data_c19595_2mgo ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID c19595_2mgo _Entry.Title ; NMR solution structure of oxytocin ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2013-11-01 _Entry.Accession_date 2013-11-01 _Entry.Last_release_date 2014-02-11 _Entry.Original_release_date 2014-02-11 _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 Peta Harvey . J. . c19595_2mgo 2 David Craik . J. . c19595_2mgo 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' . c19595_2mgo stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID hormone . c19595_2mgo stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 c19595_2mgo stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 24 c19595_2mgo '1H chemical shifts' 60 c19595_2mgo 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 . . 2014-02-11 2013-11-01 original author . c19595_2mgo stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 2MGO 'BMRB Entry Tracking System' c19595_2mgo stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID c19595_2mgo _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 24248349 _Citation.Full_citation . _Citation.Title 'Oxytocic plant cyclotides as templates for peptide G protein-coupled receptor ligand design.' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Proc. Natl. Acad. Sci. U.S.A.' _Citation.Journal_name_full 'Proceedings of the National Academy of Sciences of the United States of America' _Citation.Journal_volume 110 _Citation.Journal_issue 52 _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 21183 _Citation.Page_last 21188 _Citation.Year 2013 _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 Johannes Koehbach . . . c19595_2mgo 1 2 Margaret Muttenthaler . . . c19595_2mgo 1 3 Markus Miazzo . . . c19595_2mgo 1 4 Marion Akcan . . . c19595_2mgo 1 5 Muharrem Elliott . . . c19595_2mgo 1 6 Alysha Daly . G. . c19595_2mgo 1 7 Norelle Harvey . L. . c19595_2mgo 1 8 Peta Arrowsmith . J. . c19595_2mgo 1 9 Sarah Gunasekera . . . c19595_2mgo 1 10 Sunithi Smith . . . c19595_2mgo 1 11 Terry Wray . J. . c19595_2mgo 1 12 Susan Goransson . . . c19595_2mgo 1 13 Ulf Dawson . . . c19595_2mgo 1 14 Philip Craik . E. . c19595_2mgo 1 15 David Freissmuth . J. . c19595_2mgo 1 16 Michael Gruber . . . c19595_2mgo 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID c19595_2mgo _Assembly.ID 1 _Assembly.Name oxytocin _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 oxytocin 1 $oxytocin A . yes native no no . . . c19595_2mgo 1 stop_ loop_ _Bond.ID _Bond.Type _Bond.Value_order _Bond.Assembly_atom_ID_1 _Bond.Entity_assembly_ID_1 _Bond.Entity_assembly_name_1 _Bond.Entity_ID_1 _Bond.Comp_ID_1 _Bond.Comp_index_ID_1 _Bond.Seq_ID_1 _Bond.Atom_ID_1 _Bond.Assembly_atom_ID_2 _Bond.Entity_assembly_ID_2 _Bond.Entity_assembly_name_2 _Bond.Entity_ID_2 _Bond.Comp_ID_2 _Bond.Comp_index_ID_2 _Bond.Seq_ID_2 _Bond.Atom_ID_2 _Bond.Auth_entity_assembly_ID_1 _Bond.Auth_entity_assembly_name_1 _Bond.Auth_seq_ID_1 _Bond.Auth_comp_ID_1 _Bond.Auth_atom_ID_1 _Bond.Auth_entity_assembly_ID_2 _Bond.Auth_entity_assembly_name_2 _Bond.Auth_seq_ID_2 _Bond.Auth_comp_ID_2 _Bond.Auth_atom_ID_2 _Bond.Entry_ID _Bond.Assembly_ID 1 disulfide single . 1 oxytocin 1 CYS 1 1 SG . 1 oxytocin 1 CYS 6 6 SG . oxytocin 1 CYS SG . oxytocin 6 CYS SG c19595_2mgo 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_oxytocin _Entity.Sf_category entity _Entity.Sf_framecode oxytocin _Entity.Entry_ID c19595_2mgo _Entity.ID 1 _Entity.BMRB_code . _Entity.Name oxytocin _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 CYIQNCPLG _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 9 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all disulfide bound' _Entity.Src_method man _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 1010.188 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . 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 CYS . c19595_2mgo 1 2 2 TYR . c19595_2mgo 1 3 3 ILE . c19595_2mgo 1 4 4 GLN . c19595_2mgo 1 5 5 ASN . c19595_2mgo 1 6 6 CYS . c19595_2mgo 1 7 7 PRO . c19595_2mgo 1 8 8 LEU . c19595_2mgo 1 9 9 GLY . c19595_2mgo 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 . CYS 1 1 c19595_2mgo 1 . TYR 2 2 c19595_2mgo 1 . ILE 3 3 c19595_2mgo 1 . GLN 4 4 c19595_2mgo 1 . ASN 5 5 c19595_2mgo 1 . CYS 6 6 c19595_2mgo 1 . PRO 7 7 c19595_2mgo 1 . LEU 8 8 c19595_2mgo 1 . GLY 9 9 c19595_2mgo 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 c19595_2mgo _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 $oxytocin . 9606 organism . 'Homo sapiens' human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . . . . . . . . . c19595_2mgo 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 c19595_2mgo _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 $oxytocin . 