c25189_2mtw 1 . 1 . 272 . 1 1 17 HIS CB C 12.017 3.023 1.826 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CB . . . . . . . . . c25189_2mtw 1 . 1 . 273 . 1 1 17 HIS CD2 C 10.638 4.259 3.643 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CD2 . . . . . . . . . c25189_2mtw 1 . 1 . 274 . 1 1 17 HIS CE1 C 11.250 6.236 3.268 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CE1 . . . . . . . . . c25189_2mtw 1 . 1 . 275 . 1 1 17 HIS CG C 11.517 4.277 2.548 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CG . . . . . . . . . c25189_2mtw 1 . 1 . 276 . 1 1 17 HIS H H 9.944 1.962 0.440 . . . 1.0 . . . . . . . . . . . . A . 17 HIS H . . . . . . . . . c25189_2mtw 1 . 1 . 277 . 1 1 17 HIS HA H 12.121 4.036 -0.075 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HA . . . . . . . . . c25189_2mtw 1 . 1 . 278 . 1 1 17 HIS HB2 H 11.543 2.116 2.262 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HB2 . . . . . . . . . c25189_2mtw 1 . 1 . 279 . 1 1 17 HIS HB3 H 13.083 2.909 2.054 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HB3 . . . . . . . . . c25189_2mtw 1 . 1 . 280 . 1 1 17 HIS HD2 H 10.214 3.364 4.072 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HD2 . . . . . . . . . c25189_2mtw 1 . 1 . 281 . 1 1 17 HIS HE1 H 11.348 7.307 3.371 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HE1 . . . . . . . . . c25189_2mtw 1 . 1 . 282 . 1 1 17 HIS HE2 H 9.883 5.866 4.921 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HE2 . . . . . . . . . c25189_2mtw 1 . 1 . 283 . 1 1 17 HIS N N 10.428 2.742 -0.014 . . . 1.0 . . . . . . . . . . . . A . 17 HIS N . . . . . . . . . c25189_2mtw 1 . 1 . 284 . 1 1 17 HIS ND1 N 11.947 5.576 2.284 . . . 1.0 . . . . . . . . . . . . A . 17 HIS ND1 . . . . . . . . . c25189_2mtw 1 . 1 . 285 . 1 1 17 HIS NE2 N 10.440 5.539 4.124 . . . 1.0 . . . . . . . . . . . . A . 17 HIS NE2 . . . . . . . . . c25189_2mtw 1 . 1 . 286 . 1 1 17 HIS O O 13.421 2.423 -1.448 . . . 1.0 . . . . . . . . . . . . A . 17 HIS O . . . . . . . . . c25189_2mtw 1 . 1 . 287 . 1 1 18 GLY C C 13.315 -1.653 -0.050 . . . 1.0 . . . . . . . . . . . . A . 18 GLY C . . . . . . . . . c25189_2mtw 1 . 1 . 288 . 1 1 18 GLY CA C 13.546 -0.310 -0.758 . . . 1.0 . . . . . . . . . . . . A . 18 GLY CA . . . . . . . . . c25189_2mtw 1 . 1 . 289 . 1 1 18 GLY H H 12.164 0.566 0.730 . . . 1.0 . . . . . . . . . . . . A . 18 GLY H . . . . . . . . . c25189_2mtw 1 . 1 . 290 . 1 1 18 GLY HA2 H 13.227 -0.398 -1.814 . . . 1.0 . . . . . . . . . . . . A . 18 GLY HA2 . . . . . . . . . c25189_2mtw 1 . 1 . 291 . 1 1 18 GLY HA3 H 14.619 -0.033 -0.787 . . . 1.0 . . . . . . . . . . . . A . 18 GLY HA3 . . . . . . . . . c25189_2mtw 1 . 1 . 292 . 1 1 18 GLY N N 12.763 0.743 -0.082 . . . 1.0 . . . . . . . . . . . . A . 18 GLY N . . . . . . . . . c25189_2mtw 1 . 1 . 293 . 1 1 18 GLY O O 12.240 -2.244 -0.187 . . . 1.0 . . . . . . . . . . . . A . 18 GLY O . . . . . . . . . c25189_2mtw 1 . 1 . 294 . 1 1 19 PHE C C 13.652 -3.061 2.892 . . . 1.0 . . . . . . . . . . . . A . 19 PHE C . . . . . . . . . c25189_2mtw 1 . 1 . 295 . 1 1 19 PHE CA C 14.246 -3.376 1.490 . . . 1.0 . . . . . . . . . . . . A . 19 PHE CA . . . . . . . . . c25189_2mtw 1 . 1 . 296 . 1 1 19 PHE CB C 15.626 -4.097 1.571 . . . 1.0 . . . . . . . . . . . . A . 19 PHE CB . . . . . . . . . c25189_2mtw 1 . 1 . 297 . 1 1 19 PHE CD1 C 15.314 -6.602 1.186 . . . 1.0 . . . . . . . . . . . . A . 19 PHE CD1 . . . . . . . . . c25189_2mtw 1 . 1 . 298 . 1 1 19 PHE CD2 C 15.661 -5.828 3.449 . . . 1.0 . . . . . . . . . . . . A . 19 PHE CD2 . . . . . . . . . c25189_2mtw 1 . 1 . 299 . 1 1 19 PHE CE1 C 15.208 -7.911 1.652 . . . 1.0 . . . . . . . . . . . . A . 19 PHE CE1 . . . . . . . . . c25189_2mtw 1 . 1 . 300 . 1 1 19 PHE CE2 C 15.550 -7.137 3.912 . . . 1.0 . . . . . . . . . . . . A . 19 PHE CE2 . . . . . . . . . c25189_2mtw 1 . 1 . 301 . 1 1 19 PHE CG C 15.541 -5.550 2.081 . . . 1.0 . . . . . . . . . . . . A . 19 PHE CG . . . . . . . . . c25189_2mtw 1 . 1 . 302 . 1 1 19 PHE CZ C 15.325 -8.177 3.014 . . . 1.0 . . . . . . . . . . . . A . 19 PHE CZ . . . . . . . . . c25189_2mtw 1 . 1 . 303 . 1 1 19 PHE H H 15.200 -1.603 0.615 . . . 1.0 . . . . . . . . . . . . A . 19 PHE H . . . . . . . . . c25189_2mtw 1 . 1 . 304 . 1 1 19 PHE HA H 13.587 -4.051 0.923 . . . 1.0 . . . . . . . . . . . . A . 19 PHE HA . . . . . . . . . c25189_2mtw 1 . 1 . 305 . 1 1 19 PHE HB2 H 16.098 -4.103 0.566 . . . 1.0 . . . . . . . . . . . . A . 19 PHE HB2 . . . . . . . . . c25189_2mtw 1 . 1 . 306 . 1 1 19 PHE HB3 H 16.331 -3.528 2.215 . . . 1.0 . . . . . . . . . . . . A . 19 PHE HB3 . . . . . . . . . c25189_2mtw 1 . 1 . 307 . 1 1 19 PHE HD1 H 15.212 -6.410 0.127 . . . 1.0 . . . . . . . . . . . . A . 19 PHE HD1 . . . . . . . . . c25189_2mtw 1 . 1 . 308 . 1 1 19 PHE HD2 H 15.828 -5.031 4.159 . . . 1.0 . . . . . . . . . . . . A . 19 PHE HD2 . . . . . . . . . c25189_2mtw 1 . 1 . 309 . 1 1 19 PHE HE1 H 15.031 -8.719 0.958 . . . 1.0 . . . . . . . . . . . . A . 19 PHE HE1 . . . . . . . . . c25189_2mtw 1 . 1 . 310 . 1 1 19 PHE HE2 H 15.637 -7.344 4.969 . . . 1.0 . . . . . . . . . . . . A . 19 PHE HE2 . . . . . . . . . c25189_2mtw 1 . 1 . 311 . 1 1 19 PHE HZ H 15.239 -9.192 3.375 . . . 1.0 . . . . . . . . . . . . A . 19 PHE HZ . . . . . . . . . c25189_2mtw 1 . 1 . 312 . 1 1 19 PHE N N 14.328 -2.120 0.708 . . . 1.0 . . . . . . . . . . . . A . 19 PHE N . . . . . . . . . c25189_2mtw 1 . 1 . 313 . 1 1 19 PHE O O 14.316 -2.437 3.729 . . . 1.0 . . . . . . . . . . . . A . 19 PHE O . . . . . . . . . c25189_2mtw 1 . 1 . 314 . 1 1 20 HIS C C 11.941 -4.539 5.354 . . . 1.0 . . . . . . . . . . . . A . 20 HIS C . . . . . . . . . c25189_2mtw 1 . 1 . 315 . 1 1 20 HIS CA C 11.711 -3.321 4.420 . . . 1.0 . . . . . . . . . . . . A . 20 HIS CA . . . . . . . . . c25189_2mtw 1 . 1 . 316 . 1 1 20 HIS CB C 10.217 -3.028 4.162 . . . 1.0 . . . . . . . . . . . . A . 20 HIS CB . . . . . . . . . c25189_2mtw 1 . 1 . 317 . 1 1 20 HIS CD2 C 9.235 -0.608 4.042 . . . 1.0 . . . . . . . . . . . . A . 20 HIS CD2 . . . . . . . . . c25189_2mtw 1 . 1 . 318 . 1 1 20 HIS CE1 C 9.551 -0.214 2.003 . . . 1.0 . . . . . . . . . . . . A . 20 HIS CE1 . . . . . . . . . c25189_2mtw 1 . 1 . 319 . 1 1 20 HIS CG C 9.882 -1.703 3.454 . . . 1.0 . . . . . . . . . . . . A . 20 HIS CG . . . . . . . . . c25189_2mtw 1 . 1 . 320 . 1 1 20 HIS H H 11.868 -3.848 2.349 . . . 1.0 . . . . . . . . . . . . A . 20 HIS H . . . . . . . . . c25189_2mtw 1 . 1 . 321 . 1 1 20 HIS HA H 12.070 -2.402 4.879 . . . 1.0 . . . . . . . . . . . . A . 20 HIS HA . . . . . . . . . c25189_2mtw 1 . 1 . 322 . 1 1 20 HIS HB2 H 9.796 -3.818 3.548 . . . 1.0 . . . . . . . . . . . . A . 20 HIS HB2 . . . . . . . . . c25189_2mtw 1 . 1 . 323 . 1 1 20 HIS HB3 H 9.687 -3.127 5.125 . . . 1.0 . . . . . . . . . . . . A . 20 HIS HB3 . . . . . . . . . c25189_2mtw 1 . 1 . 324 . 1 1 20 HIS HD2 H 8.876 -0.585 5.054 . . . 1.0 . . . . . . . . . . . . A . 20 HIS HD2 . . . . . . . . . c25189_2mtw 1 . 1 . 325 . 1 1 20 HIS HE1 H 9.505 0.281 1.046 . . . 1.0 . . . . . . . . . . . . A . 20 HIS HE1 . . . . . . . . . c25189_2mtw 1 . 1 . 326 . 1 1 20 HIS HE2 H 8.532 1.285 3.204 . . . 1.0 . . . . . . . . . . . . A . 20 HIS HE2 . . . . . . . . . c25189_2mtw 1 . 1 . 327 . 1 1 20 HIS N N 12.418 -3.533 3.144 . . . 1.0 . . . . . . . . . . . . A . 20 HIS N . . . . . . . . . c25189_2mtw 1 . 1 . 328 . 1 1 20 HIS ND1 N 10.087 -1.472 2.094 . . . 1.0 . . . . . . . . . . . . A . 20 HIS ND1 . . . . . . . . . c25189_2mtw 1 . 1 . 329 . 1 1 20 HIS NE2 N 9.029 0.392 3.112 . . . 1.0 . . . . . . . . . . . . A . 20 HIS NE2 . . . . . . . . . c25189_2mtw 1 . 1 . 330 . 1 1 20 HIS O O 11.438 -5.641 5.127 . . . 1.0 . . . . . . . . . . . . A . 20 HIS O . . . . . . . . . c25189_2mtw 1 stop_ save_ ########################### # Constraint Statistics # ########################### save_constraint_statistics _Constraint_stat_list.Sf_framecode constraint_statistics _Constraint_stat_list.Sf_category constraint_statistics _Constraint_stat_list.Entry_ID c25189_2mtw _Constraint_stat_list.ID 1 loop_ _Constraint_file.ID _Constraint_file.Constraint_filename _Constraint_file.Software_ID _Constraint_file.Software_label _Constraint_file.Software_name _Constraint_file.Block_ID _Constraint_file.Constraint_type _Constraint_file.Constraint_subtype _Constraint_file.Constraint_subsubtype _Constraint_file.Constraint_number _Constraint_file.Entry_ID _Constraint_file.Constraint_stat_list_ID 1 2mtw.mr . . 'MR format' 1 comment 'Not applicable' 'Not applicable' 0 c25189_2mtw 1 1 2mtw.mr . . DISCOVER 2 stereochemistry prochirality 'Not applicable' 0 c25189_2mtw 1 1 2mtw.mr . . DISCOVER 3 stereochemistry chirality 'Not applicable' 0 c25189_2mtw 1 1 2mtw.mr . . DISCOVER 4 distance NOE simple 252 c25189_2mtw 1 1 2mtw.mr . . DISCOVER 5 'dihedral angle' 'Not applicable' 'Not applicable' 19 c25189_2mtw 1 1 2mtw.mr . . 'MR format' 6 'nomenclature mapping' 'Not applicable' 'Not applicable' 0 c25189_2mtw 1 stop_ save_ save_Discover_distance_constraints_4 _Gen_dist_constraint_list.Sf_category general_distance_constraints _Gen_dist_constraint_list.Sf_framecode Discover_distance_constraints_4 _Gen_dist_constraint_list.Entry_ID c25189_2mtw _Gen_dist_constraint_list.ID 1 _Gen_dist_constraint_list.Constraint_type NOE _Gen_dist_constraint_list.Details 'Generated by Wattos' _Gen_dist_constraint_list.Constraint_file_ID 1 _Gen_dist_constraint_list.Block_ID 4 loop_ _Gen_dist_constraint_software.Software_ID _Gen_dist_constraint_software.Software_label _Gen_dist_constraint_software.Method_ID _Gen_dist_constraint_software.Method_label _Gen_dist_constraint_software.Entry_ID _Gen_dist_constraint_software.Gen_dist_constraint_list_ID . . . . c25189_2mtw 1 stop_ loop_ _Gen_dist_constraint.ID _Gen_dist_constraint.Member_ID _Gen_dist_constraint.Member_logic_code _Gen_dist_constraint.Assembly_atom_ID_1 _Gen_dist_constraint.Entity_assembly_ID_1 _Gen_dist_constraint.Entity_ID_1 _Gen_dist_constraint.Comp_index_ID_1 _Gen_dist_constraint.Seq_ID_1 _Gen_dist_constraint.Comp_ID_1 _Gen_dist_constraint.Atom_ID_1 _Gen_dist_constraint.Atom_type_1 _Gen_dist_constraint.Atom_isotope_number_1 _Gen_dist_constraint.Resonance_ID_1 _Gen_dist_constraint.Assembly_atom_ID_2 _Gen_dist_constraint.Entity_assembly_ID_2 _Gen_dist_constraint.Entity_ID_2 _Gen_dist_constraint.Comp_index_ID_2 _Gen_dist_constraint.Seq_ID_2 _Gen_dist_constraint.Comp_ID_2 _Gen_dist_constraint.Atom_ID_2 _Gen_dist_constraint.Atom_type_2 _Gen_dist_constraint.Atom_isotope_number_2 _Gen_dist_constraint.Resonance_ID_2 _Gen_dist_constraint.Intensity_val _Gen_dist_constraint.Intensity_lower_val_err _Gen_dist_constraint.Intensity_upper_val_err _Gen_dist_constraint.Distance_val _Gen_dist_constraint.Distance_lower_bound_val _Gen_dist_constraint.Distance_upper_bound_val _Gen_dist_constraint.Contribution_fractional_val _Gen_dist_constraint.Spectral_peak_ID _Gen_dist_constraint.Spectral_peak_list_ID _Gen_dist_constraint.PDB_record_ID_1 _Gen_dist_constraint.PDB_model_num_1 _Gen_dist_constraint.PDB_strand_ID_1 _Gen_dist_constraint.PDB_ins_code_1 _Gen_dist_constraint.PDB_residue_no_1 _Gen_dist_constraint.PDB_residue_name_1 _Gen_dist_constraint.PDB_atom_name_1 _Gen_dist_constraint.PDB_record_ID_2 _Gen_dist_constraint.PDB_model_num_2 _Gen_dist_constraint.PDB_strand_ID_2 _Gen_dist_constraint.PDB_ins_code_2 _Gen_dist_constraint.PDB_residue_no_2 _Gen_dist_constraint.PDB_residue_name_2 _Gen_dist_constraint.PDB_atom_name_2 _Gen_dist_constraint.Auth_entity_assembly_ID_1 _Gen_dist_constraint.Auth_asym_ID_1 _Gen_dist_constraint.Auth_chain_ID_1 _Gen_dist_constraint.Auth_seq_ID_1 _Gen_dist_constraint.Auth_comp_ID_1 _Gen_dist_constraint.Auth_atom_ID_1 _Gen_dist_constraint.Auth_alt_ID_1 _Gen_dist_constraint.Auth_atom_name_1 _Gen_dist_constraint.Auth_entity_assembly_ID_2 _Gen_dist_constraint.Auth_asym_ID_2 _Gen_dist_constraint.Auth_chain_ID_2 _Gen_dist_constraint.Auth_seq_ID_2 _Gen_dist_constraint.Auth_comp_ID_2 _Gen_dist_constraint.Auth_atom_ID_2 _Gen_dist_constraint.Auth_alt_ID_2 _Gen_dist_constraint.Auth_atom_name_2 _Gen_dist_constraint.Entry_ID _Gen_dist_constraint.Gen_dist_constraint_list_ID 1 1 . . 1 1 2 2 THR H H . . . 1 1 2 2 THR HA H . . . . . 3.5 2.8 3.5 . . . . . A . 2 THR H . . A . 2 THR HA . 1 . 2 THR HN . . . 1 . 2 THR HA . . c25189_2mtw 1 2 1 . . 1 1 3 3 ASN H H . . . 1 1 3 3 ASN HA H . . . . . 2.8 1.8 2.8 . . . . . A . 3 ASN H . . A . 3 ASN HA . 1 . 3 ASN HN . . . 1 . 3 ASN HA . . c25189_2mtw 1 3 1 . . 1 1 4 4 GLN H H . . . 1 1 4 4 GLN HA H . . . . . 2.8 1.8 2.8 . . . . . A . 4 GLN H . . A . 4 GLN HA . 1 . 4 GLN HN . . . 1 . 4 GLN HA . . c25189_2mtw 1 4 1 . . 1 1 5 5 ASN H H . . . 1 1 5 5 ASN HA H . . . . . 2.8 1.8 2.8 . . . . . A . 5 ASN H . . A . 5 ASN HA . 1 . 5 ASN HN . . . 1 . 5 ASN HA . . c25189_2mtw 1 5 1 . . 1 1 6 6 ILE H H . . . 1 1 6 6 ILE HA H . . . . . 2.8 1.8 2.8 . . . . . A . 6 ILE H . . A . 6 ILE HA . 1 . 6 ILE HN . . . 1 . 6 ILE HA . . c25189_2mtw 1 6 1 . . 1 1 7 7 ASN H H . . . 1 1 7 7 ASN HA H . . . . . 2.8 1.8 2.8 . . . . . A . 7 ASN H . . A . 7 ASN HA . 1 . 7 ASN HN . . . 1 . 7 ASN HA . . c25189_2mtw 1 7 1 . . 1 1 8 8 ILE H H . . . 1 1 8 8 ILE HA H . . . . . 2.8 1.8 2.8 . . . . . A . 8 ILE H . . A . 8 ILE HA . 1 . 8 ILE HN . . . 1 . 8 ILE HA . . c25189_2mtw 1 8 1 . . 1 1 9 9 SER H H . . . 1 1 9 9 SER HA H . . . . . 2.8 1.8 2.8 . . . . . A . 9 SER H . . A . 9 SER HA . 1 . 9 SER HN . . . 1 . 9 SER HA . . c25189_2mtw 1 9 1 . . 1 1 10 10 GLN H H . . . 1 1 10 10 GLN HA H . . . . . 2.8 1.8 2.8 . . . . . A . 10 GLN H . . A . 10 GLN HA . 1 . 10 GLN HN . . . 1 . 10 GLN HA . . c25189_2mtw 1 10 1 . . 1 1 11 11 GLU H H . . . 1 1 11 11 GLU HA H . . . . . 2.8 1.8 2.8 . . . . . A . 11 GLU H . . A . 11 GLU HA . 1 . 11 GLU HN . . . 1 . 11 GLU HA . . c25189_2mtw 1 11 1 . . 1 1 12 12 ARG H H . . . 1 1 12 12 ARG HA H . . . . . 2.8 1.8 2.8 . . . . . A . 12 ARG H . . A . 12 ARG HA . 1 . 12 ARG HN . . . 1 . 12 ARG HA . . c25189_2mtw 1 12 1 . . 1 1 13 13 ASP H H . . . 1 1 13 13 ASP HA H . . . . . 2.8 1.8 2.8 . . . . . A . 13 ASP H . . A . 13 ASP HA . 1 . 13 ASP HN . . . 1 . 13 ASP HA . . c25189_2mtw 1 13 1 . . 1 1 14 14 LEU H H . . . 1 1 14 14 LEU HA H . . . . . 2.8 1.8 2.8 . . . . . A . 14 LEU H . . A . 14 LEU HA . 1 . 14 LEU HN . . . 1 . 14 LEU HA . . c25189_2mtw 1 14 1 . . 1 1 15 15 GLN H H . . . 1 1 15 15 GLN HA H . . . . . 2.8 1.8 2.8 . . . . . A . 15 GLN H . . A . 15 GLN HA . 1 . 15 GLN HN . . . 1 . 15 GLN HA . . c25189_2mtw 1 15 1 . . 1 1 16 16 LYS H H . . . 1 1 16 16 LYS HA H . . . . . 2.8 1.8 2.8 . . . . . A . 16 LYS H . . A . 16 LYS HA . 1 . 16 LYS HN . . . 1 . 16 LYS HA . . c25189_2mtw 1 16 1 . . 1 1 17 17 HIS H H . . . 1 1 17 17 HIS HA H . . . . . 3.5 2.8 3.5 . . . . . A . 17 HIS H . . A . 17 HIS HA . 1 . 17 HIS HN . . . 1 . 17 HIS HA . . c25189_2mtw 1 17 1 . . 1 1 19 19 PHE H H . . . 1 1 19 19 PHE HA H . . . . . 2.8 1.8 2.8 . . . . . A . 19 PHE H . . A . 19 PHE HA . 1 . 19 PHE HN . . . 1 . 19 PHE HA . . c25189_2mtw 1 18 1 . . 1 1 20 20 HIS H H . . . 1 1 20 20 HIS HA H . . . . . 3.5 2.8 3.5 . . . . . A . 20 HIS H . . A . 20 HIS HA . 1 . 20 HIS HN . . . 1 . 20 HIS HA . . c25189_2mtw 1 19 1 . . 1 1 1 1 TYR HA H . . . 1 1 2 2 THR H H . . . . . 2.8 1.8 2.8 . . . . . A . 1 TYR HA . . A . 2 THR H . 1 . 1 TYR HA . . . 1 . 2 THR HN . . c25189_2mtw 1 20 1 . . 1 1 2 2 THR HA H . . . 1 1 3 3 ASN H H . . . . . 2.8 1.8 2.8 . . . . . A . 2 THR HA . . A . 3 ASN H . 1 . 2 THR HA . . . 1 . 3 ASN HN . . c25189_2mtw 1 21 1 . . 1 1 3 3 ASN HA H . . . 1 1 4 4 GLN H H . . . . . 2.8 1.8 2.8 . . . . . A . 3 ASN HA . . A . 4 GLN H . 1 . 3 ASN HA . . . 1 . 4 GLN HN . . c25189_2mtw 1 22 1 . . 1 1 4 4 GLN HA H . . . 1 1 5 5 ASN H H . . . . . 2.8 1.8 2.8 . . . . . A . 4 GLN HA . . A . 5 ASN H . 1 . 4 GLN HA . . . 1 . 5 ASN HN . . c25189_2mtw 1 23 1 . . 1 1 5 5 ASN HA H . . . 1 1 6 6 ILE H H . . . . . 2.8 1.8 2.8 . . . . . A . 5 ASN HA . . A . 6 ILE H . 1 . 5 ASN HA . . . 1 . 6 ILE HN . . c25189_2mtw 1 24 1 . . 1 1 6 6 ILE HA H . . . 1 1 7 7 ASN H H . . . . . 2.8 1.8 2.8 . . . . . A . 6 ILE HA . . A . 7 ASN H . 1 . 6 ILE HA . . . 1 . 7 ASN HN . . c25189_2mtw 1 25 1 . . 1 1 7 7 ASN HA H . . . 1 1 8 8 ILE H H . . . . . 2.8 1.8 2.8 . . . . . A . 7 ASN HA . . A . 8 ILE H . 1 . 7 ASN HA . . . 1 . 8 ILE HN . . c25189_2mtw 1 26 1 . . 1 1 8 8 ILE HA H . . . 1 1 9 9 SER H H . . . . . 2.8 1.8 2.8 . . . . . A . 8 ILE HA . . A . 9 SER H . 1 . 8 ILE HA . . . 1 . 9 SER HN . . c25189_2mtw 1 27 1 . . 1 1 9 9 SER HA H . . . 1 1 10 10 GLN H H . . . . . 2.8 1.8 2.8 . . . . . A . 9 SER HA . . A . 10 GLN H . 1 . 9 SER HA . . . 1 . 10 GLN HN . . c25189_2mtw 1 28 1 . . 1 1 10 10 GLN HA H . . . 1 1 11 11 GLU H H . . . . . 3.5 2.8 3.5 . . . . . A . 10 GLN HA . . A . 11 GLU H . 1 . 10 GLN HA . . . 1 . 11 GLU HN . . c25189_2mtw 1 29 1 . . 1 1 11 11 GLU HA H . . . 1 1 12 12 ARG H H . . . . . 3.5 2.8 3.5 . . . . . A . 11 GLU HA . . A . 12 ARG H . 1 . 11 GLU HA . . . 1 . 12 ARG HN . . c25189_2mtw 1 30 1 . . 1 1 12 12 ARG HA H . . . 1 1 13 13 ASP H H . . . . . 3.5 2.8 3.5 . . . . . A . 12 ARG HA . . A . 13 ASP H . 1 . 12 ARG HA . . . 1 . 13 ASP HN . . c25189_2mtw 1 31 1 . . 1 1 13 13 ASP HA H . . . 1 1 14 14 LEU H H . . . . . 2.8 1.8 2.8 . . . . . A . 13 ASP HA . . A . 14 LEU H . 1 . 13 ASP HA . . . 1 . 14 LEU HN . . c25189_2mtw 1 32 1 . . 1 1 14 14 LEU HA H . . . 1 1 15 15 GLN H H . . . . . 3.5 2.8 3.5 . . . . . A . 14 LEU HA . . A . 15 GLN H . 1 . 14 LEU HA . . . 1 . 15 GLN HN . . c25189_2mtw 1 33 1 . . 1 1 15 15 GLN HA H . . . 1 1 16 16 LYS H H . . . . . 3.5 2.8 3.5 . . . . . A . 15 GLN HA . . A . 16 LYS H . 1 . 15 GLN HA . . . 1 . 16 LYS HN . . c25189_2mtw 1 34 1 . . 1 1 16 16 LYS HA H . . . 1 1 17 17 HIS H H . . . . . 2.8 1.8 2.8 . . . . . A . 16 LYS HA . . A . 17 HIS H . 1 . 16 LYS HA . . . 1 . 17 HIS HN . . c25189_2mtw 1 35 1 . . 1 1 17 17 HIS HA H . . . 1 1 18 18 GLY H H . . . . . 2.8 1.8 2.8 . . . . . A . 17 HIS HA . . A . 18 GLY H . 1 . 17 HIS HA . . . 1 . 18 GLY HN . . c25189_2mtw 1 36 1 . . 1 1 19 19 PHE HA H . . . 1 1 20 20 HIS H H . . . . . 2.8 1.8 2.8 . . . . . A . 19 PHE HA . . A . 20 HIS H . 1 . 19 PHE HA . . . 1 . 20 HIS HN . . c25189_2mtw 1 37 1 . . 1 1 1 1 TYR HA H . . . 1 1 3 3 ASN H H . . . . . 5.0 3.5 5.0 . . . . . A . 1 TYR HA . . A . 3 ASN H . 1 . 1 TYR HA . . . 1 . 3 ASN HN . . c25189_2mtw 1 38 1 . . 1 1 5 5 ASN HA H . . . 1 1 7 7 ASN H H . . . . . 5.0 3.5 5.0 . . . . . A . 5 ASN HA . . A . 7 ASN H . 1 . 5 ASN HA . . . 1 . 7 ASN HN . . c25189_2mtw 1 39 1 . . 1 1 6 6 ILE HA H . . . 1 1 8 8 ILE H H . . . . . 5.0 3.5 5.0 . . . . . A . 6 ILE HA . . A . 8 ILE H . 1 . 6 ILE HA . . . 1 . 8 ILE HN . . c25189_2mtw 1 40 1 . . 1 1 7 7 ASN HA H . . . 1 1 9 9 SER H H . . . . . 5.0 3.5 5.0 . . . . . A . 7 ASN HA . . A . 9 SER H . 1 . 7 ASN HA . . . 1 . 9 SER HN . . c25189_2mtw 1 41 1 . . 1 1 17 17 HIS HA H . . . 1 1 19 19 PHE H H . . . . . 5.0 3.5 5.0 . . . . . A . 17 HIS HA . . A . 19 PHE H . 1 . 17 HIS HA . . . 1 . 19 PHE HN . . c25189_2mtw 1 42 1 . . 1 1 6 6 ILE HA H . . . 1 1 9 9 SER H H . . . . . 3.5 2.8 3.5 . . . . . A . 6 ILE HA . . A . 9 SER H . 1 . 6 ILE HA . . . 1 . 9 SER HN . . c25189_2mtw 1 43 1 . . 1 1 7 7 ASN HA H . . . 1 1 10 10 GLN H H . . . . . 3.5 2.8 3.5 . . . . . A . 7 ASN HA . . A . 10 GLN H . 1 . 7 ASN HA . . . 1 . 10 GLN HN . . c25189_2mtw 1 44 1 . . 1 1 8 8 ILE HA H . . . 1 1 11 11 GLU H H . . . . . 2.8 1.8 2.8 . . . . . A . 8 ILE HA . . A . 11 GLU H . 1 . 8 ILE HA . . . 1 . 11 GLU HN . . c25189_2mtw 1 45 1 . . 1 1 9 9 SER HA H . . . 1 1 12 12 ARG H H . . . . . 2.8 1.8 2.8 . . . . . A . 9 SER HA . . A . 12 ARG H . 1 . 9 SER HA . . . 1 . 12 ARG HN . . c25189_2mtw 1 46 1 . . 1 1 10 10 GLN HA H . . . 1 1 13 13 ASP H H . . . . . 2.8 1.8 2.8 . . . . . A . 10 GLN HA . . A . 13 ASP H . 1 . 10 GLN HA . . . 1 . 13 ASP HN . . c25189_2mtw 1 47 1 . . 1 1 11 11 GLU HA H . . . 1 1 14 14 LEU H H . . . . . 3.5 2.8 3.5 . . . . . A . 11 GLU HA . . A . 14 LEU H . 1 . 11 GLU HA . . . 1 . 14 LEU HN . . c25189_2mtw 1 48 1 . . 1 1 13 13 ASP HA H . . . 1 1 16 16 LYS H H . . . . . 2.8 1.8 2.8 . . . . . A . 13 ASP HA . . A . 16 LYS H . 1 . 13 ASP HA . . . 1 . 16 LYS HN . . c25189_2mtw 1 49 1 . . 1 1 14 14 LEU HA H . . . 1 1 17 17 HIS H H . . . . . 3.5 2.8 3.5 . . . . . A . 14 LEU HA . . A . 17 HIS H . 1 . 14 LEU HA . . . 1 . 17 HIS HN . . c25189_2mtw 1 50 1 . . 1 1 4 4 GLN HA H . . . 1 1 8 8 ILE H H . . . . . 5.0 3.5 5.0 . . . . . A . 4 GLN HA . . A . 8 ILE H . 1 . 4 GLN HA . . . 1 . 8 ILE HN . . c25189_2mtw 1 51 1 . . 1 1 6 6 ILE HA H . . . 1 1 10 10 GLN H H . . . . . 5.0 3.5 5.0 . . . . . A . 6 ILE HA . . A . 10 GLN H . 1 . 6 ILE HA . . . 1 . 10 GLN HN . . c25189_2mtw 1 52 1 . . 1 1 8 8 ILE HA H . . . 1 1 12 12 ARG H H . . . . . 5.0 3.5 5.0 . . . . . A . 8 ILE HA . . A . 12 ARG H . 1 . 8 ILE HA . . . 1 . 12 ARG HN . . c25189_2mtw 1 53 1 . . 1 1 2 2 THR H H . . . 1 1 3 3 ASN H H . . . . . 2.8 1.8 2.8 . . . . . A . 2 THR H . . A . 3 ASN H . 1 . 2 THR HN . . . 1 . 3 ASN HN . . c25189_2mtw 1 54 1 . . 1 1 3 3 ASN H H . . . 1 1 4 4 GLN H H . . . . . 2.8 1.8 2.8 . . . . . A . 3 ASN H . . A . 4 GLN H . 1 . 3 ASN HN . . . 1 . 4 GLN HN . . c25189_2mtw 1 55 1 . . 1 1 5 5 ASN H H . . . 1 1 6 6 ILE H H . . . . . 2.8 1.8 2.8 . . . . . A . 5 ASN H . . A . 6 ILE H . 1 . 5 ASN HN . . . 1 . 6 ILE HN . . c25189_2mtw 1 56 1 . . 1 1 7 7 ASN H H . . . 1 1 8 8 ILE H H . . . . . 2.8 1.8 2.8 . . . . . A . 7 ASN H . . A . 8 ILE H . 1 . 7 ASN HN . . . 1 . 8 ILE HN . . c25189_2mtw 1 57 1 . . 1 1 6 6 ILE H H . . . 1 1 7 7 ASN H H . . . . . 2.8 1.8 2.8 . . . . . A . 6 ILE H . . A . 7 ASN H . 1 . 6 ILE HN . . . 1 . 7 ASN HN . . c25189_2mtw 1 58 1 . . 1 1 8 8 ILE H H . . . 1 1 9 9 SER H H . . . . . 2.8 1.8 2.8 . . . . . A . 8 ILE H . . A . 9 SER H . 1 . 8 ILE HN . . . 1 . 9 SER HN . . c25189_2mtw 1 59 1 . . 1 1 10 10 GLN H H . . . 1 1 11 11 GLU H H . . . . . 2.8 1.8 2.8 . . . . . A . 10 GLN H . . A . 11 GLU H . 1 . 10 GLN HN . . . 1 . 11 GLU HN . . c25189_2mtw 1 60 1 . . 1 1 11 11 GLU H H . . . 1 1 12 12 ARG H H . . . . . 