'chemical synthesis' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . c19595_2mgo 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID c19595_2mgo _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _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 oxytocin 'natural abundance' . . 1 $oxytocin . . 2.0 . . mM . . . . c19595_2mgo 1 2 H2O 'natural abundance' . . . . . . 90 . . % . . . . c19595_2mgo 1 3 D2O '[U-100% 2H]' . . . . . . 10 . . % . . . . c19595_2mgo 1 stop_ save_ save_sample_2 _Sample.Sf_category sample _Sample.Sf_framecode sample_2 _Sample.Entry_ID c19595_2mgo _Sample.ID 2 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '100% D2O' _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 oxytocin 'natural abundance' . . 1 $oxytocin . . 2.0 . . mM . . . . c19595_2mgo 2 2 D2O '[U-100% 2H]' . . . . . . 100 . . % . . . . c19595_2mgo 2 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 c19595_2mgo _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 'ionic strength' 0 . M c19595_2mgo 1 pH 3.5 . pH c19595_2mgo 1 temperature 298 . K c19595_2mgo 1 stop_ save_ ############################ # Computer software used # ############################ save_TOPSPIN _Software.Sf_category software _Software.Sf_framecode TOPSPIN _Software.Entry_ID c19595_2mgo _Software.ID 1 _Software.Name TOPSPIN _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bruker Biospin' . . c19595_2mgo 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection c19595_2mgo 1 stop_ save_ save_CYANA _Software.Sf_category software _Software.Sf_framecode CYANA _Software.Entry_ID c19595_2mgo _Software.ID 2 _Software.Name CYANA _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Guntert, Mumenthaler and Wuthrich' . . c19595_2mgo 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'structure solution' c19595_2mgo 2 stop_ save_ save_CNSSOLVE _Software.Sf_category software _Software.Sf_framecode CNSSOLVE _Software.Entry_ID c19595_2mgo _Software.ID 3 _Software.Name CNSSOLVE _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Brunger, Adams, Clore, Gros, Nilges and Read' . . c19595_2mgo 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID refinement c19595_2mgo 3 'structure solution' c19595_2mgo 3 stop_ save_ save_SPARKY _Software.Sf_category software _Software.Sf_framecode SPARKY _Software.Entry_ID c19595_2mgo _Software.ID 4 _Software.Name SPARKY _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Goddard . . c19595_2mgo 4 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' c19595_2mgo 4 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 c19595_2mgo _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _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 c19595_2mgo _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 Avance . 600 . . . c19595_2mgo 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 c19595_2mgo _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 1H-1H TOCSY' no 1 $NMR_spectrometer_expt . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . c19595_2mgo 1 2 '2D 1H-1H NOESY' no 1 $NMR_spectrometer_expt . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . c19595_2mgo 1 3 '2D 1H-13C HSQC aliphatic' no 1 $NMR_spectrometer_expt . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . c19595_2mgo 1 stop_ save_ save_NMR_spectrometer_expt _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spectrometer_expt _NMR_spec_expt.Entry_ID c19595_2mgo _NMR_spec_expt.ID 1 _NMR_spec_expt.Name . _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID 1 _NMR_spec_expt.NMR_spectrometer_label $spectrometer_1 _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . 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 c19595_2mgo _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 C 13 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.251449530 . . . . . . . . . c19595_2mgo 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . . . . . c19595_2mgo 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 c19595_2mgo _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 1 '2D 1H-1H TOCSY' . . . c19595_2mgo 1 2 '2D 1H-1H NOESY' . . . c19595_2mgo 1 3 '2D 1H-13C HSQC aliphatic' . . . c19595_2mgo 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 CYS HA H 1 4.269 0.003 . 1 . . . A 1 CYS HA . c19595_2mgo 1 2 . 1 1 1 1 CYS HB2 H 1 3.456 0.006 . 2 . . . A 1 CYS HB2 . c19595_2mgo 1 3 . 1 1 1 1 CYS HB3 H 1 3.297 0.005 . 2 . . . A 1 CYS HB3 . c19595_2mgo 1 4 . 1 1 1 1 CYS CA C 13 55.013 0.000 . 1 . . . A 1 CYS CA . c19595_2mgo 1 5 . 1 1 1 1 CYS CB C 13 42.319 0.000 . 1 . . . A 1 CYS CB . c19595_2mgo 1 6 . 1 1 2 2 TYR H H 1 8.991 0.002 . 1 . . . A 2 TYR H . c19595_2mgo 1 7 . 1 1 2 2 TYR HA H 1 4.776 0.002 . 1 . . . A 2 TYR HA . c19595_2mgo 1 8 . 