2.8 1.8 2.8 . . . . . A . 11 GLU H . . A . 12 ARG H . 1 . 11 GLU HN . . . 1 . 12 ARG HN . . c25189_2mtw 1 61 1 . . 1 1 12 12 ARG H H . . . 1 1 13 13 ASP H H . . . . . 2.8 1.8 2.8 . . . . . A . 12 ARG H . . A . 13 ASP H . 1 . 12 ARG HN . . . 1 . 13 ASP HN . . c25189_2mtw 1 62 1 . . 1 1 13 13 ASP H H . . . 1 1 14 14 LEU H H . . . . . 2.8 1.8 2.8 . . . . . A . 13 ASP H . . A . 14 LEU H . 1 . 13 ASP HN . . . 1 . 14 LEU HN . . c25189_2mtw 1 63 1 . . 1 1 14 14 LEU H H . . . 1 1 15 15 GLN H H . . . . . 2.8 1.8 2.8 . . . . . A . 14 LEU H . . A . 15 GLN H . 1 . 14 LEU HN . . . 1 . 15 GLN HN . . c25189_2mtw 1 64 1 . . 1 1 16 16 LYS H H . . . 1 1 17 17 HIS H H . . . . . 2.8 1.8 2.8 . . . . . A . 16 LYS H . . A . 17 HIS H . 1 . 16 LYS HN . . . 1 . 17 HIS HN . . c25189_2mtw 1 65 1 . . 1 1 17 17 HIS H H . . . 1 1 18 18 GLY H H . . . . . 2.8 1.8 2.8 . . . . . A . 17 HIS H . . A . 18 GLY H . 1 . 17 HIS HN . . . 1 . 18 GLY HN . . c25189_2mtw 1 66 1 . . 1 1 10 10 GLN H H . . . 1 1 12 12 ARG H H . . . . . 5.0 3.5 5.0 . . . . . A . 10 GLN H . . A . 12 ARG H . 1 . 10 GLN HN . . . 1 . 12 ARG HN . . c25189_2mtw 1 67 1 . . 1 1 11 11 GLU H H . . . 1 1 13 13 ASP H H . . . . . 5.0 3.5 5.0 . . . . . A . 11 GLU H . . A . 13 ASP H . 1 . 11 GLU HN . . . 1 . 13 ASP HN . . c25189_2mtw 1 68 1 OR . 1 1 4 4 GLN HA H . . . 1 1 7 7 ASN HB2 H . . . . . 3.5 2.8 4.5 . . . . . A . 4 GLN HA . . A . 7 ASN HB2 . 1 . 4 GLN HA . . . 1 . 7 ASN HB* . . c25189_2mtw 1 68 2 OR . 1 1 4 4 GLN HA H . . . 1 1 7 7 ASN HB3 H . . . . . 3.5 2.8 4.5 . . . . . A . 4 GLN HA . . A . 7 ASN HB3 . 1 . 4 GLN HA . . . 1 . 7 ASN HB* . . c25189_2mtw 1 69 1 OR . 1 1 7 7 ASN HA H . . . 1 1 10 10 GLN HB2 H . . . . . 3.5 2.8 4.5 . . . . . A . 7 ASN HA . . A . 10 GLN HB2 . 1 . 7 ASN HA . . . 1 . 10 GLN HB* . . c25189_2mtw 1 69 2 OR . 1 1 7 7 ASN HA H . . . 1 1 10 10 GLN HB3 H . . . . . 3.5 2.8 4.5 . . . . . A . 7 ASN HA . . A . 10 GLN HB3 . 1 . 7 ASN HA . . . 1 . 10 GLN HB* . . c25189_2mtw 1 70 1 OR . 1 1 8 8 ILE HA H . . . 1 1 11 11 GLU HB2 H . . . . . 2.8 1.8 3.8 . . . . . A . 8 ILE HA . . A . 11 GLU HB2 . 1 . 8 ILE HA . . . 1 . 11 GLU HB* . . c25189_2mtw 1 70 2 OR . 1 1 8 8 ILE HA H . . . 1 1 11 11 GLU HB3 H . . . . . 2.8 1.8 3.8 . . . . . A . 8 ILE HA . . A . 11 GLU HB3 . 1 . 8 ILE HA . . . 1 . 11 GLU HB* . . c25189_2mtw 1 71 1 OR . 1 1 9 9 SER HA H . . . 1 1 12 12 ARG HB2 H . . . . . 3.5 2.8 4.5 . . . . . A . 9 SER HA . . A . 12 ARG HB2 . 1 . 9 SER HA . . . 1 . 12 ARG HB* . . c25189_2mtw 1 71 2 OR . 1 1 9 9 SER HA H . . . 1 1 12 12 ARG HB3 H . . . . . 3.5 2.8 4.5 . . . . . A . 9 SER HA . . A . 12 ARG HB3 . 1 . 9 SER HA . . . 1 . 12 ARG HB* . . c25189_2mtw 1 72 1 . . 1 1 10 10 GLN HA H . . . 1 1 13 13 ASP HB3 H . . . . . 3.5 2.8 3.5 . . . . . A . 10 GLN HA . . A . 13 ASP HB3 . 1 . 10 GLN HA . . . 1 . 13 ASP HBR . . c25189_2mtw 1 73 1 . . 1 1 10 10 GLN HA H . . . 1 1 13 13 ASP HB2 H . . . . . 3.5 2.8 3.5 . . . . . A . 10 GLN HA . . A . 13 ASP HB2 . 1 . 10 GLN HA . . . 1 . 13 ASP HBS . . c25189_2mtw 1 74 1 OR . 1 1 11 11 GLU HA H . . . 1 1 14 14 LEU HB2 H . . . . . 3.5 2.8 4.5 . . . . . A . 11 GLU HA . . A . 14 LEU HB2 . 1 . 11 GLU HA . . . 1 . 14 LEU HB* . . c25189_2mtw 1 74 2 OR . 1 1 11 11 GLU HA H . . . 1 1 14 14 LEU HB3 H . . . . . 3.5 2.8 4.5 . . . . . A . 11 GLU HA . . A . 14 LEU HB3 . 1 . 11 GLU HA . . . 1 . 14 LEU HB* . . c25189_2mtw 1 75 1 OR . 1 1 12 12 ARG HA H . . . 1 1 15 15 GLN HB2 H . . . . . 3.5 2.8 4.5 . . . . . A . 12 ARG HA . . A . 15 GLN HB2 . 1 . 12 ARG HA . . . 1 . 15 GLN HB* . . c25189_2mtw 1 75 2 OR . 1 1 12 12 ARG HA H . . . 1 1 15 15 GLN HB3 H . . . . . 3.5 2.8 4.5 . . . . . A . 12 ARG HA . . A . 15 GLN HB3 . 1 . 12 ARG HA . . . 1 . 15 GLN HB* . . c25189_2mtw 1 76 1 OR . 1 1 13 13 ASP HA H . . . 1 1 16 16 LYS HB2 H . . . . . 3.5 2.8 4.5 . . . . . A . 13 ASP HA . . A . 16 LYS HB2 . 1 . 13 ASP HA . . . 1 . 16 LYS HB* . . c25189_2mtw 1 76 2 OR . 1 1 13 13 ASP HA H . . . 1 1 16 16 LYS HB3 H . . . . . 3.5 2.8 4.5 . . . . . A . 13 ASP HA . . A . 16 LYS HB3 . 1 . 13 ASP HA . . . 1 . 16 LYS HB* . . c25189_2mtw 1 77 1 . . 1 1 14 14 LEU HA H . . . 1 1 17 17 HIS HB2 H . . . . . 2.8 1.8 2.8 . . . . . A . 14 LEU HA . . A . 17 HIS HB2 . 1 . 14 LEU HA . . . 1 . 17 HIS HBS . . c25189_2mtw 1 78 1 . . 1 1 14 14 LEU HA H . . . 1 1 17 17 HIS HB3 H . . . . . 2.8 1.8 2.8 . . . . . A . 14 LEU HA . . A . 17 HIS HB3 . 1 . 14 LEU HA . . . 1 . 17 HIS HBR . . c25189_2mtw 1 79 1 . . 1 1 2 2 THR H H . . . 1 1 2 2 THR HB H . . . . . 2.8 1.8 2.8 . . . . . A . 2 THR H . . A . 2 THR HB . 1 . 2 THR HN . . . 1 . 2 THR HB . . c25189_2mtw 1 80 1 . . 1 1 2 2 THR H H . . . 1 1 2 2 THR MG H . . . . . 2.8 1.8 3.8 . . . . . A . 2 THR H . . A . 2 THR MG . 1 . 2 THR HN . . . 1 . 2 THR HG2* . . c25189_2mtw 1 81 1 . . 1 1 3 3 ASN H H . . . 1 1 3 3 ASN HB2 H . . . . . 2.8 1.8 2.8 . . . . . A . 3 ASN H . . A . 3 ASN HB2 . 1 . 3 ASN HN . . . 1 . 3 ASN HBS . . c25189_2mtw 1 82 1 . . 1 1 3 3 ASN H H . . . 1 1 3 3 ASN HB3 H . . . . . 2.8 1.8 2.8 . . . . . A . 3 ASN H . . A . 3 ASN HB3 . 1 . 3 ASN HN . . . 1 . 3 ASN HBR . . c25189_2mtw 1 83 1 . . 1 1 4 4 GLN H H . . . 1 1 4 4 GLN HB2 H . . . . . 2.8 1.8 2.8 . . . . . A . 4 GLN H . . A . 4 GLN HB2 . 1 . 4 GLN HN . . . 1 . 4 GLN HBR . . c25189_2mtw 1 84 1 . . 1 1 4 4 GLN H H . . . 1 1 4 4 GLN HB3 H . . . . . 2.8 1.8 2.8 . . . . . A . 4 GLN H . . A . 4 GLN HB3 . 1 . 4 GLN HN . . . 1 . 4 GLN HBS . . c25189_2mtw 1 85 1 OR . 1 1 4 4 GLN H H . . . 1 1 4 4 GLN HG2 H . . . . . 3.5 2.8 4.5 . . . . . A . 4 GLN H . . A . 4 GLN HG2 . 1 . 4 GLN HN . . . 1 . 4 GLN HG* . . c25189_2mtw 1 85 2 OR . 1 1 4 4 GLN H H . . . 1 1 4 4 GLN HG3 H . . . . . 3.5 2.8 4.5 . . . . . A . 4 GLN H . . A . 4 GLN HG3 . 1 . 4 GLN HN . . . 1 . 4 GLN HG* . . c25189_2mtw 1 86 1 OR . 1 1 5 5 ASN H H . . . 1 1 5 5 ASN HB2 H . . . . . 2.8 1.8 3.8 . . . . . A . 5 ASN H . . A . 5 ASN HB2 . 1 . 5 ASN HN . . . 1 . 5 ASN HB* . . c25189_2mtw 1 86 2 OR . 1 1 5 5 ASN H H . . . 1 1 5 5 ASN HB3 H . . . . . 2.8 1.8 3.8 . . . . . A . 5 ASN H . . A . 5 ASN HB3 . 1 . 5 ASN HN . . . 1 . 5 ASN HB* . . c25189_2mtw 1 87 1 . . 1 1 6 6 ILE H H . . . 1 1 6 6 ILE HB H . . . . . 2.8 1.8 2.8 . . . . . A . 6 ILE H . . A . 6 ILE HB . 1 . 6 ILE HN . . . 1 . 6 ILE HB . . c25189_2mtw 1 88 1 . . 1 1 6 6 ILE H H . . . 1 1 6 6 ILE HG12 H . . . . . 2.8 1.8 2.8 . . . . . A . 6 ILE H . . A . 6 ILE HG12 . 1 . 6 ILE HN . . . 1 . 6 ILE HG1R . . c25189_2mtw 1 89 1 . . 1 1 6 6 ILE H H . . . 1 1 6 6 ILE HG13 H . . . . . 3.5 2.8 3.5 . . . . . A . 6 ILE H . . A . 6 ILE HG13 . 1 . 6 ILE HN . . . 1 . 6 ILE HG1S . . c25189_2mtw 1 90 1 . . 1 1 6 6 ILE H H . . . 1 1 6 6 ILE MD H . . . . . 2.8 1.8 3.8 . . . . . A . 6 ILE H . . A . 6 ILE MD . 1 . 6 ILE HN . . . 1 . 6 ILE HD1* . . c25189_2mtw 1 91 1 OR . 1 1 7 7 ASN H H . . . 1 1 7 7 ASN HB2 H . . . . . 2.8 1.8 3.8 . . . . . A . 7 ASN H . . A . 7 ASN HB2 . 1 . 7 ASN HN . . . 1 . 7 ASN HB* . . c25189_2mtw 1 91 2 OR . 1 1 7 7 ASN H H . . . 1 1 7 7 ASN HB3 H . . . . . 2.8 1.8 3.8 . . . . . A . 7 ASN H . . A . 7 ASN HB3 . 1 . 7 ASN HN . . . 1 . 7 ASN HB* . . c25189_2mtw 1 92 1 . . 1 1 8 8 ILE H H . . . 1 1 8 8 ILE HB H . . . . . 2.8 1.8 2.8 . . . . . A . 8 ILE H . . A . 8 ILE HB . 1 . 8 ILE HN . . . 1 . 8 ILE HB . . c25189_2mtw 1 93 1 . . 1 1 8 8 ILE H H . . . 1 1 8 8 ILE HG12 H . . . . . 2.8 1.8 2.8 . . . . . A . 8 ILE H . . A . 8 ILE HG12 . 1 . 8 ILE HN . . . 1 . 8 ILE HG1R . . c25189_2mtw 1 94 1 . . 1 1 8 8 ILE H H . . . 1 1 8 8 ILE HG13 H . . . . . 2.8 1.8 2.8 . . . . . A . 8 ILE H . . A . 8 ILE HG13 . 1 . 8 ILE HN . . . 1 . 8 ILE HG1S . . c25189_2mtw 1 95 1 . . 1 1 8 8 ILE H H . . . 1 1 8 8 ILE MD H . . . . . 2.8 1.8 3.8 . . . . . A . 8 ILE H . . A . 8 ILE MD . 1 . 8 ILE HN . . . 1 . 8 ILE HD1* . . c25189_2mtw 1 96 1 . . 1 1 9 9 SER H H . . . 1 1 9 9 SER HB2 H . . . . . 2.8 1.8 2.8 . . . . . A . 9 SER H . . A . 9 SER HB2 . 1 . 9 SER HN . . . 1 . 9 SER HBS . . c25189_2mtw 1 97 1 . . 1 1 9 9 SER H H . . . 1 1 9 9 SER HB3 H . . . . . 2.8 1.8 2.8 . . . . . A . 9 SER H . . A . 9 SER HB3 . 1 . 9 SER HN . . . 1 . 9 SER HBR . . c25189_2mtw 1 98 1 OR . 1 1 10 10 GLN H H . . . 1 1 10 10 GLN HB2 H . . . . . 2.8 1.8 3.8 . . . . . A . 10 GLN H . . A . 10 GLN HB2 . 1 . 10 GLN HN . . . 1 . 10 GLN HB* . . c25189_2mtw 1 98 2 OR . 1 1 10 10 GLN H H . . . 1 1 10 10 GLN HB3 H . . . . . 2.8 1.8 3.8 . . . . . A . 10 GLN H . . A . 10 GLN HB3 . 1 . 10 GLN HN . . . 1 . 10 GLN HB* . . c25189_2mtw 1 99 1 . . 1 1 10 10 GLN H H . . . 1 1 10 10 GLN HG2 H . . . . . 2.8 1.8 2.8 . . . . . A . 10 GLN H . . A . 10 GLN HG2 . 1 . 10 GLN HN . . . 1 . 10 GLN HGS . . c25189_2mtw 1 100 1 . . 1 1 10 10 GLN H H . . . 1 1 10 10 GLN HG3 H . . . . . 2.8 1.8 2.8 . . . . . A . 10 GLN H . . A . 10 GLN HG3 . 1 . 10 GLN HN . . . 1 . 10 GLN HGR . . c25189_2mtw 1 101 1 OR . 1 1 11 11 GLU H H . . . 1 1 11 11 GLU HB2 H . . . . . 2.8 1.8 3.8 . . . . . A . 11 GLU H . . A . 11 GLU HB2 . 1 . 11 GLU HN . . . 1 . 11 GLU HB* . . c25189_2mtw 1 101 2 OR . 1 1 11 11 GLU H H . . . 1 1 11 11 GLU HB3 H . . . . . 2.8 1.8 3.8 . . . . . A . 11 GLU H . . A . 11 GLU HB3 . 1 . 11 GLU HN . . . 1 . 11 GLU HB* . . c25189_2mtw 1 102 1 . . 1 1 11 11 GLU H H . . . 1 1 11 11 GLU HG2 H . . . . . 3.5 2.8 3.5 . . . . . A . 11 GLU H . . A . 11 GLU HG2 . 1 . 11 GLU HN . . . 1 . 11 GLU HGS . . c25189_2mtw 1 103 1 . . 1 1 11 11 GLU H H . . . 1 1 11 11 GLU HG3 H . . . . . 3.5 2.8 3.5 . . . . . A . 11 GLU H . . A . 11 GLU HG3 . 1 . 11 GLU HN . . . 1 . 11 GLU HGR . . c25189_2mtw 1 104 1 OR . 1 1 12 12 ARG H H . . . 1 1 12 12 ARG HD2 H . . . . . 3.5 2.8 4.5 . . . . . A . 12 ARG H . . A . 12 ARG HD2 . 1 . 12 ARG HN . . . 1 . 12 ARG HD* . . c25189_2mtw 1 104 2 OR . 1 1 12 12 ARG H H . . . 1 1 12 12 ARG HD3 H . . . . . 3.5 2.8 4.5 . . . . . A . 12 ARG H . . A . 12 ARG HD3 . 1 . 12 ARG HN . . . 1 . 12 ARG HD* . . c25189_2mtw 1 105 1 OR . 1 1 12 12 ARG H H . . . 1 1 12 12 ARG HB2 H . . . . . 2.8 1.8 3.8 . . . . . A . 12 ARG H . . A . 12 ARG HB2 . 1 . 12 ARG HN . . . 1 . 12 ARG HB* . . c25189_2mtw 1 105 2 OR . 1 1 12 12 ARG H H . . . 1 1 12 12 ARG HB3 H . . . . . 2.8 1.8 3.8 . . . . . A . 12 ARG H . . A . 12 ARG HB3 . 1 . 12 ARG HN . . . 1 . 12 ARG HB* . . c25189_2mtw 1 106 1 . . 1 1 12 12 ARG H H . . . 1 1 12 12 ARG HG2 H . . . . . 2.8 1.8 2.8 . . . . . A . 12 ARG H . . A . 12 ARG HG2 . 1 . 12 ARG HN . . . 1 . 12 ARG HGS . . c25189_2mtw 1 107 1 . . 1 1 12 12 ARG H H . . . 1 1 12 12 ARG HG3 H . . . . . 2.8 1.8 2.8 . . . . . A . 12 ARG H . . A . 12 ARG HG3 . 1 . 12 ARG HN . . . 1 . 12 ARG HGR . . c25189_2mtw 1 108 1 . . 1 1 13 13 ASP H H . . . 1 1 13 13 ASP HB2 H . . . . . 3.5 2.8 3.5 . . . . . A . 13 ASP H . . A . 13 ASP HB2 . 1 . 13 ASP HN . . . 1 . 13 ASP HBS . . c25189_2mtw 1 109 1 . . 1 1 13 13 ASP H H . . . 1 1 13 13 ASP HB3 H . . . . . 3.5 2.8 3.5 . . . . . A . 13 ASP H . . A . 13 ASP HB3 . 1 . 13 ASP HN . . . 1 . 13 ASP HBR . . c25189_2mtw 1 110 1 OR . 1 1 14 14 LEU H H . . . 1 1 14 14 LEU HB2 H . . . . . 2.8 1.8 3.8 . . . . . A . 14 LEU H . . A . 14 LEU HB2 . 1 . 