1 1 2 2 TYR HB2 H 1 3.012 0.006 . 2 . . . A 2 TYR HB2 . c19595_2mgo 1 9 . 1 1 2 2 TYR HB3 H 1 3.162 0.005 . 2 . . . A 2 TYR HB3 . c19595_2mgo 1 10 . 1 1 2 2 TYR HD1 H 1 7.209 0.002 . 3 . . . A 2 TYR HD1 . c19595_2mgo 1 11 . 1 1 2 2 TYR HD2 H 1 7.209 0.002 . 3 . . . A 2 TYR HD2 . c19595_2mgo 1 12 . 1 1 2 2 TYR HE1 H 1 6.872 0.001 . 3 . . . A 2 TYR HE1 . c19595_2mgo 1 13 . 1 1 2 2 TYR HE2 H 1 6.872 0.001 . 3 . . . A 2 TYR HE2 . c19595_2mgo 1 14 . 1 1 2 2 TYR CB C 13 38.843 0.005 . 1 . . . A 2 TYR CB . c19595_2mgo 1 15 . 1 1 3 3 ILE H H 1 7.960 0.001 . 1 . . . A 3 ILE H . c19595_2mgo 1 16 . 1 1 3 3 ILE HA H 1 4.041 0.006 . 1 . . . A 3 ILE HA . c19595_2mgo 1 17 . 1 1 3 3 ILE HB H 1 1.918 0.004 . 1 . . . A 3 ILE HB . c19595_2mgo 1 18 . 1 1 3 3 ILE HG12 H 1 1.105 0.109 . 2 . . . A 3 ILE HG12 . c19595_2mgo 1 19 . 1 1 3 3 ILE HG13 H 1 1.145 0.100 . 2 . . . A 3 ILE HG13 . c19595_2mgo 1 20 . 1 1 3 3 ILE HG21 H 1 0.872 0.004 . 1 . . . A 3 ILE HG21 . c19595_2mgo 1 21 . 1 1 3 3 ILE HG22 H 1 0.872 0.004 . 1 . . . A 3 ILE HG22 . c19595_2mgo 1 22 . 1 1 3 3 ILE HG23 H 1 0.872 0.004 . 1 . . . A 3 ILE HG23 . c19595_2mgo 1 23 . 1 1 3 3 ILE HD11 H 1 0.851 0.004 . 1 . . . A 3 ILE HD11 . c19595_2mgo 1 24 . 1 1 3 3 ILE HD12 H 1 0.851 0.004 . 1 . . . A 3 ILE HD12 . c19595_2mgo 1 25 . 1 1 3 3 ILE HD13 H 1 0.851 0.004 . 1 . . . A 3 ILE HD13 . c19595_2mgo 1 26 . 1 1 3 3 ILE CA C 13 62.672 0.000 . 1 . . . A 3 ILE CA . c19595_2mgo 1 27 . 1 1 3 3 ILE CB C 13 38.706 0.000 . 1 . . . A 3 ILE CB . c19595_2mgo 1 28 . 1 1 3 3 ILE CG1 C 13 27.261 0.019 . 1 . . . A 3 ILE CG1 . c19595_2mgo 1 29 . 1 1 3 3 ILE CG2 C 13 17.596 0.000 . 1 . . . A 3 ILE CG2 . c19595_2mgo 1 30 . 1 1 3 3 ILE CD1 C 13 13.315 0.000 . 1 . . . A 3 ILE CD1 . c19595_2mgo 1 31 . 1 1 4 4 GLN H H 1 8.229 0.001 . 1 . . . A 4 GLN H . c19595_2mgo 1 32 . 1 1 4 4 GLN HA H 1 4.110 0.002 . 1 . . . A 4 GLN HA . c19595_2mgo 1 33 . 1 1 4 4 GLN HB2 H 1 2.070 0.008 . 2 . . . A 4 GLN HB2 . c19595_2mgo 1 34 . 1 1 4 4 GLN HB3 H 1 2.070 0.008 . 2 . . . A 4 GLN HB3 . c19595_2mgo 1 35 . 1 1 4 4 GLN HG2 H 1 2.403 0.005 . 2 . . . A 4 GLN HG2 . c19595_2mgo 1 36 . 1 1 4 4 GLN HG3 H 1 2.403 0.005 . 2 . . . A 4 GLN HG3 . c19595_2mgo 1 37 . 1 1 4 4 GLN HE21 H 1 6.864 0.002 . 2 . . . A 4 GLN HE21 . c19595_2mgo 1 38 . 1 1 4 4 GLN HE22 H 1 7.556 0.001 . 2 . . . A 4 GLN HE22 . c19595_2mgo 1 39 . 1 1 4 4 GLN CA C 13 57.854 0.000 . 1 . . . A 4 GLN CA . c19595_2mgo 1 40 . 1 1 4 4 GLN CB C 13 28.542 0.019 . 1 . . . A 4 GLN CB . c19595_2mgo 1 41 . 1 1 4 4 GLN CG C 13 33.785 0.015 . 1 . . . A 4 GLN CG . c19595_2mgo 1 42 . 1 1 5 5 ASN H H 1 8.339 0.005 . 1 . . . A 5 ASN H . c19595_2mgo 1 43 . 1 1 5 5 ASN HA H 1 4.728 0.003 . 1 . . . A 5 ASN HA . c19595_2mgo 1 44 . 1 1 5 5 ASN HB2 H 1 2.852 0.004 . 2 . . . A 5 ASN HB2 . c19595_2mgo 1 45 . 1 1 5 5 ASN HB3 H 1 2.852 0.004 . 2 . . . A 5 ASN HB3 . c19595_2mgo 1 46 . 1 1 5 5 ASN HD21 H 1 6.929 0.002 . 2 . . . A 5 ASN HD21 . c19595_2mgo 1 47 . 1 1 5 5 ASN HD22 H 1 7.608 0.001 . 2 . . . A 5 ASN HD22 . c19595_2mgo 1 48 . 1 1 5 5 ASN CA C 13 53.112 0.021 . 1 . . . A 5 ASN CA . c19595_2mgo 1 49 . 1 1 5 5 ASN CB C 13 38.460 0.000 . 1 . . . A 5 ASN CB . c19595_2mgo 1 50 . 1 1 6 6 CYS H H 1 8.218 0.002 . 1 . . . A 6 CYS H . c19595_2mgo 1 51 . 1 1 6 6 CYS HA H 1 4.870 0.004 . 1 . . . A 6 CYS HA . c19595_2mgo 1 52 . 1 1 6 6 CYS HB2 H 1 2.972 0.004 . 2 . . . A 6 CYS HB2 . c19595_2mgo 1 53 . 1 1 6 6 CYS HB3 H 1 3.220 0.009 . 2 . . . A 6 CYS HB3 . c19595_2mgo 1 54 . 1 1 6 6 CYS CA C 13 54.068 0.000 . 1 . . . A 6 CYS CA . c19595_2mgo 1 55 . 1 1 6 6 CYS CB C 13 40.983 0.008 . 1 . . . A 6 CYS CB . c19595_2mgo 1 56 . 1 1 7 7 PRO HA H 1 4.443 0.002 . 1 . . . A 7 PRO HA . c19595_2mgo 1 57 . 1 1 7 7 PRO HB2 H 1 2.292 0.005 . 2 . . . A 7 PRO HB2 . c19595_2mgo 1 58 . 1 1 7 7 PRO HB3 H 1 1.935 0.005 . 2 . . . A 7 PRO HB3 . c19595_2mgo 1 59 . 1 1 7 7 PRO HG2 H 1 2.030 0.004 . 2 . . . A 7 PRO HG2 . c19595_2mgo 1 60 . 1 1 7 7 PRO HG3 H 1 2.030 0.004 . 2 . . . A 7 PRO HG3 . c19595_2mgo 1 61 . 1 1 7 7 PRO HD2 H 1 3.716 0.012 . 2 . . . A 7 PRO HD2 . c19595_2mgo 1 62 . 1 1 7 7 PRO HD3 H 1 3.738 0.013 . 2 . . . A 7 PRO HD3 . c19595_2mgo 1 63 . 1 1 7 7 PRO CA C 13 63.324 0.000 . 1 . . . A 7 PRO CA . c19595_2mgo 1 64 . 1 1 7 7 PRO CB C 13 32.010 0.005 . 1 . . . A 7 PRO CB . c19595_2mgo 1 65 . 1 1 7 7 PRO CG C 13 27.370 0.011 . 1 . . . A 7 PRO CG . c19595_2mgo 1 66 . 1 1 7 7 PRO CD C 13 50.654 0.020 . 1 . . . A 7 PRO CD . c19595_2mgo 1 67 . 1 1 8 8 LEU H H 1 8.488 0.002 . 1 . . . A 8 LEU H . c19595_2mgo 1 68 . 1 1 8 8 LEU HA H 1 4.303 0.003 . 1 . . . A 8 LEU HA . c19595_2mgo 1 69 . 1 1 8 8 LEU HB2 H 1 1.622 0.017 . 2 . . . A 8 LEU HB2 . c19595_2mgo 1 70 . 1 1 8 8 LEU HB3 H 1 1.673 0.007 . 2 . . . A 8 LEU HB3 . c19595_2mgo 1 71 . 1 1 8 8 LEU HD11 H 1 0.937 0.010 . 