14 LEU HN . . . 1 . 14 LEU HB* . . c25189_2mtw 1 110 2 OR . 1 1 14 14 LEU H H . . . 1 1 14 14 LEU HB3 H . . . . . 2.8 1.8 3.8 . . . . . A . 14 LEU H . . A . 14 LEU HB3 . 1 . 14 LEU HN . . . 1 . 14 LEU HB* . . c25189_2mtw 1 111 1 . . 1 1 14 14 LEU H H . . . 1 1 14 14 LEU MD1 H . . . . . 2.8 1.8 3.8 . . . . . A . 14 LEU H . . A . 14 LEU MD1 . 1 . 14 LEU HN . . . 1 . 14 LEU HDR* . . c25189_2mtw 1 112 1 . . 1 1 14 14 LEU H H . . . 1 1 14 14 LEU MD2 H . . . . . 2.8 1.8 3.8 . . . . . A . 14 LEU H . . A . 14 LEU MD2 . 1 . 14 LEU HN . . . 1 . 14 LEU HDS* . . c25189_2mtw 1 113 1 OR . 1 1 15 15 GLN H H . . . 1 1 15 15 GLN HB2 H . . . . . 2.8 1.8 3.8 . . . . . A . 15 GLN H . . A . 15 GLN HB2 . 1 . 15 GLN HN . . . 1 . 15 GLN HB* . . c25189_2mtw 1 113 2 OR . 1 1 15 15 GLN H H . . . 1 1 15 15 GLN HB3 H . . . . . 2.8 1.8 3.8 . . . . . A . 15 GLN H . . A . 15 GLN HB3 . 1 . 15 GLN HN . . . 1 . 15 GLN HB* . . c25189_2mtw 1 114 1 . . 1 1 15 15 GLN H H . . . 1 1 15 15 GLN HG2 H . . . . . 2.8 1.8 2.8 . . . . . A . 15 GLN H . . A . 15 GLN HG2 . 1 . 15 GLN HN . . . 1 . 15 GLN HGS . . c25189_2mtw 1 115 1 . . 1 1 15 15 GLN H H . . . 1 1 15 15 GLN HG3 H . . . . . 2.8 1.8 2.8 . . . . . A . 15 GLN H . . A . 15 GLN HG3 . 1 . 15 GLN HN . . . 1 . 15 GLN HGR . . c25189_2mtw 1 116 1 OR . 1 1 16 16 LYS H H . . . 1 1 16 16 LYS HB2 H . . . . . 2.8 1.8 3.8 . . . . . A . 16 LYS H . . A . 16 LYS HB2 . 1 . 16 LYS HN . . . 1 . 16 LYS HB* . . c25189_2mtw 1 116 2 OR . 1 1 16 16 LYS H H . . . 1 1 16 16 LYS HB3 H . . . . . 2.8 1.8 3.8 . . . . . A . 16 LYS H . . A . 16 LYS HB3 . 1 . 16 LYS HN . . . 1 . 16 LYS HB* . . c25189_2mtw 1 117 1 OR . 1 1 16 16 LYS H H . . . 1 1 16 16 LYS HD2 H . . . . . 2.8 1.8 3.8 . . . . . A . 16 LYS H . . A . 16 LYS HD2 . 1 . 16 LYS HN . . . 1 . 16 LYS HD* . . c25189_2mtw 1 117 2 OR . 1 1 16 16 LYS H H . . . 1 1 16 16 LYS HD3 H . . . . . 2.8 1.8 3.8 . . . . . A . 16 LYS H . . A . 16 LYS HD3 . 1 . 16 LYS HN . . . 1 . 16 LYS HD* . . c25189_2mtw 1 118 1 . . 1 1 16 16 LYS H H . . . 1 1 16 16 LYS HG2 H . . . . . 2.8 1.8 2.8 . . . . . A . 16 LYS H . . A . 16 LYS HG2 . 1 . 16 LYS HN . . . 1 . 16 LYS HGR . . c25189_2mtw 1 119 1 . . 1 1 16 16 LYS H H . . . 1 1 16 16 LYS HG3 H . . . . . 2.8 1.8 2.8 . . . . . A . 16 LYS H . . A . 16 LYS HG3 . 1 . 16 LYS HN . . . 1 . 16 LYS HGS . . c25189_2mtw 1 120 1 . . 1 1 17 17 HIS H H . . . 1 1 17 17 HIS HB2 H . . . . . 2.8 1.8 2.8 . . . . . A . 17 HIS H . . A . 17 HIS HB2 . 1 . 17 HIS HN . . . 1 . 17 HIS HBS . . c25189_2mtw 1 121 1 . . 1 1 17 17 HIS H H . . . 1 1 17 17 HIS HB3 H . . . . . 2.8 1.8 2.8 . . . . . A . 17 HIS H . . A . 17 HIS HB3 . 1 . 17 HIS HN . . . 1 . 17 HIS HBR . . c25189_2mtw 1 122 1 OR . 1 1 19 19 PHE H H . . . 1 1 19 19 PHE HB2 H . . . . . 2.8 1.8 3.8 . . . . . A . 19 PHE H . . A . 19 PHE HB2 . 1 . 19 PHE HN . . . 1 . 19 PHE HB* . . c25189_2mtw 1 122 2 OR . 1 1 19 19 PHE H H . . . 1 1 19 19 PHE HB3 H . . . . . 2.8 1.8 3.8 . . . . . A . 19 PHE H . . A . 19 PHE HB3 . 1 . 19 PHE HN . . . 1 . 19 PHE HB* . . c25189_2mtw 1 123 1 . . 1 1 20 20 HIS H H . . . 1 1 20 20 HIS HB2 H . . . . . 3.5 2.8 3.5 . . . . . A . 20 HIS H . . A . 20 HIS HB2 . 1 . 20 HIS HN . . . 1 . 20 HIS HBS . . c25189_2mtw 1 124 1 . . 1 1 20 20 HIS H H . . . 1 1 20 20 HIS HB3 H . . . . . 3.5 2.8 3.5 . . . . . A . 20 HIS H . . A . 20 HIS HB3 . 1 . 20 HIS HN . . . 1 . 20 HIS HBR . . c25189_2mtw 1 125 1 . . 1 1 18 18 GLY H H . . . 1 1 17 17 HIS HB2 H . . . . . 3.5 2.8 3.5 . . . . . A . 18 GLY H . . A . 17 HIS HB2 . 1 . 18 GLY HN . . . 1 . 17 HIS HBS . . c25189_2mtw 1 126 1 . . 1 1 18 18 GLY H H . . . 1 1 17 17 HIS HB3 H . . . . . 3.5 2.8 3.5 . . . . . A . 18 GLY H . . A . 17 HIS HB3 . 1 . 18 GLY HN . . . 1 . 17 HIS HBR . . c25189_2mtw 1 127 1 . . 1 1 2 2 THR H H . . . 1 1 1 1 TYR HB2 H . . . . . 3.5 2.8 3.5 . . . . . A . 2 THR H . . A . 1 TYR HB2 . 1 . 2 THR HN . . . 1 . 1 TYR HBR . . c25189_2mtw 1 128 1 . . 1 1 2 2 THR H H . . . 1 1 1 1 TYR HB3 H . . . . . 3.5 2.8 3.5 . . . . . A . 2 THR H . . A . 1 TYR HB3 . 1 . 2 THR HN . . . 1 . 1 TYR HBS . . c25189_2mtw 1 129 1 . . 1 1 14 14 LEU H H . . . 1 1 13 13 ASP HB2 H . . . . . 3.5 2.8 3.5 . . . . . A . 14 LEU H . . A . 13 ASP HB2 . 1 . 14 LEU HN . . . 1 . 13 ASP HBS . . c25189_2mtw 1 130 1 . . 1 1 14 14 LEU H H . . . 1 1 13 13 ASP HB3 H . . . . . 3.5 2.8 3.5 . . . . . A . 14 LEU H . . A . 13 ASP HB3 . 1 . 14 LEU HN . . . 1 . 13 ASP HBR . . c25189_2mtw 1 131 1 OR . 1 1 20 20 HIS H H . . . 1 1 19 19 PHE HB2 H . . . . . 3.5 2.8 4.5 . . . . . A . 20 HIS H . . A . 19 PHE HB2 . 1 . 20 HIS HN . . . 1 . 19 PHE HB* . . c25189_2mtw 1 131 2 OR . 1 1 20 20 HIS H H . . . 1 1 19 19 PHE HB3 H . . . . . 3.5 2.8 4.5 . . . . . A . 20 HIS H . . A . 19 PHE HB3 . 1 . 20 HIS HN . . . 1 . 19 PHE HB* . . c25189_2mtw 1 132 1 OR . 1 1 9 9 SER H H . . . 1 1 7 7 ASN HB2 H . . . . . 3.5 2.8 4.5 . . . . . A . 9 SER H . . A . 7 ASN HB2 . 1 . 9 SER HN . . . 1 . 7 ASN HB* . . c25189_2mtw 1 132 2 OR . 1 1 9 9 SER H H . . . 1 1 7 7 ASN HB3 H . . . . . 3.5 2.8 4.5 . . . . . A . 9 SER H . . A . 7 ASN HB3 . 1 . 9 SER HN . . . 1 . 7 ASN HB* . . c25189_2mtw 1 133 1 OR . 1 1 8 8 ILE H H . . . 1 1 7 7 ASN HB2 H . . . . . 2.8 1.8 3.8 . . . . . A . 8 ILE H . . A . 7 ASN HB2 . 1 . 8 ILE HN . . . 1 . 7 ASN HB* . . c25189_2mtw 1 133 2 OR . 1 1 8 8 ILE H H . . . 1 1 7 7 ASN HB3 H . . . . . 2.8 1.8 3.8 . . . . . A . 8 ILE H . . A . 7 ASN HB3 . 1 . 8 ILE HN . . . 1 . 7 ASN HB* . . c25189_2mtw 1 134 1 OR . 1 1 6 6 ILE H H . . . 1 1 5 5 ASN HB2 H . . . . . 2.8 1.8 3.8 . . . . . A . 6 ILE H . . A . 5 ASN HB2 . 1 . 6 ILE HN . . . 1 . 5 ASN HB* . . c25189_2mtw 1 134 2 OR . 1 1 6 6 ILE H H . . . 1 1 5 5 ASN HB3 H . . . . . 2.8 1.8 3.8 . . . . . A . 6 ILE H . . A . 5 ASN HB3 . 1 . 6 ILE HN . . . 1 . 5 ASN HB* . . c25189_2mtw 1 135 1 . . 1 1 4 4 GLN H H . . . 1 1 3 3 ASN HB3 H . . . . . 3.5 2.8 3.5 . . . . . A . 4 GLN H . . A . 3 ASN HB3 . 1 . 4 GLN HN . . . 1 . 3 ASN HBR . . c25189_2mtw 1 136 1 . . 1 1 4 4 GLN H H . . . 1 1 3 3 ASN HB2 H . . . . . 3.5 2.8 3.5 . . . . . A . 4 GLN H . . A . 3 ASN HB2 . 1 . 4 GLN HN . . . 1 . 3 ASN HBS . . c25189_2mtw 1 137 1 . . 1 1 5 5 ASN H H . . . 1 1 4 4 GLN HB2 H . . . . . 3.5 2.8 3.5 . . . . . A . 5 ASN H . . A . 4 GLN HB2 . 1 . 5 ASN HN . . . 1 . 4 GLN HBR . . c25189_2mtw 1 138 1 . . 1 1 5 5 ASN H H . . . 1 1 4 4 GLN HB3 H . . . . . 3.5 2.8 3.5 . . . . . A . 5 ASN H . . A . 4 GLN HB3 . 1 . 5 ASN HN . . . 1 . 4 GLN HBS . . c25189_2mtw 1 139 1 OR . 1 1 12 12 ARG H H . . . 1 1 11 11 GLU HB2 H . . . . . 2.8 1.8 3.8 . . . . . A . 12 ARG H . . A . 11 GLU HB2 . 1 . 12 ARG HN . . . 1 . 11 GLU HB* . . c25189_2mtw 1 139 2 OR . 1 1 12 12 ARG H H . . . 1 1 11 11 GLU HB3 H . . . . . 2.8 1.8 3.8 . . . . . A . 12 ARG H . . A . 11 GLU HB3 . 1 . 12 ARG HN . . . 1 . 11 GLU HB* . . c25189_2mtw 1 140 1 OR . 1 1 5 5 ASN H H . . . 1 1 4 4 GLN HG2 H . . . . . 3.5 2.8 4.5 . . . . . A . 5 ASN H . . A . 4 GLN HG2 . 1 . 5 ASN HN . . . 1 . 4 GLN HG* . . c25189_2mtw 1 140 2 OR . 1 1 5 5 ASN H H . . . 1 1 4 4 GLN HG3 H . . . . . 3.5 2.8 4.5 . . . . . A . 5 ASN H . . A . 4 GLN HG3 . 1 . 5 ASN HN . . . 1 . 4 GLN HG* . . c25189_2mtw 1 141 1 . . 1 1 7 7 ASN H H . . . 1 1 6 6 ILE HB H . . . . . 2.8 1.8 2.8 . . . . . A . 7 ASN H . . A . 6 ILE HB . 1 . 7 ASN HN . . . 1 . 6 ILE HB . . c25189_2mtw 1 142 1 OR . 1 1 11 11 GLU H H . . . 1 1 10 10 GLN HB2 H . . . . . 2.8 1.8 3.8 . . . . . A . 11 GLU H . . A . 10 GLN HB2 . 1 . 11 GLU HN . . . 1 . 10 GLN HB* . . c25189_2mtw 1 142 2 OR . 1 1 11 11 GLU H H . . . 1 1 10 10 GLN HB3 H . . . . . 2.8 1.8 3.8 . . . . . A . 11 GLU H . . A . 10 GLN HB3 . 1 . 11 GLU HN . . . 1 . 10 GLN HB* . . c25189_2mtw 1 143 1 . . 1 1 9 9 SER H H . . . 1 1 8 8 ILE HB H . . . . . 2.8 1.8 2.8 . . . . . A . 9 SER H . . A . 8 ILE HB . 1 . 9 SER HN . . . 1 . 8 ILE HB . . c25189_2mtw 1 144 1 . . 1 1 7 7 ASN H H . . . 1 1 6 6 ILE HG13 H . . . . . 3.5 2.8 3.5 . . . . . A . 7 ASN H . . A . 6 ILE HG13 . 1 . 7 ASN HN . . . 1 . 6 ILE HG1S . . c25189_2mtw 1 145 1 . . 1 1 9 9 SER H H . . . 1 1 8 8 ILE MD H . . . . . 2.8 1.8 3.8 . . . . . A . 9 SER H . . A . 8 ILE MD . 1 . 9 SER HN . . . 1 . 8 ILE HD1* . . c25189_2mtw 1 146 1 . . 1 1 7 7 ASN H H . . . 1 1 6 6 ILE MD H . . . . . 2.8 1.8 3.8 . . . . . A . 7 ASN H . . A . 6 ILE MD . 1 . 7 ASN HN . . . 1 . 6 ILE HD1* . . c25189_2mtw 1 147 1 . . 1 1 1 1 TYR HA H . . . 1 1 1 1 TYR HB2 H . . . . . 2.8 1.8 2.8 . . . . . A . 1 TYR HA . . A . 1 TYR HB2 . 1 . 1 TYR HA . . . 1 . 1 TYR HBR . . c25189_2mtw 1 148 1 . . 1 1 1 1 TYR HA H . . . 1 1 1 1 TYR HB3 H . . . . . 2.8 1.8 2.8 . . . . . A . 1 TYR HA . . A . 1 TYR HB3 . 1 . 1 TYR HA . . . 1 . 1 TYR HBS . . c25189_2mtw 1 149 1 . . 1 1 1 1 TYR HB2 H . . . 1 1 1 1 TYR HB3 H . . . . . 2.8 1.8 2.8 . . . . . A . 1 TYR HB2 . . A . 1 TYR HB3 . 1 . 1 TYR HBR . . . 1 . 1 TYR HBS . . c25189_2mtw 1 150 1 . . 1 1 2 2 THR HA H . . . 1 1 2 2 THR HB H . . . . . 2.8 1.8 2.8 . . . . . A . 2 THR HA . . A . 2 THR HB . 1 . 2 THR HA . . . 1 . 2 THR HB . . c25189_2mtw 1 151 1 . . 1 1 2 2 THR HA H . . . 1 1 2 2 THR MG H . . . . . 2.8 1.8 3.8 . . . . . A . 2 THR HA . . A . 2 THR MG . 1 . 2 THR HA . . . 1 . 2 THR HG2* . . c25189_2mtw 1 152 1 . . 1 1 2 2 THR HB H . . . 1 1 2 2 THR MG H . . . . . 2.8 1.8 3.8 . . . . . A . 2 THR HB . . A . 2 THR MG . 1 . 2 THR HB . . . 1 . 2 THR HG2* . . c25189_2mtw 1 153 1 . . 1 1 3 3 ASN HA H . . . 1 1 3 3 ASN HB2 H . . . . . 2.8 1.8 2.8 . . . . . A . 3 ASN HA . . A . 3 ASN HB2 . 1 . 3 ASN HA . . . 1 . 3 ASN HBS . . c25189_2mtw 1 154 1 . . 1 1 3 3 ASN HA H . . . 1 1 3 3 ASN HB3 H . . . . . 2.8 1.8 2.8 . . . . . A . 3 ASN HA . . A . 3 ASN HB3 . 1 . 3 ASN HA . . . 1 . 3 ASN HBR . . c25189_2mtw 1 155 1 . . 1 1 3 3 ASN HB2 H . . . 1 1 3 3 ASN HB3 H . . . . . 2.8 1.8 2.8 . . . . . A . 3 ASN HB2 . . A . 3 ASN HB3 . 1 . 3 ASN HBS . . . 1 . 3 ASN HBR . . c25189_2mtw 1 156 1 . . 1 1 4 4 GLN HA H . . . 1 1 4 4 GLN HB2 H . . . . . 2.8 1.8 2.8 . . . . . A . 4 GLN HA . . A . 4 GLN HB2 . 1 . 4 GLN HA . . . 1 . 4 GLN HBR . . c25189_2mtw 1 157 1 . . 1 1 4 4 GLN HA H . . . 1 1 4 4 GLN HB3 H . . . . . 2.8 1.8 2.8 . . . . . A . 4 GLN HA . . A . 4 GLN HB3 . 1 . 4 GLN HA . . . 1 . 4 GLN HBS . . c25189_2mtw 1 158 1 OR . 1 1 4 4 GLN HA H . . . 1 1 4 4 GLN HG2 H . . . . . 2.8 1.8 3.8 . . . . . A . 4 GLN HA . . A . 4 GLN HG2 . 1 . 4 GLN HA . . . 1 . 4 GLN HG* . . c25189_2mtw 1 158 2 OR . 1 1 4 4 GLN HA H . . . 1 1 4 4 GLN HG3 H . . . . . 2.8 1.8 3.8 . . . . . A . 4 GLN HA . . A . 4 GLN HG3 . 1 . 4 GLN HA . . . 1 . 4 GLN HG* . . c25189_2mtw 1 159 1 . . 1 1 4 4 GLN HB2 H . . . 1 1 4 4 GLN HB3 H . . . . . 2.8 1.8 2.8 . . . . . A . 4 GLN HB2 . . A . 4 GLN HB3 . 1 . 4 GLN HBR . . . 1 . 4 GLN HBS . . c25189_2mtw 1 160 1 OR . 1 1 4 4 GLN HB3 H . . . 1 1 4 4 GLN HG2 H . . . . . 2.8 1.8 3.8 . . . . . A . 4 GLN HB3 . . A . 4 GLN HG2 . 1 . 4 GLN HBS . . . 1 . 4 GLN HG* . . c25189_2mtw 1 160 2 OR . 1 1 4 4 GLN HB3 H . . . 1 1 4 4 GLN HG3 H . . . . . 2.8 1.8 3.8 . . . . . A . 4 GLN HB3 . . A . 4 GLN HG3 . 1 . 4 GLN HBS . . . 1 . 4 GLN HG* . . c25189_2mtw 1 161 1 OR . 1 1 4 4 GLN HB2 H . . . 1 1 4 4 GLN HG2 H . . . . . 2.8 1.8 3.8 . . . . . A . 4 GLN HB2 . . A . 4 GLN HG2 . 1 . 4 GLN HBR . . . 1 . 4 GLN HG* . . c25189_2mtw 1 161 2 OR . 1 1 4 4 GLN HB2 H . . . 1 1 4 4 GLN HG3 H . . . . . 2.8 1.8 3.8 . . . . . A . 4 GLN HB2 . . A . 4 GLN HG3 . 1 . 4 GLN HBR . . . 1 . 4 GLN HG* . . c25189_2mtw 1 162 1 OR . 1 1 5 5 ASN HA H . . . 1 1 5 5 ASN HB2 H . . . . . 2.8 1.8 3.8 . . . . . A . 5 ASN HA . . A . 5 ASN HB2 . 1 . 5 ASN HA . . . 1 . 5 ASN HB* . . c25189_2mtw 1 162 2 OR . 1 1 5 5 ASN HA H . . . 1 1 5 5 ASN HB3 H . . . . . 2.8 1.8 3.8 . . . . . A . 5 ASN HA . . A . 5 ASN HB3 . 1 . 5 ASN HA . . . 1 . 5 ASN HB* . . c25189_2mtw 1 163 1 . . 1 1 6 6 ILE HA H . . . 1 1 6 6 ILE HB H . . . . . 2.8 1.8 2.8 . . . . . A . 6 ILE HA . . A . 6 ILE HB . 1 . 6 ILE HA . . . 1 . 6 ILE HB . . c25189_2mtw 1 164 1 . . 1 1 6 6 ILE HA H . . . 1 1 6 6 ILE HG12 H . . . . . 2.8 1.8 2.8 . . . . . A . 6 ILE HA . . A . 6 ILE HG12 . 1 . 6 ILE HA . . . 1 . 6 ILE HG1R . . c25189_2mtw 1 165 1 . . 1 1 6 6 ILE HA H . . . 1 1 6 6 ILE HG13 H . . . . . 2.8 1.8 2.8 . . . . . A . 6 ILE HA . . A . 6 ILE HG13 . 1 . 6 ILE HA . . . 1 . 6 ILE HG1S . . c25189_2mtw 1 166 1 . . 1 1 6 6 ILE HA H . . . 1 1 6 6 ILE MD H . . . . . 2.8 1.8 3.8 . . . . . A . 6 ILE HA . . A . 6 ILE MD . 1 . 6 ILE HA . . . 1 . 6 ILE HD1* . . c25189_2mtw 1 167 1 . . 1 1 6 6 ILE HB H . . . 1 1 6 6 ILE HG12 H . . . . . 2.8 1.8 2.8 . . . . . A . 6 ILE HB . . A . 6 ILE HG12 . 1 . 6 ILE HB . . . 1 . 6 ILE HG1R . . c25189_2mtw 1 168 1 . . 1 1 6 6 ILE HB H . . . 1 1 6 6 ILE HG13 H . . . . . 2.8 1.8 2.8 . . . . . A . 6 ILE HB . . A . 6 ILE HG13 . 1 . 6 ILE HB . . . 1 . 6 ILE HG1S . . c25189_2mtw 1 169 1 . . 1 1 6 6 ILE HB H . . . 1 1 6 6 ILE MD H . . . . . 2.8 1.8 3.8 . . . . . A . 6 ILE HB . . A . 6 ILE MD . 1 . 6 ILE HB . . . 1 . 6 ILE HD1* . . c25189_2mtw 1 170 1 . . 1 1 6 6 ILE HG12 H . . . 1 1 6 6 ILE HG13 H . . . . . 2.8 1.8 2.8 . . . . . A . 6 ILE HG12 . . A . 6 ILE HG13 . 1 . 6 ILE HG1R . . . 1 . 6 ILE HG1S . . c25189_2mtw 1 171 1 . . 1 1 6 6 ILE HG12 H . . . 1 1 6 6 ILE MD H . . . . . 2.8 1.8 3.8 . . . . . A . 6 ILE HG12 . . A . 6 ILE MD . 1 . 6 ILE HG1R . . . 1 . 6 ILE HD1* . . c25189_2mtw 1 172 1 . . 1 1 6 6 ILE HG13 H . . . 1 1 6 6 ILE MD H . . . . . 2.8 1.8 3.8 . . . . . A . 6 ILE HG13 . . A . 6 ILE MD . 1 . 6 ILE HG1S . . . 1 . 6 ILE HD1* . . c25189_2mtw 1 173 1 OR . 1 1 7 7 ASN HA H . . . 1 1 7 7 ASN HB2 H . . . . . 2.8 1.8 3.8 . . . . . A . 7 ASN HA . . A . 7 ASN HB2 . 1 . 7 ASN HA . . . 1 . 7 ASN HB* . . c25189_2mtw 1 173 2 OR . 1 1 7 7 ASN HA H . . . 1 1 7 7 ASN HB3 H . . . . . 2.8 1.8 3.8 . . . . . A . 7 ASN HA . . A . 7 ASN HB3 . 1 . 7 ASN HA . . . 1 . 7 ASN HB* . . c25189_2mtw 1 174 1 . . 1 1 8 8 ILE HA H . . . 1 1 8 8 ILE HB H . . . . . 2.8 1.8 2.8 . . . . . A . 8 ILE HA . . A . 8 ILE HB . 1 . 8 ILE HA . . . 1 . 8 ILE HB . . c25189_2mtw 1 175 1 . . 1 1 8 8 ILE HA H . . . 1 1 8 8 ILE HG12 H . . . . . 2.8 1.8 2.8 . . . . . A . 8 ILE HA . . A . 8 ILE HG12 . 1 . 8 ILE HA . . . 1 . 8 ILE HG1R . . c25189_2mtw 1 176 1 . . 1 1 8 8 ILE HA H . . . 1 1 8 8 ILE HG13 H . . . . . 2.8 1.8 2.8 . . . . . A . 8 ILE HA . . A . 8 ILE HG13 . 1 . 8 ILE HA . . . 1 . 8 ILE HG1S . . c25189_2mtw 1 177 1 . . 1 1 8 8 ILE HA H . . . 1 1 8 8 ILE MD H . . . . . 2.8 1.8 3.8 . . . . . A . 8 ILE HA . . A . 8 ILE MD . 1 . 8 ILE HA . . . 1 . 8 ILE HD1* . . c25189_2mtw 1 178 1 . . 1 1 8 8 ILE HB H . . . 1 1 8 8 ILE HG12 H . . . . . 2.8 1.8 2.8 . . . . . A . 8 ILE HB . . A . 8 ILE HG12 . 1 . 8 ILE HB . . . 1 . 8 ILE HG1R . . c25189_2mtw 1 179 1 . . 1 1 8 8 ILE HB H . . . 1 1 8 8 ILE HG13 H . . . . . 2.8 1.8 2.8 . . . . . A . 8 ILE HB . . A . 8 ILE HG13 . 1 . 8 ILE HB . . . 1 . 8 ILE HG1S . . c25189_2mtw 1 180 1 . . 1 1 8 8 ILE HB H . . . 1 1 8 8 ILE MD H . . . . . 2.8 1.8 3.8 . . . . . A . 8 ILE HB . . A . 8 ILE MD . 1 . 8 ILE HB . . . 1 . 8 ILE HD1* . . c25189_2mtw 1 181 1 . . 1 1 8 8 ILE HG12 H . . . 1 1 8 8 ILE HG13 H . . . . . 2.8 1.8 2.8 . . . . . A . 8 ILE HG12 . . A . 8 ILE HG13 . 1 . 8 ILE HG1R . . . 1 . 8 ILE HG1S . . c25189_2mtw 1 182 1 . . 1 1 8 8 ILE HG12 H . . . 1 1 8 8 ILE MD H . . . . . 2.8 1.8 3.8 . . . . . A . 8 ILE HG12 . . A . 8 ILE MD . 1 . 8 ILE HG1R . . . 1 . 8 ILE HD1* . . c25189_2mtw 1 183 1 . . 1 1 8 8 ILE HG13 H . . . 1 1 8 8 ILE MD H . . . . . 2.8 1.8 3.8 . . . . . A . 8 ILE HG13 . . A . 8 ILE MD . 1 . 8 ILE HG1S . . . 1 . 8 ILE HD1* . . c25189_2mtw 1 184 1 . . 1 1 9 9 SER HA H . . . 1 1 9 9 SER HB2 H . . . . . 2.8 1.8 2.8 . . . . . A . 9 SER HA . . A . 9 SER HB2 . 1 . 9 SER HA . . . 1 . 9 SER HBS . . c25189_2mtw 1 185 1 . . 1 1 9 9 SER HA H . . . 1 1 9 9 SER HB3 H . . . . . 2.8 1.8 2.8 . . . . . A . 9 SER HA . . A . 9 SER HB3 . 1 . 9 SER HA . . . 1 . 9 SER HBR . . c25189_2mtw 1 186 1 . . 1 1 9 9 SER HB2 H . . . 1 1 9 9 SER HB3 H . . . . . 2.8 1.8 2.8 . . . . . A . 9 SER HB2 . . A . 9 SER HB3 . 1 . 9 SER HBS . . . 1 . 9 SER HBR . . c25189_2mtw 1 187 1 OR . 1 1 10 10 GLN HA H . . . 1 1 10 10 GLN HB2 H . . . . . 2.8 1.8 3.8 . . . . . A . 10 GLN HA . . A . 10 GLN HB2 . 1 . 10 GLN HA . . . 1 . 10 GLN HB* . . c25189_2mtw 1 187 2 OR . 1 1 10 10 GLN HA H . . . 1 1 10 10 GLN HB3 H . . . . . 2.8 1.8 3.8 . . . . . A . 10 GLN HA . . A . 10 GLN HB3 . 1 . 10 GLN HA . . . 1 . 10 GLN HB* . . c25189_2mtw 1 188 1 . . 1 1 10 10 GLN HA H . . . 1 1 10 10 GLN HG2 H . . . . . 2.8 1.8 2.8 . . . . . A . 10 GLN HA . . A . 10 GLN HG2 . 1 . 10 GLN HA . . . 1 . 10 GLN HGS . . c25189_2mtw 1 189 1 . . 1 1 10 10 GLN HA H . . . 1 1 10 10 GLN HG3 H . . . . . 2.8 1.8 2.8 . . . . . A . 10 GLN HA . . A . 10 GLN HG3 . 1 . 10 GLN HA . . . 1 . 10 GLN HGR . . c25189_2mtw 1 190 1 OR . 1 1 10 10 GLN HG2 H . . . 1 1 10 10 GLN HB2 H . . . . . 2.8 1.8 3.8 . . . . . A . 10 GLN HG2 . . A . 10 GLN HB2 . 1 . 10 GLN HGS . . . 1 . 10 GLN HB* . . c25189_2mtw 1 190 2 OR . 1 1 10 10 GLN HB3 H . . . 1 1 10 10 GLN HG2 H . . . . . 2.8 1.8 3.8 . . . . . A . 10 GLN HB3 . . A . 10 GLN HG2 . 1 . 10 GLN HB* . . . 1 . 10 GLN HGS . . c25189_2mtw 1 191 1 OR . 1 1 10 10 GLN HG3 H . . . 1 1 10 10 GLN HB2 H . . . . . 2.8 1.8 3.8 . . . . . A . 10 GLN HG3 . . A . 10 GLN HB2 . 1 . 10 GLN HGR . . . 1 . 10 GLN HB* . . c25189_2mtw 1 191 2 OR . 1 1 10 10 GLN HB3 H . . . 1 1 10 10 GLN HG3 H . . . . . 2.8 1.8 3.8 . . . . . A . 10 GLN HB3 . . A . 10 GLN HG3 . 1 . 10 GLN HB* . . . 1 . 10 GLN HGR . . c25189_2mtw 1 192 1 . . 1 1 10 10 GLN HG2 H . . . 1 1 10 10 GLN HG3 H . . . . . 2.8 1.8 2.8 . . . . . A . 10 GLN HG2 . . A . 10 GLN HG3 . 1 . 10 GLN HGS . . . 1 . 10 GLN HGR . . c25189_2mtw 1 193 1 OR . 1 1 11 11 GLU HA H . . . 1 1 11 11 GLU HB2 H . . . . . 2.8 1.8 3.8 . . . . . A . 11 GLU HA . . A . 11 GLU HB2 . 1 . 11 GLU HA . . . 1 . 11 GLU HB* . . c25189_2mtw 1 193 2 OR . 1 1 11 11 GLU HA H . . . 1 1 11 11 GLU HB3 H . . . . . 2.8 1.8 3.8 . . . . . A . 11 GLU HA . . A . 11 GLU HB3 . 1 . 11 GLU HA . . . 1 . 11 GLU HB* . . c25189_2mtw 1 194 1 . . 1 1 11 11 GLU HA H . . . 1 1 11 11 GLU HG2 H . . . . . 2.8 1.8 2.8 . . . . . A . 11 GLU HA . . A . 11 GLU HG2 . 1 . 11 GLU HA . . . 1 . 11 GLU HGS . . c25189_2mtw 1 195 1 . . 1 1 11 11 GLU HA H . . . 1 1 11 11 GLU HG3 H . . . . . 2.8 1.8 2.8 . . . . . A . 11 GLU HA . . A . 11 GLU HG3 . 1 . 11 GLU HA . . . 1 . 11 GLU HGR . . c25189_2mtw 1 196 1 OR . 1 1 11 11 GLU HG2 H . . . 1 1 11 11 GLU HB2 H . . . . . 2.8 1.8 3.8 . . . . . A . 11 GLU HG2 . . A . 11 GLU HB2 . 1 . 11 GLU HGS . . . 1 . 11 GLU HB* . . c25189_2mtw 1 196 2 OR . 1 1 11 11 GLU HB3 H . . . 1 1 11 11 GLU HG2 H . . . . . 2.8 1.8 3.8 . . . . . A . 11 GLU HB3 . . A . 11 GLU HG2 . 1 . 11 GLU HB* . . . 1 . 11 GLU HGS . . c25189_2mtw 1 197 1 OR . 1 1 11 11 GLU HG3 H . . . 1 1 11 11 GLU HB2 H . . . . . 2.8 1.8 3.8 . . . . . A . 11 GLU HG3 . . A . 11 GLU HB2 . 1 . 11 GLU HGR . . . 1 . 11 GLU HB* . . c25189_2mtw 1 197 2 OR . 1 1 11 11 GLU HB3 H . . . 1 1 11 11 GLU HG3 H . . . . . 2.8 1.8 3.8 . . . . . A . 11 GLU HB3 . . A . 11 GLU HG3 . 1 . 11 GLU HB* . . . 1 . 11 GLU HGR . . c25189_2mtw 1 198 1 . . 1 1 11 11 GLU HG2 H . . . 1 1 11 11 GLU HG3 H . . . . . 2.8 1.8 2.8 . . . . . A . 11 GLU HG2 . . A . 11 GLU HG3 . 1 . 11 GLU HGS . . . 1 . 11 GLU HGR . . c25189_2mtw 1 199 1 OR . 1 1 12 12 ARG HA H . . . 1 1 12 12 ARG HD2 H . . . . . 2.8 1.8 3.8 . . . . . A . 12 ARG HA . . A . 12 ARG HD2 . 1 . 12 ARG HA . . . 1 . 12 ARG HD* . . c25189_2mtw 1 199 2 OR . 1 1 12 12 ARG HA H . . . 1 1 12 12 ARG HD3 H . . . . . 2.8 1.8 3.8 . . . . . A . 12 ARG HA . . A . 12 ARG HD3 . 1 . 12 ARG HA . . . 1 . 12 ARG HD* . . c25189_2mtw 1 200 1 OR . 1 1 12 12 ARG HA H . . . 1 1 12 12 ARG HB2 H . . . . . 2.8 1.8 3.8 . . . . . A . 12 ARG HA . . A . 12 ARG HB2 . 1 . 12 ARG HA . . . 1 . 12 ARG HB* . . c25189_2mtw 1 200 2 OR . 1 1 12 12 ARG HA H . . . 1 1 12 12 ARG HB3 H . . . . . 2.8 1.8 3.8 . . . . . A . 12 ARG HA . . A . 12 ARG HB3 . 1 . 12 ARG HA . . . 1 . 12 ARG HB* . . c25189_2mtw 1 201 1 . . 1 1 12 12 ARG HA H . . . 1 1 12 12 ARG HG2 H . . . . . 2.8 1.8 2.8 . . . . . A . 12 ARG HA . . A . 12 ARG HG2 . 1 . 12 ARG HA . . . 1 . 12 ARG HGS . . c25189_2mtw 1 202 1 . . 1 1 12 12 ARG HA H . . . 1 1 12 12 ARG HG3 H . . . . . 2.8 1.8 2.8 . . . . . A . 12 ARG HA . . A . 12 ARG HG3 . 1 . 12 ARG HA . . . 1 . 12 ARG HGR . . c25189_2mtw 1 203 1 OR . 1 1 12 12 ARG HG2 H . . . 1 1 12 12 ARG HB2 H . . . . . 2.8 1.8 3.8 . . . . . A . 12 ARG HG2 . . A . 12 ARG HB2 . 1 . 12 ARG HGS . . . 1 . 12 ARG HB* . . c25189_2mtw 1 203 2 OR . 1 1 12 12 ARG HB3 H . . . 1 1 12 12 ARG HG2 H . . . . . 2.8 1.8 3.8 . . . . . A . 12 ARG HB3 . . A . 12 ARG HG2 . 1 . 12 ARG HB* . . . 1 . 12 ARG HGS . . c25189_2mtw 1 204 1 OR . 1 1 12 12 ARG HG3 H . . . 1 1 12 12 ARG HB2 H . . . . . 2.8 1.8 3.8 . . . . . A . 12 ARG HG3 . . A . 12 ARG HB2 . 1 . 12 ARG HGR . . . 1 . 12 ARG HB* . . c25189_2mtw 1 204 2 OR . 1 1 12 12 ARG HB3 H . . . 1 1 12 12 ARG HG3 H . . . . . 2.8 1.8 3.8 . . . . . A . 12 ARG HB3 . . A . 12 ARG HG3 . 1 . 12 ARG HB* . . . 1 . 12 ARG HGR . . c25189_2mtw 1 205 1 . . 1 1 12 12 ARG HG2 H . . . 1 1 12 12 ARG HG3 H . . . . . 2.8 1.8 2.8 . . . . . A . 12 ARG HG2 . . A . 12 ARG HG3 . 1 . 12 ARG HGS . . . 1 . 12 ARG HGR . . c25189_2mtw 1 206 1 . . 1 1 13 13 ASP HA H . . . 1 1 13 13 ASP HB3 H . . . . . 2.8 1.8 2.8 . . . . . A . 13 ASP HA . . A . 13 ASP HB3 . 1 . 13 ASP HA . . . 1 . 13 ASP HBR . . c25189_2mtw 1 207 1 . . 1 1 13 13 ASP HA H . . . 1 1 13 13 ASP HB2 H . . . . . 2.8 1.8 2.8 . . . . . A . 13 ASP HA . . A . 13 ASP HB2 . 1 . 13 ASP HA . . . 1 . 13 ASP HBS . . c25189_2mtw 1 208 1 . . 1 1 13 13 ASP HB3 H . . . 1 1 13 13 ASP HB2 H . . . . . 2.8 1.8 2.8 . . . . . A . 13 ASP HB3 . . A . 13 ASP HB2 . 1 . 13 ASP HBR . . . 1 . 13 ASP HBS . . c25189_2mtw 1 209 1 OR . 1 1 14 14 LEU HA H . . . 1 1 14 14 LEU HB2 H . . . . . 2.8 1.8 3.8 . . . . . A . 14 LEU HA . . A . 14 LEU HB2 . 1 . 14 LEU HA . . . 1 . 14 LEU HB* . . c25189_2mtw 1 209 2 OR . 1 1 14 14 LEU HA H . . . 1 1 14 14 LEU HB3 H . . . . . 2.8 1.8 3.8 . . . . . A . 14 LEU HA . . A . 14 LEU HB3 . 