2 . . . A 8 LEU HD11 . c19595_2mgo 1 72 . 1 1 8 8 LEU HD12 H 1 0.937 0.010 . 2 . . . A 8 LEU HD12 . c19595_2mgo 1 73 . 1 1 8 8 LEU HD13 H 1 0.937 0.010 . 2 . . . A 8 LEU HD13 . c19595_2mgo 1 74 . 1 1 8 8 LEU HD21 H 1 0.896 0.010 . 2 . . . A 8 LEU HD21 . c19595_2mgo 1 75 . 1 1 8 8 LEU HD22 H 1 0.896 0.010 . 2 . . . A 8 LEU HD22 . c19595_2mgo 1 76 . 1 1 8 8 LEU HD23 H 1 0.896 0.010 . 2 . . . A 8 LEU HD23 . c19595_2mgo 1 77 . 1 1 8 8 LEU CA C 13 55.409 0.000 . 1 . . . A 8 LEU CA . c19595_2mgo 1 78 . 1 1 8 8 LEU CB C 13 42.037 0.007 . 1 . . . A 8 LEU CB . c19595_2mgo 1 79 . 1 1 8 8 LEU CD1 C 13 24.851 0.000 . 2 . . . A 8 LEU CD1 . c19595_2mgo 1 80 . 1 1 8 8 LEU CD2 C 13 23.417 0.000 . 2 . . . A 8 LEU CD2 . c19595_2mgo 1 81 . 1 1 9 9 GLY H H 1 8.394 0.003 . 1 . . . A 9 GLY H . c19595_2mgo 1 82 . 1 1 9 9 GLY HA2 H 1 3.910 0.007 . 2 . . . A 9 GLY HA2 . c19595_2mgo 1 83 . 1 1 9 9 GLY HA3 H 1 3.910 0.007 . 2 . . . A 9 GLY HA3 . c19595_2mgo 1 84 . 1 1 9 9 GLY CA C 13 44.856 0.000 . 1 . . . A 9 GLY CA . c19595_2mgo 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 c19595_2mgo _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 20 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 c19595_2mgo _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 . . . c19595_2mgo 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 . . . . c19595_2mgo 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 CYS C C 4.157 0.518 0.500 . . . 1.0 . . . . . . . . . . . . A . 1 CYS C . . . . . . . . . c19595_2mgo 1 . 1 . 2 . 1 1 1 CYS CA C 3.791 1.923 0.075 . . . 1.0 . . . . . . . . . . . . A . 1 CYS CA . . . . . . . . . c19595_2mgo 1 . 1 . 3 . 1 1 1 CYS CB C 3.435 1.946 -1.418 . . . 1.0 . . . . . . . . . . . . A . 1 CYS CB . . . . . . . . . c19595_2mgo 1 . 1 . 4 . 1 1 1 CYS H1 H 5.740 2.550 -0.125 . . . 1.0 . . . . . . . . . . . . A . 1 CYS H1 . . . . . . . . . c19595_2mgo 1 . 1 . 5 . 1 1 1 CYS H2 H 5.072 2.861 1.387 . . . 1.0 . . . . . . . . . . . . A . 1 CYS H2 . . . . . . . . . c19595_2mgo 1 . 1 . 6 . 1 1 1 CYS H3 H 4.642 3.820 0.062 . . . 1.0 . . . . . . . . . . . . A . 1 CYS H3 . . . . . . . . . c19595_2mgo 1 . 1 . 7 . 1 1 1 CYS HA H 2.928 2.234 0.643 . . . 1.0 . . . . . . . . . . . . A . 1 CYS HA . . . . . . . . . c19595_2mgo 1 . 1 . 8 . 1 1 1 CYS HB2 H 4.332 1.791 -1.997 . . . 1.0 . . . . . . . . . . . . A . 1 CYS HB2 . . . . . . . . . c19595_2mgo 1 . 1 . 9 . 1 1 1 CYS HB3 H 2.744 1.142 -1.622 . . . 1.0 . . . . . . . . . . . . A . 1 CYS HB3 . . . . . . . . . c19595_2mgo 1 . 1 . 10 . 1 1 1 CYS N N 4.874 2.855 0.366 . . . 1.0 . . . . . . . . . . . . A . 1 CYS N . . . . . . . . . c19595_2mgo 1 . 1 . 11 . 1 1 1 CYS O O 5.232 0.286 1.045 . . . 1.0 . . . . . . . . . . . . A . 1 CYS O . . . . . . . . . c19595_2mgo 1 . 1 . 12 . 1 1 1 CYS SG S 2.665 3.502 -1.990 . . . 1.0 . . . . . . . . . . . . A . 1 CYS SG . . . . . . . . . c19595_2mgo 1 . 1 . 13 . 1 1 2 TYR C C 2.361 -2.413 -0.333 . . . 1.0 . . . . . . . . . . . . A . 2 TYR C . . . . . . . . . c19595_2mgo 1 . 1 . 14 . 1 1 2 TYR CA C 3.387 -1.760 0.550 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CA . . . . . . . . . c19595_2mgo 1 . 1 . 15 . 1 1 2 TYR CB C 3.100 -2.041 2.041 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CB . . . . . . . . . c19595_2mgo 1 . 1 . 16 . 1 1 2 TYR CD1 C 4.530 -4.073 2.473 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CD1 . . . . . . . . . c19595_2mgo 1 . 1 . 17 . 1 1 2 TYR CD2 C 2.185 -4.258 2.838 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CD2 . . . . . . . . . c19595_2mgo 1 . 1 . 18 . 1 1 2 TYR CE1 C 4.697 -5.383 2.850 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CE1 . . . . . . . . . c19595_2mgo 1 . 1 . 19 . 1 1 2 TYR CE2 C 2.348 -5.571 3.218 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CE2 . . . . . . . . . c19595_2mgo 1 . 1 . 20 . 1 1 2 TYR CG C 3.274 -3.486 2.457 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CG . . . . . . . . . c19595_2mgo 1 . 1 . 21 . 1 1 2 TYR CZ C 3.607 -6.128 3.221 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CZ . . . . . . . . . c19595_2mgo 1 . 1 . 22 . 1 1 2 TYR H H 2.377 -0.218 -0.138 . . . 1.0 . . . . . . . . . . . . A . 2 TYR H . . . . . . . . . c19595_2mgo 1 . 1 . 23 . 1 1 2 TYR HA H 4.384 -2.073 0.287 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HA . . . . . . . . . c19595_2mgo 1 . 1 . 24 . 1 1 2 TYR HB2 H 3.772 -1.449 2.644 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HB2 . . . . . . . . . c19595_2mgo 1 . 1 . 25 . 1 1 2 TYR HB3 H 2.085 -1.750 2.255 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HB3 . . . . . . . . . c19595_2mgo 1 . 1 . 26 . 1 1 2 TYR HD1 H 5.390 -3.488 2.179 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HD1 . . . . . . . . . c19595_2mgo 1 . 