1 . 14 LEU HA . . . 1 . 14 LEU HB* . . c25189_2mtw 1 210 1 . . 1 1 14 14 LEU HA H . . . 1 1 14 14 LEU MD1 H . . . . . 2.8 1.8 3.8 . . . . . A . 14 LEU HA . . A . 14 LEU MD1 . 1 . 14 LEU HA . . . 1 . 14 LEU HDR* . . c25189_2mtw 1 211 1 . . 1 1 14 14 LEU HA H . . . 1 1 14 14 LEU MD2 H . . . . . 2.8 1.8 3.8 . . . . . A . 14 LEU HA . . A . 14 LEU MD2 . 1 . 14 LEU HA . . . 1 . 14 LEU HDS* . . c25189_2mtw 1 212 1 OR . 1 1 14 14 LEU MD1 H . . . 1 1 14 14 LEU HB2 H . . . . . 2.8 1.8 4.8 . . . . . A . 14 LEU MD1 . . A . 14 LEU HB2 . 1 . 14 LEU HDR* . . . 1 . 14 LEU HB* . . c25189_2mtw 1 212 2 OR . 1 1 14 14 LEU HB3 H . . . 1 1 14 14 LEU MD1 H . . . . . 2.8 1.8 4.8 . . . . . A . 14 LEU HB3 . . A . 14 LEU MD1 . 1 . 14 LEU HB* . . . 1 . 14 LEU HDR* . . c25189_2mtw 1 213 1 OR . 1 1 14 14 LEU MD2 H . . . 1 1 14 14 LEU HB2 H . . . . . 2.8 1.8 4.8 . . . . . A . 14 LEU MD2 . . A . 14 LEU HB2 . 1 . 14 LEU HDS* . . . 1 . 14 LEU HB* . . c25189_2mtw 1 213 2 OR . 1 1 14 14 LEU HB3 H . . . 1 1 14 14 LEU MD2 H . . . . . 2.8 1.8 4.8 . . . . . A . 14 LEU HB3 . . A . 14 LEU MD2 . 1 . 14 LEU HB* . . . 1 . 14 LEU HDS* . . c25189_2mtw 1 214 1 . . 1 1 14 14 LEU MD1 H . . . 1 1 14 14 LEU MD2 H . . . . . 2.8 1.8 4.8 . . . . . A . 14 LEU MD1 . . A . 14 LEU MD2 . 1 . 14 LEU HDR* . . . 1 . 14 LEU HDS* . . c25189_2mtw 1 215 1 OR . 1 1 15 15 GLN HA H . . . 1 1 15 15 GLN HB2 H . . . . . 2.8 1.8 3.8 . . . . . A . 15 GLN HA . . A . 15 GLN HB2 . 1 . 15 GLN HA . . . 1 . 15 GLN HB* . . c25189_2mtw 1 215 2 OR . 1 1 15 15 GLN HA H . . . 1 1 15 15 GLN HB3 H . . . . . 2.8 1.8 3.8 . . . . . A . 15 GLN HA . . A . 15 GLN HB3 . 1 . 15 GLN HA . . . 1 . 15 GLN HB* . . c25189_2mtw 1 216 1 . . 1 1 15 15 GLN HA H . . . 1 1 15 15 GLN HG2 H . . . . . 2.8 1.8 2.8 . . . . . A . 15 GLN HA . . A . 15 GLN HG2 . 1 . 15 GLN HA . . . 1 . 15 GLN HGS . . c25189_2mtw 1 217 1 . . 1 1 15 15 GLN HA H . . . 1 1 15 15 GLN HG3 H . . . . . 2.8 1.8 2.8 . . . . . A . 15 GLN HA . . A . 15 GLN HG3 . 1 . 15 GLN HA . . . 1 . 15 GLN HGR . . c25189_2mtw 1 218 1 OR . 1 1 15 15 GLN HG2 H . . . 1 1 15 15 GLN HB2 H . . . . . 2.8 1.8 3.8 . . . . . A . 15 GLN HG2 . . A . 15 GLN HB2 . 1 . 15 GLN HGS . . . 1 . 15 GLN HB* . . c25189_2mtw 1 218 2 OR . 1 1 15 15 GLN HB3 H . . . 1 1 15 15 GLN HG2 H . . . . . 2.8 1.8 3.8 . . . . . A . 15 GLN HB3 . . A . 15 GLN HG2 . 1 . 15 GLN HB* . . . 1 . 15 GLN HGS . . c25189_2mtw 1 219 1 OR . 1 1 15 15 GLN HG3 H . . . 1 1 15 15 GLN HB2 H . . . . . 2.8 1.8 3.8 . . . . . A . 15 GLN HG3 . . A . 15 GLN HB2 . 1 . 15 GLN HGR . . . 1 . 15 GLN HB* . . c25189_2mtw 1 219 2 OR . 1 1 15 15 GLN HB3 H . . . 1 1 15 15 GLN HG3 H . . . . . 2.8 1.8 3.8 . . . . . A . 15 GLN HB3 . . A . 15 GLN HG3 . 1 . 15 GLN HB* . . . 1 . 15 GLN HGR . . c25189_2mtw 1 220 1 . . 1 1 15 15 GLN HG2 H . . . 1 1 15 15 GLN HG3 H . . . . . 2.8 1.8 2.8 . . . . . A . 15 GLN HG2 . . A . 15 GLN HG3 . 1 . 15 GLN HGS . . . 1 . 15 GLN HGR . . c25189_2mtw 1 221 1 OR . 1 1 16 16 LYS HA H . . . 1 1 16 16 LYS HB2 H . . . . . 2.8 1.8 3.8 . . . . . A . 16 LYS HA . . A . 16 LYS HB2 . 1 . 16 LYS HA . . . 1 . 16 LYS HB* . . c25189_2mtw 1 221 2 OR . 1 1 16 16 LYS HA H . . . 1 1 16 16 LYS HB3 H . . . . . 2.8 1.8 3.8 . . . . . A . 16 LYS HA . . A . 16 LYS HB3 . 1 . 16 LYS HA . . . 1 . 16 LYS HB* . . c25189_2mtw 1 222 1 OR . 1 1 16 16 LYS HA H . . . 1 1 16 16 LYS HD2 H . . . . . 2.8 1.8 3.8 . . . . . A . 16 LYS HA . . A . 16 LYS HD2 . 1 . 16 LYS HA . . . 1 . 16 LYS HD* . . c25189_2mtw 1 222 2 OR . 1 1 16 16 LYS HA H . . . 1 1 16 16 LYS HD3 H . . . . . 2.8 1.8 3.8 . . . . . A . 16 LYS HA . . A . 16 LYS HD3 . 1 . 16 LYS HA . . . 1 . 16 LYS HD* . . c25189_2mtw 1 223 1 . . 1 1 16 16 LYS HA H . . . 1 1 16 16 LYS HG2 H . . . . . 2.8 1.8 2.8 . . . . . A . 16 LYS HA . . A . 16 LYS HG2 . 1 . 16 LYS HA . . . 1 . 16 LYS HGR . . c25189_2mtw 1 224 1 . . 1 1 16 16 LYS HA H . . . 1 1 16 16 LYS HG3 H . . . . . 2.8 1.8 2.8 . . . . . A . 16 LYS HA . . A . 16 LYS HG3 . 1 . 16 LYS HA . . . 1 . 16 LYS HGS . . c25189_2mtw 1 225 1 OR . 1 1 16 16 LYS HB2 H . . . 1 1 16 16 LYS HD2 H . . . . . 2.8 1.8 4.8 . . . . . A . 16 LYS HB2 . . A . 16 LYS HD2 . 1 . 16 LYS HB* . . . 1 . 16 LYS HD* . . c25189_2mtw 1 225 2 OR . 1 1 16 16 LYS HB3 H . . . 1 1 16 16 LYS HD2 H . . . . . 2.8 1.8 4.8 . . . . . A . 16 LYS HB3 . . A . 16 LYS HD2 . 1 . 16 LYS HB* . . . 1 . 16 LYS HD* . . c25189_2mtw 1 225 3 OR . 1 1 16 16 LYS HD3 H . . . 1 1 16 16 LYS HB2 H . . . . . 2.8 1.8 4.8 . . . . . A . 16 LYS HD3 . . A . 16 LYS HB2 . 1 . 16 LYS HD* . . . 1 . 16 LYS HB* . . c25189_2mtw 1 225 4 OR . 1 1 16 16 LYS HB3 H . . . 1 1 16 16 LYS HD3 H . . . . . 2.8 1.8 4.8 . . . . . A . 16 LYS HB3 . . A . 16 LYS HD3 . 1 . 16 LYS HB* . . . 1 . 16 LYS HD* . . c25189_2mtw 1 226 1 OR . 1 1 16 16 LYS HG2 H . . . 1 1 16 16 LYS HB2 H . . . . . 2.8 1.8 3.8 . . . . . A . 16 LYS HG2 . . A . 16 LYS HB2 . 1 . 16 LYS HGR . . . 1 . 16 LYS HB* . . c25189_2mtw 1 226 2 OR . 1 1 16 16 LYS HB3 H . . . 1 1 16 16 LYS HG2 H . . . . . 2.8 1.8 3.8 . . . . . A . 16 LYS HB3 . . A . 16 LYS HG2 . 1 . 16 LYS HB* . . . 1 . 16 LYS HGR . . c25189_2mtw 1 227 1 OR . 1 1 16 16 LYS HG3 H . . . 1 1 16 16 LYS HB2 H . . . . . 2.8 1.8 3.8 . . . . . A . 16 LYS HG3 . . A . 16 LYS HB2 . 1 . 16 LYS HGS . . . 1 . 16 LYS HB* . . c25189_2mtw 1 227 2 OR . 1 1 16 16 LYS HB3 H . . . 1 1 16 16 LYS HG3 H . . . . . 2.8 1.8 3.8 . . . . . A . 16 LYS HB3 . . A . 16 LYS HG3 . 1 . 16 LYS HB* . . . 1 . 16 LYS HGS . . c25189_2mtw 1 228 1 OR . 1 1 16 16 LYS HG2 H . . . 1 1 16 16 LYS HD2 H . . . . . 2.8 1.8 3.8 . . . . . A . 16 LYS HG2 . . A . 16 LYS HD2 . 1 . 16 LYS HGR . . . 1 . 16 LYS HD* . . c25189_2mtw 1 228 2 OR . 1 1 16 16 LYS HD3 H . . . 1 1 16 16 LYS HG2 H . . . . . 2.8 1.8 3.8 . . . . . A . 16 LYS HD3 . . A . 16 LYS HG2 . 1 . 16 LYS HD* . . . 1 . 16 LYS HGR . . c25189_2mtw 1 229 1 OR . 1 1 16 16 LYS HG3 H . . . 1 1 16 16 LYS HD2 H . . . . . 2.8 1.8 3.8 . . . . . A . 16 LYS HG3 . . A . 16 LYS HD2 . 1 . 16 LYS HGS . . . 1 . 16 LYS HD* . . c25189_2mtw 1 229 2 OR . 1 1 16 16 LYS HD3 H . . . 1 1 16 16 LYS HG3 H . . . . . 2.8 1.8 3.8 . . . . . A . 16 LYS HD3 . . A . 16 LYS HG3 . 1 . 16 LYS HD* . . . 1 . 16 LYS HGS . . c25189_2mtw 1 230 1 . . 1 1 16 16 LYS HG2 H . . . 1 1 16 16 LYS HG3 H . . . . . 2.8 1.8 2.8 . . . . . A . 16 LYS HG2 . . A . 16 LYS HG3 . 1 . 16 LYS HGR . . . 1 . 16 LYS HGS . . c25189_2mtw 1 231 1 . . 1 1 17 17 HIS HA H . . . 1 1 17 17 HIS HB3 H . . . . . 2.8 1.8 2.8 . . . . . A . 17 HIS HA . . A . 17 HIS HB3 . 1 . 17 HIS HA . . . 1 . 17 HIS HBR . . c25189_2mtw 1 232 1 . . 1 1 17 17 HIS HA H . . . 1 1 17 17 HIS HB2 H . . . . . 2.8 1.8 2.8 . . . . . A . 17 HIS HA . . A . 17 HIS HB2 . 1 . 17 HIS HA . . . 1 . 17 HIS HBS . . c25189_2mtw 1 233 1 . . 1 1 17 17 HIS HB2 H . . . 1 1 17 17 HIS HB3 H . . . . . 2.8 1.8 2.8 . . . . . A . 17 HIS HB2 . . A . 17 HIS HB3 . 1 . 17 HIS HBS . . . 1 . 17 HIS HBR . . c25189_2mtw 1 234 1 OR . 1 1 19 19 PHE HA H . . . 1 1 19 19 PHE HB2 H . . . . . 2.8 1.8 3.8 . . . . . A . 19 PHE HA . . A . 19 PHE HB2 . 1 . 19 PHE HA . . . 1 . 19 PHE HB* . . c25189_2mtw 1 234 2 OR . 1 1 19 19 PHE HA H . . . 1 1 19 19 PHE HB3 H . . . . . 2.8 1.8 3.8 . . . . . A . 19 PHE HA . . A . 19 PHE HB3 . 1 . 19 PHE HA . . . 1 . 19 PHE HB* . . c25189_2mtw 1 235 1 . . 1 1 20 20 HIS HA H . . . 1 1 20 20 HIS HB3 H . . . . . 2.8 1.8 2.8 . . . . . A . 20 HIS HA . . A . 20 HIS HB3 . 1 . 20 HIS HA . . . 1 . 20 HIS HBR . . c25189_2mtw 1 236 1 . . 1 1 20 20 HIS HA H . . . 1 1 20 20 HIS HB2 H . . . . . 2.8 1.8 2.8 . . . . . A . 20 HIS HA . . A . 20 HIS HB2 . 1 . 20 HIS HA . . . 1 . 20 HIS HBS . . c25189_2mtw 1 237 1 . . 1 1 20 20 HIS HB2 H . . . 1 1 20 20 HIS HB3 H . . . . . 2.8 1.8 2.8 . . . . . A . 20 HIS HB2 . . A . 20 HIS HB3 . 1 . 20 HIS HBS . . . 1 . 20 HIS HBR . . c25189_2mtw 1 238 1 . . 1 1 1 1 TYR QD H . . . 1 1 1 1 TYR QE H . . . . . 2.8 1.8 6.8 . . . . . A . 1 TYR QD . . A . 1 TYR QE . 1 . 1 TYR HD* . . . 1 . 1 TYR HE* . . c25189_2mtw 1 239 1 . . 1 1 3 3 ASN HD21 H . . . 1 1 3 3 ASN HD22 H . . . . . 2.8 1.8 2.8 . . . . . A . 3 ASN HD21 . . A . 3 ASN HD22 . 1 . 3 ASN HD21 . . . 1 . 3 ASN HD22 . . c25189_2mtw 1 240 1 . . 1 1 4 4 GLN HE21 H . . . 1 1 4 4 GLN HE22 H . . . . . 2.8 1.8 2.8 . . . . . A . 4 GLN HE21 . . A . 4 GLN HE22 . 1 . 4 GLN HE21 . . . 1 . 4 GLN HE22 . . c25189_2mtw 1 241 1 . . 1 1 5 5 ASN HD21 H . . . 1 1 5 5 ASN HD22 H . . . . . 2.8 1.8 2.8 . . . . . A . 5 ASN HD21 . . A . 5 ASN HD22 . 1 . 5 ASN HD21 . . . 1 . 5 ASN HD22 . . c25189_2mtw 1 242 1 . . 1 1 7 7 ASN HD21 H . . . 1 1 7 7 ASN HD22 H . . . . . 2.8 1.8 2.8 . . . . . A . 7 ASN HD21 . . A . 7 ASN HD22 . 1 . 7 ASN HD21 . . . 1 . 7 ASN HD22 . . c25189_2mtw 1 243 1 . . 1 1 10 10 GLN HE21 H . . . 1 1 10 10 GLN HE22 H . . . . . 2.8 1.8 2.8 . . . . . A . 10 GLN HE21 . . A . 10 GLN HE22 . 1 . 10 GLN HE21 . . . 1 . 10 GLN HE22 . . c25189_2mtw 1 244 1 . . 1 1 15 15 GLN HE21 H . . . 1 1 15 15 GLN HE22 H . . . . . 2.8 1.8 2.8 . . . . . A . 15 GLN HE21 . . A . 15 GLN HE22 . 1 . 15 GLN HE21 . . . 1 . 15 GLN HE22 . . c25189_2mtw 1 245 1 . . 1 1 5 5 ASN H H . . . 1 1 5 5 ASN HD21 H . . . . . 5.0 3.5 5.0 . . . . . A . 5 ASN H . . A . 5 ASN HD21 . 1 . 5 ASN HN . . . 1 . 5 ASN HD21 . . c25189_2mtw 1 246 1 . . 1 1 5 5 ASN H H . . . 1 1 5 5 ASN HD22 H . . . . . 5.0 3.5 5.0 . . . . . A . 5 ASN H . . A . 5 ASN HD22 . 1 . 5 ASN HN . . . 1 . 5 ASN HD22 . . c25189_2mtw 1 247 1 . . 1 1 7 7 ASN H H . . . 1 1 7 7 ASN HD21 H . . . . . 5.0 3.5 5.0 . . . . . A . 7 ASN H . . A . 7 ASN HD21 . 1 . 7 ASN HN . . . 1 . 7 ASN HD21 . . c25189_2mtw 1 248 1 . . 1 1 7 7 ASN H H . . . 1 1 7 7 ASN HD22 H . . . . . 5.0 3.5 5.0 . . . . . A . 7 ASN H . . A . 7 ASN HD22 . 1 . 7 ASN HN . . . 1 . 