1 . 27 . 1 1 2 TYR HD2 H 1.200 -3.817 2.836 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HD2 . . . . . . . . . c19595_2mgo 1 . 1 . 28 . 1 1 2 TYR HE1 H 5.688 -5.813 2.853 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HE1 . . . . . . . . . c19595_2mgo 1 . 1 . 29 . 1 1 2 TYR HE2 H 1.490 -6.159 3.512 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HE2 . . . . . . . . . c19595_2mgo 1 . 1 . 30 . 1 1 2 TYR HH H 4.479 -7.464 4.259 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HH . . . . . . . . . c19595_2mgo 1 . 1 . 31 . 1 1 2 TYR N N 3.252 -0.399 0.268 . . . 1.0 . . . . . . . . . . . . A . 2 TYR N . . . . . . . . . c19595_2mgo 1 . 1 . 32 . 1 1 2 TYR O O 1.436 -1.723 -0.788 . . . 1.0 . . . . . . . . . . . . A . 2 TYR O . . . . . . . . . c19595_2mgo 1 . 1 . 33 . 1 1 2 TYR OH O 3.773 -7.431 3.601 . . . 1.0 . . . . . . . . . . . . A . 2 TYR OH . . . . . . . . . c19595_2mgo 1 . 1 . 34 . 1 1 3 ILE C C 0.199 -4.221 -1.291 . . . 1.0 . . . . . . . . . . . . A . 3 ILE C . . . . . . . . . c19595_2mgo 1 . 1 . 35 . 1 1 3 ILE CA C 1.677 -4.511 -1.466 . . . 1.0 . . . . . . . . . . . . A . 3 ILE CA . . . . . . . . . c19595_2mgo 1 . 1 . 36 . 1 1 3 ILE CB C 1.928 -6.029 -1.237 . . . 1.0 . . . . . . . . . . . . A . 3 ILE CB . . . . . . . . . c19595_2mgo 1 . 1 . 37 . 1 1 3 ILE CD1 C 3.786 -7.783 -1.018 . . . 1.0 . . . . . . . . . . . . A . 3 ILE CD1 . . . . . . . . . c19595_2mgo 1 . 1 . 38 . 1 1 3 ILE CG1 C 3.427 -6.341 -1.317 . . . 1.0 . . . . . . . . . . . . A . 3 ILE CG1 . . . . . . . . . c19595_2mgo 1 . 1 . 39 . 1 1 3 ILE CG2 C 1.161 -6.856 -2.271 . . . 1.0 . . . . . . . . . . . . A . 3 ILE CG2 . . . . . . . . . c19595_2mgo 1 . 1 . 40 . 1 1 3 ILE H H 3.329 -4.061 -0.158 . . . 1.0 . . . . . . . . . . . . A . 3 ILE H . . . . . . . . . c19595_2mgo 1 . 1 . 41 . 1 1 3 ILE HA H 1.916 -4.277 -2.480 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HA . . . . . . . . . c19595_2mgo 1 . 1 . 42 . 1 1 3 ILE HB H 1.566 -6.288 -0.253 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HB . . . . . . . . . c19595_2mgo 1 . 1 . 43 . 1 1 3 ILE HD11 H 3.477 -8.030 -0.013 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HD11 . . . . . . . . . c19595_2mgo 1 . 1 . 44 . 1 1 3 ILE HD12 H 4.852 -7.914 -1.110 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HD12 . . . . . . . . . c19595_2mgo 1 . 1 . 45 . 1 1 3 ILE HD13 H 3.279 -8.428 -1.719 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HD13 . . . . . . . . . c19595_2mgo 1 . 1 . 46 . 1 1 3 ILE HG12 H 3.787 -6.114 -2.309 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HG12 . . . . . . . . . c19595_2mgo 1 . 1 . 47 . 1 1 3 ILE HG13 H 3.942 -5.720 -0.600 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HG13 . . . . . . . . . c19595_2mgo 1 . 1 . 48 . 1 1 3 ILE HG21 H 0.104 -6.656 -2.178 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HG21 . . . . . . . . . c19595_2mgo 1 . 1 . 49 . 1 1 3 ILE HG22 H 1.348 -7.906 -2.103 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HG22 . . . . . . . . . c19595_2mgo 1 . 1 . 50 . 1 1 3 ILE HG23 H 1.490 -6.585 -3.264 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HG23 . . . . . . . . . c19595_2mgo 1 . 1 . 51 . 1 1 3 ILE N N 2.531 -3.680 -0.581 . . . 1.0 . . . . . . . . . . . . A . 3 ILE N . . . . . . . . . c19595_2mgo 1 . 1 . 52 . 1 1 3 ILE O O -0.519 -3.905 -2.240 . . . 1.0 . . . . . . . . . . . . A . 3 ILE O . . . . . . . . . c19595_2mgo 1 . 1 . 53 . 1 1 4 GLN C C -1.790 -2.792 1.112 . . . 1.0 . . . . . . . . . . . . A . 4 GLN C . . . . . . . . . c19595_2mgo 1 . 1 . 54 . 1 1 4 GLN CA C -1.601 -4.078 0.283 . . . 1.0 . . . . . . . . . . . . A . 4 GLN CA . . . . . . . . . c19595_2mgo 1 . 1 . 55 . 1 1 4 GLN CB C -2.146 -5.314 1.032 . . . 1.0 . . . . . . . . . . . . A . 4 GLN CB . . . . . . . . . c19595_2mgo 1 . 1 . 56 . 1 1 4 GLN CD C -2.010 -6.885 3.023 . . . 1.0 . . . . . . . . . . . . A . 4 GLN CD . . . . . . . . . c19595_2mgo 1 . 1 . 57 . 1 1 4 GLN CG C -1.441 -5.647 2.338 . . . 1.0 . . . . . . . . . . . . A . 4 GLN CG . . . . . . . . . c19595_2mgo 1 . 1 . 58 . 1 1 4 GLN H H 0.534 -4.475 0.514 . . . 1.0 . . . . . . . . . . . . A . 4 GLN H . . . . . . . . . c19595_2mgo 1 . 1 . 59 . 1 1 4 GLN HA H -2.157 -3.961 -0.636 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HA . . . . . . . . . c19595_2mgo 1 . 1 . 60 . 1 1 4 GLN HB2 H -3.186 -5.141 1.261 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HB2 . . . . . . . . . c19595_2mgo 1 . 1 . 61 . 1 1 4 GLN HB3 H -2.073 -6.173 0.381 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HB3 . . . . . . . . . c19595_2mgo 1 . 1 . 62 . 1 1 4 GLN HE21 H -1.614 -6.104 4.777 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HE21 . . . . . . . . . c19595_2mgo 1 . 1 . 63 . 1 1 4 GLN HE22 H -2.310 -7.672 4.809 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HE22 . . . . . . . . . c19595_2mgo 1 . 1 . 64 . 1 1 4 GLN HG2 H -0.396 -5.820 2.131 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HG2 . . . . . . . . . c19595_2mgo 1 . 1 . 65 . 1 1 4 GLN HG3 H -1.539 -4.804 3.006 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HG3 . . . . . . . . . c19595_2mgo 1 . 1 . 66 . 1 1 4 GLN N N -0.204 -4.279 -0.093 . . . 1.0 . . . . . . . . . . . . A . 4 GLN N . . . . . . . . . c19595_2mgo 1 . 1 . 67 . 1 1 4 GLN NE2 N -1.983 -6.890 4.320 . . . 1.0 . . . . . . . . . . . . A . 4 GLN NE2 . . . . . . . . . c19595_2mgo 1 . 1 . 68 . 1 1 4 GLN O O -2.726 -2.685 1.911 . . . 1.0 . . . . . . . . . . . . A . 4 GLN O . . . . . . . . . c19595_2mgo 1 . 1 . 69 . 1 1 4 GLN OE1 O -2.494 -7.820 2.381 . . . 1.0 . . . . . . . . . . . . A . 4 GLN OE1 . . . . . . . . . c19595_2mgo 1 . 1 . 70 . 1 1 5 ASN C C -0.214 0.526 0.877 . . . 1.0 . . . . . . . . . . . . A . 5 ASN C . . . . . . . . . c19595_2mgo 1 . 1 . 71 . 1 1 5 ASN CA C -1.010 -0.533 1.594 . . . 1.0 . . . . . . . . . . . . A . 5 ASN CA . . . . . . . . . c19595_2mgo 1 . 1 . 72 . 1 1 5 ASN CB C -0.572 -0.650 3.081 . . . 1.0 . . . . . . . . . . . . A . 5 ASN CB . . . . . . . . . c19595_2mgo 1 . 1 . 73 . 1 1 5 ASN CG C -0.616 0.690 3.831 . . . 1.0 . . . . . . . . . . . . A . 5 ASN CG . . . . . . . . . c19595_2mgo 1 . 1 . 74 . 1 1 5 ASN H H -0.281 -1.878 0.152 . . . 1.0 . . . . . . . . . . . . A . 5 ASN H . . . . . . . . . c19595_2mgo 1 . 1 . 75 . 1 1 5 ASN HA H -2.046 -0.229 1.562 . . . 1.0 . . . . . . . . . . . . A . 5 ASN HA . . . . . . . . . c19595_2mgo 1 . 1 . 76 . 1 1 5 ASN HB2 H -1.214 -1.350 3.590 . . . 1.0 . . . . . . . . . . . . A . 5 ASN HB2 . . . . . . . . . c19595_2mgo 1 . 1 . 77 . 1 1 5 ASN HB3 H 0.440 -1.021 3.119 . . . 1.0 . . . . . . . . . . . . A . 5 ASN HB3 . . . . . . . . . c19595_2mgo 1 . 1 . 78 . 1 1 5 ASN HD21 H -2.545 0.463 4.229 . . . 1.0 . . . . . . . . . . . . A . 5 ASN HD21 . . . . . . . . . c19595_2mgo 1 . 1 . 79 . 1 1 5 ASN HD22 H -1.800 1.901 4.829 . . . 1.0 . . . . . . . . . . . . A . 5 ASN HD22 . . . . . . . . . c19595_2mgo 1 . 1 . 80 . 1 1 5 ASN N N -0.942 -1.802 0.876 . . . 1.0 . . . . . . . . . . . . A . 5 ASN N . . . . . . . . . c19595_2mgo 1 . 1 . 81 . 1 1 5 ASN ND2 N -1.765 1.049 4.341 . . . 1.0 . . . . . . . . . . . . A . 5 ASN ND2 . . . . . . . . . c19595_2mgo 1 . 1 . 82 . 1 1 5 ASN O O 0.937 0.794 1.192 . . . 1.0 . . . . . . . . . . . . A . 5 ASN O . . . . . . . . . c19595_2mgo 1 . 1 . 83 . 1 1 5 ASN OD1 O 0.387 1.404 3.922 . . . 1.0 . . . . . . . . . . . . A . 5 ASN OD1 . . . . . . . . . c19595_2mgo 1 . 1 . 84 . 1 1 6 CYS C C -1.051 3.316 -0.861 . . . 1.0 . . . . . . . . . . . . A . 6 CYS C . . . . . . . . . c19595_2mgo 1 . 1 . 85 . 1 1 6 CYS CA C -0.140 2.101 -0.873 . . . 1.0 . . . . . . . . . . . . A . 6 CYS CA . . . . . . . . . c19595_2mgo 1 . 1 . 86 . 1 1 6 CYS CB C 0.193 1.681 -2.308 . . . 1.0 . . . . . . . . . . . . A . 6 CYS CB . . . . . . . . . c19595_2mgo 1 . 1 . 87 . 1 1 6 CYS H H -1.607 0.632 -0.477 . . . 1.0 . . . . . . . . . . . . A . 6 CYS H . . . . . . . . . c19595_2mgo 1 . 1 . 88 . 1 1 6 CYS HA H 0.778 2.346 -0.358 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HA . . . . . . . . . c19595_2mgo 1 . 1 . 89 . 1 1 6 CYS HB2 H 0.742 0.752 -2.286 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HB2 . . . . . . . . . c19595_2mgo 1 . 1 . 90 . 1 1 6 CYS HB3 H -0.736 1.528 -2.838 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HB3 . . . . . . . . . c19595_2mgo 1 . 1 . 91 . 1 1 6 CYS N N -0.764 1.026 -0.158 . . . 1.0 . . . . . . . . . . . . A . 6 CYS N . . . . . . . . . c19595_2mgo 1 . 1 . 92 . 1 1 6 CYS O O -2.141 3.274 -1.434 . . . 1.0 . . . . . . . . . . . . A . 6 CYS O . . . . . . . . . c19595_2mgo 1 . 1 . 93 . 1 1 6 CYS SG S 1.185 2.902 -3.264 . . . 1.0 . . . . . . . . . . . . A . 6 CYS SG . . . . . . . . . c19595_2mgo 1 . 1 . 94 . 1 1 7 PRO C C -1.574 6.192 -1.529 . . . 1.0 . . . . . . . . . . . . A . 7 PRO C . . . . . . . . . c19595_2mgo 1 . 1 . 95 . 1 1 7 PRO CA C -1.424 5.635 -0.117 . . . 1.0 . . . . . . . . . . . . A . 7 PRO CA . . . . . . . . . c19595_2mgo 1 . 1 . 96 . 1 1 7 PRO CB C -0.555 6.569 0.729 . . . 1.0 . . . . . . . . . . . . A . 7 PRO CB . . . . . . . . . c19595_2mgo 1 . 1 . 97 . 1 1 7 PRO CD C 0.537 4.459 0.710 . . . 1.0 . . . . . . . . . . . . A . 7 PRO CD . . . . . . . . . c19595_2mgo 1 . 1 . 98 . 1 1 7 PRO CG C 0.282 5.665 1.553 . . . 1.0 . . . . . . . . . . . . A . 7 PRO CG . . . . . . . . . c19595_2mgo 1 . 1 . 99 . 1 1 7 PRO HA H -2.395 5.502 0.335 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HA . . . . . . . . . c19595_2mgo 1 . 1 . 100 . 1 1 7 PRO HB2 H 0.048 7.185 0.077 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HB2 . . . . . . . . . c19595_2mgo 1 . 