7 ASN HD22 . . c25189_2mtw 1 stop_ loop_ _Gen_dist_constraint_parse_err.ID _Gen_dist_constraint_parse_err.Content _Gen_dist_constraint_parse_err.Begin_line _Gen_dist_constraint_parse_err.Begin_column _Gen_dist_constraint_parse_err.End_line _Gen_dist_constraint_parse_err.End_column _Gen_dist_constraint_parse_err.Entry_ID _Gen_dist_constraint_parse_err.Gen_dist_constraint_list_ID 1 3.000000E+02 256 1 256 12 c25189_2mtw 1 stop_ loop_ _Gen_dist_constraint_comment_org.ID _Gen_dist_constraint_comment_org.Comment_text _Gen_dist_constraint_comment_org.Comment_begin_line _Gen_dist_constraint_comment_org.Comment_begin_column _Gen_dist_constraint_comment_org.Comment_end_line _Gen_dist_constraint_comment_org.Comment_end_column _Gen_dist_constraint_comment_org.Entry_ID _Gen_dist_constraint_comment_org.Gen_dist_constraint_list_ID 1 NOE_distance 1 1 1 13 c25189_2mtw 1 2 weak: 2 87 2 125 c25189_2mtw 1 3 medium: 3 87 3 95 c25189_2mtw 1 4 strong: 4 87 4 101 c25189_2mtw 1 5 strong: 5 87 5 100 c25189_2mtw 1 6 strong: 6 87 6 102 c25189_2mtw 1 7 strong: 7 87 7 104 c25189_2mtw 1 8 strong: 8 87 8 102 c25189_2mtw 1 9 strong: 9 87 9 102 c25189_2mtw 1 10 strong: 10 87 10 108 c25189_2mtw 1 11 strong: 11 87 11 100 c25189_2mtw 1 12 strong: 12 87 12 102 c25189_2mtw 1 13 strong: 13 87 13 104 c25189_2mtw 1 14 strong: 14 87 14 104 c25189_2mtw 1 15 strong: 15 87 15 101 c25189_2mtw 1 16 strong: 16 87 16 166 c25189_2mtw 1 17 strong: 17 87 17 103 c25189_2mtw 1 18 medium: 18 87 18 99 c25189_2mtw 1 19 strong: 19 87 19 101 c25189_2mtw 1 20 medium: 20 87 20 97 c25189_2mtw 1 21 strong: 21 87 21 100 c25189_2mtw 1 22 strong: 22 87 22 102 c25189_2mtw 1 23 strong: 23 87 23 104 c25189_2mtw 1 24 strong: 24 87 24 96 c25189_2mtw 1 25 strong: 25 87 25 103 c25189_2mtw 1 26 strong: 26 87 26 97 c25189_2mtw 1 27 strong: 27 87 27 100 c25189_2mtw 1 28 strong: 28 87 28 102 c25189_2mtw 1 29 strong: 29 87 29 100 c25189_2mtw 1 30 medium: 30 87 30 102 c25189_2mtw 1 31 medium: 31 87 31 101 c25189_2mtw 1 32 medium: 32 87 32 104 c25189_2mtw 1 33 strong: 33 87 33 104 c25189_2mtw 1 34 medium: 34 87 34 102 c25189_2mtw 1 35 medium: 35 87 35 98 c25189_2mtw 1 36 strong: 36 87 36 105 c25189_2mtw 1 37 strong: 37 87 37 99 c25189_2mtw 1 38 strong: 38 87 38 100 c25189_2mtw 1 39 weak: 39 87 39 99 c25189_2mtw 1 40 weak: 40 87 40 100 c25189_2mtw 1 41 weak: 41 87 41 96 c25189_2mtw 1 42 weak: 42 87 42 103 c25189_2mtw 1 43 weak: 43 87 43 98 c25189_2mtw 1 44 medium: 44 87 44 105 c25189_2mtw 1 45 medium: 45 87 45 95 c25189_2mtw 1 46 strong: 46 87 46 95 c25189_2mtw 1 47 strong: 47 87 47 95 c25189_2mtw 1 48 strong: 48 87 48 95 c25189_2mtw 1 49 medium: 49 87 49 96 c25189_2mtw 1 50 strong: 50 87 50 95 c25189_2mtw 1 51 medium: 51 87 51 96 c25189_2mtw 1 52 weak: 52 87 52 94 c25189_2mtw 1 53 weak: 53 87 53 94 c25189_2mtw 1 54 weak: 54 87 54 94 c25189_2mtw 1 55 strong: 55 87 55 94 c25189_2mtw 1 56 strong: 56 87 56 94 c25189_2mtw 1 57 strong: 57 87 57 94 c25189_2mtw 1 58 strong: 58 87 58 94 c25189_2mtw 1 59 strong: 59 87 59 95 c25189_2mtw 1 60 strong: 60 87 60 94 c25189_2mtw 1 61 strong: 61 87 61 94 c25189_2mtw 1 62 strong: 62 87 62 95 c25189_2mtw 1 63 strong: 63 87 63 94 c25189_2mtw 1 64 strong: 64 87 64 94 c25189_2mtw 1 65 strong: 65 87 65 94 c25189_2mtw 1 66 strong: 66 87 66 94 c25189_2mtw 1 67 strong 67 87 67 95 c25189_2mtw 1 68 weak: 68 87 68 94 c25189_2mtw 1 69 weak: 69 87 69 94 c25189_2mtw 1 70 medium: 70 87 70 94 c25189_2mtw 1 71 medium: 71 87 71 94 c25189_2mtw 1 72 strong: 72 87 72 94 c25189_2mtw 1 73 medium: 73 87 73 94 c25189_2mtw 1 74 medium: 74 87 74 94 c25189_2mtw 1 75 medium: 75 87 75 94 c25189_2mtw 1 76 medium: 76 87 76 94 c25189_2mtw 1 77 medium: 77 87 77 94 c25189_2mtw 1 78 medium: 78 87 78 94 c25189_2mtw 1 79 strong: 79 87 79 94 c25189_2mtw 1 80 strong: 80 87 80 94 c25189_2mtw 1 81 medium: 81 87 81 94 c25189_2mtw 1 82 medium: 82 87 82 95 c25189_2mtw 1 83 strong: 83 87 83 94 c25189_2mtw 1 84 strong: 84 87 84 94 c25189_2mtw 1 85 strong: 85 87 85 94 c25189_2mtw 1 86 strong: 86 87 86 94 c25189_2mtw 1 87 strong: 87 87 87 94 c25189_2mtw 1 88 strong: 88 87 88 95 c25189_2mtw 1 89 strong: 89 87 89 94 c25189_2mtw 1 90 medium: 90 87 90 95 c25189_2mtw 1 91 strong: 91 87 91 94 c25189_2mtw 1 92 strong: 92 87 92 94 c25189_2mtw 1 93 strong: 93 87 93 94 c25189_2mtw 1 94 medium: 94 87 94 95 c25189_2mtw 1 95 strong: 95 87 95 94 c25189_2mtw 1 96 strong: 96 87 96 94 c25189_2mtw 1 97 strong: 97 87 97 95 c25189_2mtw 1 98 strong: 98 87 98 94 c25189_2mtw 1 99 strong: 99 87 99 94 c25189_2mtw 1 100 strong: 100 87 100 95 c25189_2mtw 1 101 strong: 101 87 101 96 c25189_2mtw 1 102 strong: 102 87 102 95 c25189_2mtw 1 103 strong: 103 87 103 94 c25189_2mtw 1 104 strong: 104 87 104 94 c25189_2mtw 1 105 strong: 105 87 105 94 c25189_2mtw 1 106 strong: 106 87 106 94 c25189_2mtw 1 107 medium: 107 87 107 95 c25189_2mtw 1 108 medium: 108 87 108 95 c25189_2mtw 1 109 medium: 109 87 109 94 c25189_2mtw 1 110 strong: 110 87 110 94 c25189_2mtw 1 111 strong: 111 87 111 94 c25189_2mtw 1 112 strong: 112 87 112 94 c25189_2mtw 1 113 medium: 113 87 113 94 c25189_2mtw 1 114 medium: 114 87 114 94 c25189_2mtw 1 115 strong: 115 87 115 94 c25189_2mtw 1 116 strong: 116 87 116 94 c25189_2mtw 1 117 strong: 117 87 117 94 c25189_2mtw 1 118 strong: 118 87 118 94 c25189_2mtw 1 119 strong: 119 87 119 94 c25189_2mtw 1 120 strong: 120 87 120 94 c25189_2mtw 1 121 strong: 121 87 121 94 c25189_2mtw 1 122 strong: 122 87 122 94 c25189_2mtw 1 123 strong: 123 87 123 94 c25189_2mtw 1 124 strong: 124 87 124 94 c25189_2mtw 1 125 strong: 125 87 125 95 c25189_2mtw 1 126 strong: 126 87 126 95 c25189_2mtw 1 127 strong: 127 87 127 95 c25189_2mtw 1 128 medium: 128 87 128 94 c25189_2mtw 1 129 medium: 129 87 129 94 c25189_2mtw 1 130 medium: 130 87 130 94 c25189_2mtw 1 131 medium: 131 87 131 94 c25189_2mtw 1 132 medium: 132 87 132 94 c25189_2mtw 1 133 medium: 133 87 133 94 c25189_2mtw 1 134 medium: 134 87 134 94 c25189_2mtw 1 135 medium: 135 87 135 94 c25189_2mtw 1 136 medium: 136 87 136 95 c25189_2mtw 1 137 medium: 137 87 137 99 c25189_2mtw 1 138 strong: 138 87 138 96 c25189_2mtw 1 139 strong: 139 87 139 96 c25189_2mtw 1 140 medium: 140 87 140 94 c25189_2mtw 1 141 medium: 141 87 141 94 c25189_2mtw 1 142 medium: 142 87 142 95 c25189_2mtw 1 143 medium: 143 87 143 95 c25189_2mtw 1 144 strong: 144 87 144 94 c25189_2mtw 1 145 medium: 145 87 145 95 c25189_2mtw 1 146 strong: 146 87 146 94 c25189_2mtw 1 147 strong: 147 87 147 94 c25189_2mtw 1 148 strong: 148 87 148 95 c25189_2mtw 1 149 medium: 149 87 149 95 c25189_2mtw 1 150 strong: 150 87 150 95 c25189_2mtw 1 151 strong: 151 87 151 95 c25189_2mtw 1 152 strong: 152 87 152 95 c25189_2mtw 1 153 strong: 153 87 153 95 c25189_2mtw 1 154 strong: 154 87 154 95 c25189_2mtw 1 155 strong: 155 87 155 95 c25189_2mtw 1 156 strong: 156 87 156 95 c25189_2mtw 1 157 strong: 157 87 157 94 c25189_2mtw 1 158 strong: 158 87 158 94 c25189_2mtw 1 159 strong: 159 87 159 94 c25189_2mtw 1 160 strong: 160 87 160 94 c25189_2mtw 1 161 strong: 161 87 161 94 c25189_2mtw 1 162 strong: 162 87 162 94 c25189_2mtw 1 163 strong: 163 87 163 94 c25189_2mtw 1 164 strong: 164 87 164 94 c25189_2mtw 1 165 strong: 165 87 165 94 c25189_2mtw 1 166 strong: 166 87 166 94 c25189_2mtw 1 167 strong: 167 87 167 94 c25189_2mtw 1 168 strong: 168 87 168 94 c25189_2mtw 1 169 strong: 169 87 169 94 c25189_2mtw 1 170 strong: 170 87 170 94 c25189_2mtw 1 171 strong: 171 87 171 94 c25189_2mtw 1 172 strong: 172 87 172 94 c25189_2mtw 1 173 strong: 173 87 173 94 c25189_2mtw 1 174 strong: 174 87 174 94 c25189_2mtw 1 175 strong: 175 87 175 94 c25189_2mtw 1 176 strong: 176 87 176 94 c25189_2mtw 1 177 strong: 177 87 177 94 c25189_2mtw 1 178 strong: 178 87 178 94 c25189_2mtw 1 179 strong: 179 87 179 94 c25189_2mtw 1 180 strong: 180 87 180 94 c25189_2mtw 1 181 strong: 181 87 181 94 c25189_2mtw 1 182 strong: 182 87 182 94 c25189_2mtw 1 183 strong: 183 87 183 94 c25189_2mtw 1 184 strong: 184 87 184 94 c25189_2mtw 1 185 strong: 185 87 185 94 c25189_2mtw 1 186 strong: 186 87 186 94 c25189_2mtw 1 187 strong: 187 87 187 94 c25189_2mtw 1 188 strong: 188 87 188 94 c25189_2mtw 1 189 strong: 189 87 189 94 c25189_2mtw 1 190 strong: 190 87 190 94 c25189_2mtw 1 191 strong: 191 87 191 94 c25189_2mtw 1 192 strong: 192 87 192 94 c25189_2mtw 1 193 strong: 193 87 193 94 c25189_2mtw 1 194 strong: 194 87 194 94 c25189_2mtw 1 195 strong: 195 87 195 94 c25189_2mtw 1 196 strong: 196 87 196 94 c25189_2mtw 1 197 strong: 197 87 197 94 c25189_2mtw 1 198 strong: 198 87 198 94 c25189_2mtw 1 199 strong: 199 87 199 94 c25189_2mtw 1 200 strong: 200 87 200 94 c25189_2mtw 1 201 strong: 201 87 201 94 c25189_2mtw 1 202 strong: 202 87 202 94 c25189_2mtw 1 203 strong: 203 87 203 94 c25189_2mtw 1 204 strong: 204 87 204 94 c25189_2mtw 1 205 strong: 205 87 205 94 c25189_2mtw 1 206 strong: 206 87 206 94 c25189_2mtw 1 207 strong: 207 87 207 94 c25189_2mtw 1 208 strong: 208 87 208 94 c25189_2mtw 1 209 strong: 209 87 209 94 c25189_2mtw 1 210 strong: 210 87 210 94 c25189_2mtw 1 211 strong: 211 87 211 94 c25189_2mtw 1 212 strong: 212 87 212 94 c25189_2mtw 1 213 strong: 213 87 213 94 c25189_2mtw 1 214 strong: 214 87 214 94 c25189_2mtw 1 215 strong: 215 87 215 94 c25189_2mtw 1 216 strong: 216 87 216 94 c25189_2mtw 1 217 strong: 217 87 217 94 c25189_2mtw 1 218 strong: 218 87 218 94 c25189_2mtw 1 219 strong: 219 87 219 94 c25189_2mtw 1 220 strong: 220 87 220 94 c25189_2mtw 1 221 strong: 221 87 221 94 c25189_2mtw 1 222 strong: 222 87 222 94 c25189_2mtw 1 223 strong: 223 87 223 94 c25189_2mtw 1 224 strong: 224 87 224 94 c25189_2mtw 1 225 strong: 225 87 225 94 c25189_2mtw 1 226 strong: 226 87 226 94 c25189_2mtw 1 227 strong: 227 87 227 94 c25189_2mtw 1 228 strong: 228 87 228 94 c25189_2mtw 1 229 strong: 229 87 229 94 c25189_2mtw 1 230 strong: 230 87 230 94 c25189_2mtw 1 231 strong: 231 87 231 94 c25189_2mtw 1 232 strong: 232 87 232 94 c25189_2mtw 1 233 strong: 233 87 233 94 c25189_2mtw 1 234 strong: 234 87 234 94 c25189_2mtw 1 235 strong: 235 87 235 94 c25189_2mtw 1 236 strong: 236 87 236 94 c25189_2mtw 1 237 strong: 237 87 237 94 c25189_2mtw 1 238 strong: 238 87 238 94 c25189_2mtw 1 239 strong: 239 87 239 94 c25189_2mtw 1 240 strong: 240 87 240 94 c25189_2mtw 1 241 strong: 241 87 241 94 c25189_2mtw 1 242 strong: 242 87 242 94 c25189_2mtw 1 243 strong: 243 87 243 94 c25189_2mtw 1 244 strong: 244 87 244 94 c25189_2mtw 1 245 strong: 245 87 245 94 c25189_2mtw 1 246 strong: 246 87 246 94 c25189_2mtw 1 247 strong: 247 87 247 94 c25189_2mtw 1 248 strong: 248 87 248 94 c25189_2mtw 1 249 strong: 249 87 249 94 c25189_2mtw 1 250 weak: 250 87 250 94 c25189_2mtw 1 251 weak: 251 87 251 94 c25189_2mtw 1 252 weak: 252 87 252 94 c25189_2mtw 1 stop_ loop_ _Gen_dist_constraint_conv_err.ID _Gen_dist_constraint_conv_err.Gen_dist_constraint_parse_file_ID _Gen_dist_constraint_conv_err.Parse_file_constraint_ID _Gen_dist_constraint_conv_err.Conv_error_type _Gen_dist_constraint_conv_err.Conv_error_note _Gen_dist_constraint_conv_err.Entry_ID _Gen_dist_constraint_conv_err.Gen_dist_constraint_list_ID 1 4 1 1 "Not handling restraint 1, item 1, resonance(s) '1.1.HN' (nmrStar names) not linked" c25189_2mtw 1 2 4 80 1 "Not handling restraint 80, item 1, resonance(s) '1.1.HN' (nmrStar names) not linked" c25189_2mtw 1 3 4 81 1 "Not handling restraint 81, item 1, resonance(s) '1.1.HN' (nmrStar names) not linked" c25189_2mtw 1 4 4 82 1 "Not handling restraint 82, item 1, resonance(s) '1.1.HN' (nmrStar names) not linked" c25189_2mtw 1 5 4 82 1 "Not handling restraint 82, item 1, resonance(s) '1.1.HN' (nmrStar names) not linked" c25189_2mtw 1 stop_ save_ save_Discover_dihedral_5 _Torsion_angle_constraint_list.Sf_category torsion_angle_constraints _Torsion_angle_constraint_list.Sf_framecode Discover_dihedral_5 _Torsion_angle_constraint_list.Entry_ID c25189_2mtw _Torsion_angle_constraint_list.ID 1 _Torsion_angle_constraint_list.Details 'Generated by Wattos' _Torsion_angle_constraint_list.Constraint_file_ID 1 _Torsion_angle_constraint_list.Block_ID 5 loop_ _Torsion_angle_constraint_software.Software_ID _Torsion_angle_constraint_software.Software_label _Torsion_angle_constraint_software.Method_ID _Torsion_angle_constraint_software.Method_label _Torsion_angle_constraint_software.Entry_ID _Torsion_angle_constraint_software.Torsion_angle_constraint_list_ID . . . . c25189_2mtw 1 stop_ loop_ _Torsion_angle_constraint.ID _Torsion_angle_constraint.Torsion_angle_name _Torsion_angle_constraint.Assembly_atom_ID_1 _Torsion_angle_constraint.Entity_assembly_ID_1 _Torsion_angle_constraint.Entity_ID_1 _Torsion_angle_constraint.Comp_index_ID_1 _Torsion_angle_constraint.Seq_ID_1 _Torsion_angle_constraint.Comp_ID_1 _Torsion_angle_constraint.Atom_ID_1 _Torsion_angle_constraint.Atom_type_1 _Torsion_angle_constraint.Resonance_ID_1 _Torsion_angle_constraint.Assembly_atom_ID_2 _Torsion_angle_constraint.Entity_assembly_ID_2 _Torsion_angle_constraint.Entity_ID_2 _Torsion_angle_constraint.Comp_index_ID_2 _Torsion_angle_constraint.Seq_ID_2 _Torsion_angle_constraint.Comp_ID_2 _Torsion_angle_constraint.Atom_ID_2 _Torsion_angle_constraint.Atom_type_2 _Torsion_angle_constraint.Resonance_ID_2 _Torsion_angle_constraint.Assembly_atom_ID_3 _Torsion_angle_constraint.Entity_assembly_ID_3 _Torsion_angle_constraint.Entity_ID_3 _Torsion_angle_constraint.Comp_index_ID_3 _Torsion_angle_constraint.Seq_ID_3 _Torsion_angle_constraint.Comp_ID_3 _Torsion_angle_constraint.Atom_ID_3 _Torsion_angle_constraint.Atom_type_3 _Torsion_angle_constraint.Resonance_ID_3 _Torsion_angle_constraint.Assembly_atom_ID_4 _Torsion_angle_constraint.Entity_assembly_ID_4 _Torsion_angle_constraint.Entity_ID_4 _Torsion_angle_constraint.Comp_index_ID_4 _Torsion_angle_constraint.Seq_ID_4 _Torsion_angle_constraint.Comp_ID_4 _Torsion_angle_constraint.Atom_ID_4 _Torsion_angle_constraint.Atom_type_4 _Torsion_angle_constraint.Resonance_ID_4 _Torsion_angle_constraint.Angle_lower_bound_val _Torsion_angle_constraint.Angle_upper_bound_val _Torsion_angle_constraint.Source_experiment_ID _Torsion_angle_constraint.PDB_record_ID_1 _Torsion_angle_constraint.PDB_model_num_1 _Torsion_angle_constraint.PDB_strand_ID_1 _Torsion_angle_constraint.PDB_ins_code_1 _Torsion_angle_constraint.PDB_residue_no_1 _Torsion_angle_constraint.PDB_residue_name_1 _Torsion_angle_constraint.PDB_atom_name_1 _Torsion_angle_constraint.PDB_record_ID_2 _Torsion_angle_constraint.PDB_model_num_2 _Torsion_angle_constraint.PDB_strand_ID_2 _Torsion_angle_constraint.PDB_ins_code_2 _Torsion_angle_constraint.PDB_residue_no_2 _Torsion_angle_constraint.PDB_residue_name_2 _Torsion_angle_constraint.PDB_atom_name_2 _Torsion_angle_constraint.PDB_record_ID_3 _Torsion_angle_constraint.PDB_model_num_3 _Torsion_angle_constraint.PDB_strand_ID_3 _Torsion_angle_constraint.PDB_ins_code_3 _Torsion_angle_constraint.PDB_residue_no_3 _Torsion_angle_constraint.PDB_residue_name_3 _Torsion_angle_constraint.PDB_atom_name_3 _Torsion_angle_constraint.PDB_record_ID_4 _Torsion_angle_constraint.PDB_model_num_4 _Torsion_angle_constraint.PDB_strand_ID_4 _Torsion_angle_constraint.PDB_ins_code_4 _Torsion_angle_constraint.PDB_residue_no_4 _Torsion_angle_constraint.PDB_residue_name_4 _Torsion_angle_constraint.PDB_atom_name_4 _Torsion_angle_constraint.Auth_entity_assembly_ID_1 _Torsion_angle_constraint.Auth_asym_ID_1 _Torsion_angle_constraint.Auth_chain_ID_1 _Torsion_angle_constraint.Auth_seq_ID_1 _Torsion_angle_constraint.Auth_comp_ID_1 _Torsion_angle_constraint.Auth_atom_ID_1 _Torsion_angle_constraint.Auth_alt_ID_1 _Torsion_angle_constraint.Auth_atom_name_1 _Torsion_angle_constraint.Auth_entity_assembly_ID_2 _Torsion_angle_constraint.Auth_asym_ID_2 _Torsion_angle_constraint.Auth_chain_ID_2 _Torsion_angle_constraint.Auth_seq_ID_2 _Torsion_angle_constraint.Auth_comp_ID_2 _Torsion_angle_constraint.Auth_atom_ID_2 _Torsion_angle_constraint.Auth_alt_ID_2 _Torsion_angle_constraint.Auth_atom_name_2 _Torsion_angle_constraint.Auth_entity_assembly_ID_3 _Torsion_angle_constraint.Auth_asym_ID_3 _Torsion_angle_constraint.Auth_chain_ID_3 _Torsion_angle_constraint.Auth_seq_ID_3 _Torsion_angle_constraint.Auth_comp_ID_3 _Torsion_angle_constraint.Auth_atom_ID_3 _Torsion_angle_constraint.Auth_alt_ID_3 _Torsion_angle_constraint.Auth_atom_name_3 _Torsion_angle_constraint.Auth_entity_assembly_ID_4 _Torsion_angle_constraint.Auth_asym_ID_4 _Torsion_angle_constraint.Auth_chain_ID_4 _Torsion_angle_constraint.Auth_seq_ID_4 _Torsion_angle_constraint.Auth_comp_ID_4 _Torsion_angle_constraint.Auth_atom_ID_4 _Torsion_angle_constraint.Auth_alt_ID_4 _Torsion_angle_constraint.Auth_atom_name_4 _Torsion_angle_constraint.Entry_ID _Torsion_angle_constraint.Torsion_angle_constraint_list_ID 1 . . 1 1 1 1 TYR CA C . . 1 1 1 1 TYR C C . . 1 1 2 2 THR N N . . 1 1 2 2 THR CA C . 178.0 180.0 . . . A . 1 TYR CA . . A . 1 TYR C . . A . 2 THR N . . A . 2 THR CA . 1 . 1 TYR CA . . . 1 . 1 TYR C . . . 1 . 2 THR N . . . 1 . 2 THR CA . . c25189_2mtw 1 2 . . 1 1 2 2 THR CA C . . 1 1 2 2 THR C C . . 1 1 3 3 ASN N N . . 1 1 3 3 ASN CA C . 178.0 180.0 . . . A . 2 THR CA . . A . 2 THR C . . A . 3 ASN N . . A . 3 ASN CA . 1 . 2 THR CA . . . 1 . 2 THR C . . . 1 . 3 ASN N . . . 1 . 3 ASN CA . . c25189_2mtw 1 3 . . 1 1 3 3 ASN CA C . . 1 1 3 3 ASN C C . . 1 1 4 4 GLN N N . . 1 1 4 4 GLN CA C . 178.0 180.0 . . . A . 3 ASN CA . . A . 3 ASN C . . A . 4 GLN N . . A . 4 GLN CA . 1 . 3 ASN CA . . . 1 . 3 ASN C . . . 1 . 4 GLN N . . . 1 . 4 GLN CA . . c25189_2mtw 1 4 . . 1 1 4 4 GLN CA C . . 1 1 4 4 GLN C C . . 1 1 5 5 ASN N N . . 1 1 5 5 ASN CA C . 178.0 180.0 . . . A . 4 GLN CA . . A . 4 GLN C . . A . 5 ASN N . . A . 5 ASN CA . 1 . 4 GLN CA . . . 1 . 4 GLN C . . . 1 . 5 ASN N . . . 1 . 5 ASN CA . . c25189_2mtw 1 5 . . 1 1 5 5 ASN CA C . . 1 1 5 5 ASN C C . . 1 1 6 6 ILE N N . . 1 1 6 6 ILE CA C . 178.0 180.0 . . . A . 5 ASN CA . . A . 5 ASN C . . A . 6 ILE N . . A . 6 ILE CA . 1 . 5 ASN CA . . . 1 . 5 ASN C . . . 1 . 6 ILE N . . . 1 . 6 ILE CA . . c25189_2mtw 1 6 . . 1 1 6 6 ILE CA C . . 1 1 6 6 ILE C C . . 1 1 7 7 ASN N N . . 1 1 7 7 ASN CA C . 178.0 180.0 . . . A . 6 ILE CA . . A . 6 ILE C . . A . 7 ASN N . . A . 7 ASN CA . 1 . 6 ILE CA . . . 1 . 6 ILE C . . . 1 . 7 ASN N . . . 1 . 7 ASN CA . . c25189_2mtw 1 7 . . 1 1 7 7 ASN CA C . . 1 1 7 7 ASN C C . . 1 1 8 8 ILE N N . . 1 1 8 8 ILE CA C . 178.0 180.0 . . . A . 7 ASN CA . . A . 7 ASN C . . A . 8 ILE N . . A . 8 ILE CA . 1 . 7 ASN CA . . . 1 . 7 ASN C . . . 1 . 8 ILE N . . . 1 . 8 ILE CA . . c25189_2mtw 1 8 . . 1 1 8 8 ILE CA C . . 1 1 8 8 ILE C C . . 1 1 9 9 SER N N . . 1 1 9 9 SER CA C . 178.0 180.0 . . . A . 8 ILE CA . . A . 8 ILE C . . A . 9 SER N . . A . 9 SER CA . 1 . 8 ILE CA . . . 1 . 8 ILE C . . . 1 . 9 SER N . . . 1 . 9 SER CA . . c25189_2mtw 1 9 . . 1 1 9 9 SER CA C . . 1 1 9 9 SER C C . . 1 1 10 10 GLN N N . . 1 1 10 10 GLN CA C . 178.0 180.0 . . . A . 9 SER CA . . A . 9 SER C . . A . 10 GLN N . . A . 10 GLN CA . 1 . 9 SER CA . . . 1 . 9 SER C . . . 1 . 10 GLN N . . . 1 . 10 GLN CA . . c25189_2mtw 1 10 . . 1 1 10 10 GLN CA C . . 1 1 10 10 GLN C C . . 1 1 11 11 GLU N N . . 1 1 11 11 GLU CA C . 178.0 180.0 . . . A . 10 GLN CA . . A . 10 GLN C . . A . 11 GLU N . . A . 11 GLU CA . 1 . 10 GLN CA . . . 1 . 10 GLN C . . . 1 . 11 GLU N . . . 1 . 11 GLU CA . . c25189_2mtw 1 11 . . 1 1 11 11 GLU CA C . . 1 1 11 11 GLU C C . . 1 1 12 12 ARG N N . . 1 1 12 12 ARG CA C . 178.0 180.0 . . . A . 11 GLU CA . . A . 11 GLU C . . A . 12 ARG N . . A . 12 ARG CA . 1 . 11 GLU CA . . . 1 . 11 GLU C . . . 1 . 12 ARG N . . . 1 . 12 ARG CA . . c25189_2mtw 1 12 . . 1 1 12 12 ARG CA C . . 1 1 12 12 ARG C C . . 1 1 13 13 ASP N N . . 1 1 13 13 ASP CA C . 178.0 180.0 . . . A . 12 ARG CA . . A . 12 ARG C . . A . 13 ASP N . . A . 13 ASP CA . 1 . 12 ARG CA . . . 1 . 12 ARG C . . . 1 . 13 ASP N . . . 1 . 13 ASP CA . . c25189_2mtw 1 13 . . 1 1 13 13 ASP CA C . . 1 1 13 13 ASP C C . . 1 1 14 14 LEU N N . . 1 1 14 14 LEU CA C . 178.0 180.0 . . . A . 13 ASP CA . . A . 13 ASP C . . A . 14 LEU N . . A . 14 LEU CA . 1 . 13 ASP CA . . . 1 . 13 ASP C . . . 1 . 14 LEU N . . . 1 . 14 LEU CA . . c25189_2mtw 1 14 . . 1 1 14 14 LEU CA C . . 1 1 14 14 LEU C C . . 1 1 15 15 GLN N N . . 1 1 15 15 GLN CA C . 178.0 180.0 . . . A . 14 LEU CA . . A . 14 LEU C . . A . 15 GLN N . . A . 15 GLN CA . 1 . 14 LEU CA . . . 1 . 14 LEU C . . . 1 . 15 GLN N . . . 1 . 15 GLN CA . . c25189_2mtw 1 15 . . 1 1 15 15 GLN CA C . . 1 1 15 15 GLN C C . . 1 1 16 16 LYS N N . . 1 1 16 16 LYS CA C . 178.0 180.0 . . . A . 15 GLN CA . . A . 15 GLN C . . A . 16 LYS N . . A . 16 LYS CA . 1 . 15 GLN CA . . . 1 . 15 GLN C . . . 1 . 16 LYS N . . . 1 . 16 LYS CA . . c25189_2mtw 1 16 . . 1 1 16 16 LYS CA C . . 1 1 16 16 LYS C C . . 1 1 17 17 HIS N N . . 1 1 17 17 HIS CA C . 178.0 180.0 . . . A . 16 LYS CA . . A . 16 LYS C . . A . 17 HIS N . . A . 17 HIS CA . 1 . 16 LYS CA . . . 1 . 16 LYS C . . . 1 . 17 HIS N . . . 1 . 17 HIS CA . . c25189_2mtw 1 17 . . 1 1 17 17 HIS CA C . . 1 1 17 17 HIS C C . . 1 1 18 18 GLY N N . . 1 1 18 18 GLY CA C . 178.0 180.0 . . . A . 17 HIS CA . . A . 17 HIS C . . A . 18 GLY N . . A . 18 GLY CA . 1 . 17 HIS CA . . . 1 . 17 HIS C . . . 1 . 18 GLY N . . . 1 . 18 GLY CA . . c25189_2mtw 1 18 . . 1 1 18 18 GLY CA C . . 1 1 18 18 GLY C C . . 1 1 19 19 PHE N N . . 1 1 19 19 PHE CA C . 178.0 180.0 . . . A . 18 GLY CA . . A . 18 GLY C . . A . 19 PHE N . . A . 19 PHE CA . 1 . 18 GLY CA . . . 1 . 18 GLY C . . . 1 . 19 PHE N . . . 1 . 19 PHE CA . . c25189_2mtw 1 19 . . 1 1 19 19 PHE CA C . . 1 1 19 19 PHE C C . . 1 1 20 20 HIS N N . . 1 1 20 20 HIS CA C . 178.0 180.0 . . . A . 19 PHE CA . . A . 19 PHE C . . A . 20 HIS N . . A . 20 HIS CA . 1 . 19 PHE CA . . . 1 . 19 PHE C . . . 1 . 20 HIS N . . . 1 . 20 HIS CA . . c25189_2mtw 1 stop_ loop_ _TA_constraint_comment_org.ID _TA_constraint_comment_org.Comment_text _TA_constraint_comment_org.Comment_begin_line _TA_constraint_comment_org.Comment_begin_column _TA_constraint_comment_org.Comment_end_line _TA_constraint_comment_org.Comment_end_column _TA_constraint_comment_org.Entry_ID _TA_constraint_comment_org.Torsion_angle_constraint_list_ID 1 NMR_dihedral 1 1 1 13 c25189_2mtw 1 stop_ save_ save_MR_file_comment_1 _Org_constr_file_comment.Sf_framecode MR_file_comment_1 _Org_constr_file_comment.Sf_category org_constr_file_comment _Org_constr_file_comment.Entry_ID c25189_2mtw _Org_constr_file_comment.ID 1 _Org_constr_file_comment.Constraint_file_ID 1 _Org_constr_file_comment.Block_ID 1 _Org_constr_file_comment.Details 'Generated by Wattos' _Org_constr_file_comment.Comment '*HEADER PROTEIN BINDING 01-SEP-14 2MTW *TITLE EVIDENCE SUPPORTING THE HYPOTHESIS THAT SPECIFICALLY MODIFYING A *TITLE 2 MALARIA PEPTIDE TO FIT INTO HLA-DR 1*03 MOLECULES INDUCES ANTIBODY *TITLE 3 PRODUCTION AND PROTECTION *COMPND MOL_ID: 1; *COMPND 2 MOLECULE: ERYTHROCYTE-BINDING ANTIGEN 175; *COMPND 3 CHAIN: A; *COMPND 4 FRAGMENT: UNP RESIDUES 1221-1239; *COMPND 5 SYNONYM: EBA-175; *COMPND 6 ENGINEERED: YES *SOURCE MOL_ID: 1; *SOURCE 2 SYNTHETIC: YES; *SOURCE 3 ORGANISM_SCIENTIFIC: PLASMODIUM FALCIPARUM CAMP/MALAYSIA; *SOURCE 4 ORGANISM_TAXID: 5835 *KEYWDS EBA-175, PROTEIN BINDING *EXPDTA SOLUTION NMR *NUMMDL 1 *AUTHOR G.CIFUENTES, L.SALAZAR, L.VARGAS, C.PARRA, M.VANEGAS, J.CORTES, *AUTHOR 2 M.SANDOVAL, M.PATARROYO *REVDAT 1 04-FEB-15 2MTW 0' save_