1 . 101 . 1 1 7 PRO HB3 H -1.184 7.194 1.344 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HB3 . . . . . . . . . c19595_2mgo 1 . 1 . 102 . 1 1 7 PRO HD2 H 1.429 4.592 0.115 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HD2 . . . . . . . . . c19595_2mgo 1 . 1 . 103 . 1 1 7 PRO HD3 H 0.620 3.579 1.332 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HD3 . . . . . . . . . c19595_2mgo 1 . 1 . 104 . 1 1 7 PRO HG2 H 1.212 6.152 1.808 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HG2 . . . . . . . . . c19595_2mgo 1 . 1 . 105 . 1 1 7 PRO HG3 H -0.254 5.387 2.449 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HG3 . . . . . . . . . c19595_2mgo 1 . 1 . 106 . 1 1 7 PRO N N -0.660 4.386 -0.143 . . . 1.0 . . . . . . . . . . . . A . 7 PRO N . . . . . . . . . c19595_2mgo 1 . 1 . 107 . 1 1 7 PRO O O -0.590 6.580 -2.165 . . . 1.0 . . . . . . . . . . . . A . 7 PRO O . . . . . . . . . c19595_2mgo 1 . 1 . 108 . 1 1 8 LEU C C -3.389 8.088 -3.457 . . . 1.0 . . . . . . . . . . . . A . 8 LEU C . . . . . . . . . c19595_2mgo 1 . 1 . 109 . 1 1 8 LEU CA C -3.044 6.624 -3.392 . . . 1.0 . . . . . . . . . . . . A . 8 LEU CA . . . . . . . . . c19595_2mgo 1 . 1 . 110 . 1 1 8 LEU CB C -4.136 5.783 -4.023 . . . 1.0 . . . . . . . . . . . . A . 8 LEU CB . . . . . . . . . c19595_2mgo 1 . 1 . 111 . 1 1 8 LEU CD1 C -5.036 3.567 -4.795 . . . 1.0 . . . . . . . . . . . . A . 8 LEU CD1 . . . . . . . . . c19595_2mgo 1 . 1 . 112 . 1 1 8 LEU CD2 C -2.590 4.042 -5.000 . . . 1.0 . . . . . . . . . . . . A . 8 LEU CD2 . . . . . . . . . c19595_2mgo 1 . 1 . 113 . 1 1 8 LEU CG C -3.848 4.280 -4.173 . . . 1.0 . . . . . . . . . . . . A . 8 LEU CG . . . . . . . . . c19595_2mgo 1 . 1 . 114 . 1 1 8 LEU H H -3.532 5.912 -1.455 . . . 1.0 . . . . . . . . . . . . A . 8 LEU H . . . . . . . . . c19595_2mgo 1 . 1 . 115 . 1 1 8 LEU HA H -2.131 6.487 -3.939 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HA . . . . . . . . . c19595_2mgo 1 . 1 . 116 . 1 1 8 LEU HB2 H -5.028 5.902 -3.423 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HB2 . . . . . . . . . c19595_2mgo 1 . 1 . 117 . 1 1 8 LEU HB3 H -4.316 6.211 -4.993 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HB3 . . . . . . . . . c19595_2mgo 1 . 1 . 118 . 1 1 8 LEU HD11 H -4.811 2.516 -4.898 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HD11 . . . . . . . . . c19595_2mgo 1 . 1 . 119 . 1 1 8 LEU HD12 H -5.242 3.990 -5.767 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HD12 . . . . . . . . . c19595_2mgo 1 . 1 . 120 . 1 1 8 LEU HD13 H -5.902 3.690 -4.161 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HD13 . . . . . . . . . c19595_2mgo 1 . 1 . 121 . 1 1 8 LEU HD21 H -2.703 4.498 -5.973 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HD21 . . . . . . . . . c19595_2mgo 1 . 1 . 122 . 1 1 8 LEU HD22 H -2.433 2.979 -5.115 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HD22 . . . . . . . . . c19595_2mgo 1 . 1 . 123 . 1 1 8 LEU HD23 H -1.739 4.471 -4.494 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HD23 . . . . . . . . . c19595_2mgo 1 . 1 . 124 . 1 1 8 LEU HG H -3.694 3.858 -3.191 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HG . . . . . . . . . c19595_2mgo 1 . 1 . 125 . 1 1 8 LEU N N -2.786 6.199 -2.024 . . . 1.0 . . . . . . . . . . . . A . 8 LEU N . . . . . . . . . c19595_2mgo 1 . 1 . 126 . 1 1 8 LEU O O -3.608 8.661 -4.523 . . . 1.0 . . . . . . . . . . . . A . 8 LEU O . . . . . . . . . c19595_2mgo 1 . 1 . 127 . 1 1 9 GLY C C -3.647 10.353 -0.712 . . . 1.0 . . . . . . . . . . . . A . 9 GLY C . . . . . . . . . c19595_2mgo 1 . 1 . 128 . 1 1 9 GLY CA C -3.689 10.034 -2.161 . . . 1.0 . . . . . . . . . . . . A . 9 GLY CA . . . . . . . . . c19595_2mgo 1 . 1 . 129 . 1 1 9 GLY H H -3.209 8.066 -1.579 . . . 1.0 . . . . . . . . . . . . A . 9 GLY H . . . . . . . . . c19595_2mgo 1 . 1 . 130 . 1 1 9 GLY HA2 H -2.953 10.621 -2.691 . . . 1.0 . . . . . . . . . . . . A . 9 GLY HA2 . . . . . . . . . c19595_2mgo 1 . 1 . 131 . 1 1 9 GLY HA3 H -4.676 10.254 -2.541 . . . 1.0 . . . . . . . . . . . . A . 9 GLY HA3 . . . . . . . . . c19595_2mgo 1 . 1 . 132 . 1 1 9 GLY N N -3.406 8.654 -2.333 . . . 1.0 . . . . . . . . . . . . A . 9 GLY N . . . . . . . . . c19595_2mgo 1 . 1 . 133 . 1 1 9 GLY O O -3.337 11.487 -0.337 . . . 1.0 . . . . . . . . . . . . A . 9 GLY O . . . . . . . . . c19595_2mgo 1 . 1 . 134 . 1 1 9 GLY OXT O -3.916 9.443 0.096 . . . 1.0 . . . . . . . . . . . . A . 9 GLY OXT . . . . . . . . . c19595_2mgo 1 . 2 . 135 . 1 1 1 CYS C C 4.659 0.509 -0.530 . . . 1.0 . . . . . . . . . . . . A . 1 CYS C . . . . . . . . . c19595_2mgo 1 . 2 . 136 . 1 1 1 CYS CA C 4.820 1.561 0.543 . . . 1.0 . . . . . . . . . . . . A . 1 CYS CA . . . . . . . . . c19595_2mgo 1 . 2 . 137 . 1 1 1 CYS CB C 3.520 1.709 1.346 . . . 1.0 . . . . . . . . . . . . A . 1 CYS CB . . . . . . . . . c19595_2mgo 1 . 2 . 138 . 1 1 1 CYS H1 H 5.272 3.593 0.590 . . . 1.0 . . . . . . . . . . . . A . 1 CYS H1 . . . . . . . . . c19595_2mgo 1 . 2 . 139 . 1 1 1 CYS H2 H 4.371 3.050 -0.748 . . . 1.0 . . . . . . . . . . . . A . 1 CYS H2 . . . . . . . . . c19595_2mgo 1 . 2 . 140 . 1 1 1 CYS H3 H 6.000 2.711 -0.677 . . . 1.0 . . . . . . . . . . . . A . 1 CYS H3 . . . . . . . . . c19595_2mgo 1 . 2 . 141 . 1 1 1 CYS HA H 5.626 1.282 1.206 . . . 1.0 . . . . . . . . . . . . A . 1 CYS HA . . . . . . . . . c19595_2mgo 1 . 2 . 142 . 1 1 1 CYS HB2 H 3.222 0.746 1.733 . . . 1.0 . . . . . . . . . . . . A . 1 CYS HB2 . . . . . . . . . c19595_2mgo 1 . 2 . 143 . 1 1 1 CYS HB3 H 3.680 2.389 2.168 . . . 1.0 . . . . . . . . . . . . A . 1 CYS HB3 . . . . . . . . . c19595_2mgo 1 . 2 . 144 . 1 1 1 CYS N N 5.148 2.822 -0.095 . . . 1.0 . . . . . . . . . . . . A . 1 CYS N . . . . . . . . . c19595_2mgo 1 . 2 . 145 . 1 1 1 CYS O O 4.364 0.839 -1.679 . . . 1.0 . . . . . . . . . . . . A . 1 CYS O . . . . . . . . . c19595_2mgo 1 . 2 . 146 . 1 1 1 CYS SG S 2.102 2.342 0.384 . . . 1.0 . . . . . . . . . . . . A . 1 CYS SG . . . . . . . . . c19595_2mgo 1 . 2 . 147 . 1 1 2 TYR C C 3.937 -2.931 -0.504 . . . 1.0 . . . . . . . . . . . . A . 2 TYR C . . . . . . . . . c19595_2mgo 1 . 2 . 148 . 1 1 2 TYR CA C 4.699 -1.789 -1.149 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CA . . . . . . . . . c19595_2mgo 1 . 2 . 149 . 1 1 2 TYR CB C 6.044 -2.243 -1.761 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CB . . . . . . . . . c19595_2mgo 1 . 2 . 150 . 1 1 2 TYR CD1 C 5.312 -2.806 -4.112 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CD1 . . . . . . . . . c19595_2mgo 1 . 2 . 151 . 1 1 2 TYR CD2 C 6.398 -4.505 -2.852 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CD2 . . . . . . . . . c19595_2mgo 1 . 2 . 152 . 1 1 2 TYR CE1 C 5.196 -3.662 -5.180 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CE1 . . . . . . . . . c19595_2mgo 1 . 2 . 153 . 1 1 2 TYR CE2 C 6.284 -5.371 -3.922 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CE2 . . . . . . . . . c19595_2mgo 1 . 2 . 154 . 1 1 2 TYR CG C 5.910 -3.208 -2.928 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CG . . . . . . . . . c19595_2mgo 1 . 2 . 155 . 1 1 2 TYR CZ C 5.683 -4.943 -5.082 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CZ . . . . . . . . . c19595_2mgo 1 . 2 . 156 . 1 1 2 TYR H H 5.164 -0.963 0.716 . . . 1.0 . . . . . . . . . . . . A . 2 TYR H . . . . . . . . . c19595_2mgo 1 . 2 . 157 . 1 1 2 TYR HA H 4.075 -1.386 -1.933 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HA . . . . . . . . . c19595_2mgo 1 . 2 . 158 . 1 1 2 TYR HB2 H 6.578 -1.372 -2.115 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HB2 . . . . . . . . . c19595_2mgo 1 . 2 . 159 . 1 1 2 TYR HB3 H 6.631 -2.723 -0.992 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HB3 . . . . . . . . . c19595_2mgo 1 . 2 . 160 . 1 1 2 TYR HD1 H 4.926 -1.801 -4.190 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HD1 . . . . . . . . . c19595_2mgo 1 . 2 . 161 . 1 1 2 TYR HD2 H 6.869 -4.839 -1.940 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HD2 . . . . . . . . . c19595_2mgo 1 . 2 . 162 . 1 1 2 TYR HE1 H 4.724 -3.317 -6.088 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HE1 . . . . . . . . . c19595_2mgo 1 . 2 . 163 . 1 1 2 TYR HE2 H 6.671 -6.376 -3.841 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HE2 . . . . . . . . . c19595_2mgo 1 . 2 . 164 . 1 1 2 TYR HH H 5.764 -5.310 -6.959 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HH . . . . . . . . . c19595_2mgo 1 . 2 . 165 . 1 1 2 TYR N N 4.877 -0.736 -0.196 . . . 1.0 . . . . . . . . . . . . A . 2 TYR N . . . . . . . . . c19595_2mgo 1 . 2 . 166 . 1 1 2 TYR O O 4.495 -3.980 -0.173 . . . 1.0 . . . . . . . . . . . . A . 2 TYR O . . . . . . . . . c19595_2mgo 1 . 2 . 167 . 1 1 2 TYR OH O 5.576 -5.799 -6.149 . . . 1.0 . . . . . . . . . . . . A . 2 TYR OH . . . . . . . . . c19595_2mgo 1 . 2 . 168 . 1 1 3 ILE C C 0.426 -3.268 -0.284 . . . 1.0 . . . . . . . . . . . . A . 3 ILE C . . . . . . . . . c19595_2mgo 1 . 2 . 169 . 1 1 3 ILE CA C 1.758 -3.582 0.338 . . . 1.0 . . . . . . . . . . . . A . 3 ILE CA . . . . . . . . . c19595_2mgo 1 . 2 . 170 . 1 1 3 ILE CB C 1.653 -3.447 1.880 . . . 1.0 . . . . . . . . . . . . A . 3 ILE CB . . . . . . . . . c19595_2mgo 1 . 2 . 171 . 1 1 3 ILE CD1 C 1.352 -1.774 3.812 . . . 1.0 . . . . . . . . . . . . A . 3 ILE CD1 . . . . . . . . . c19595_2mgo 1 . 2 . 172 . 1 1 3 ILE CG1 C 1.460 -1.975 2.313 . . . 1.0 . . . . . . . . . . . . A . 3 ILE CG1 . . . . . . . . . c19595_2mgo 1 . 2 . 173 . 1 1 3 ILE CG2 C 2.830 -4.107 2.593 . . . 1.0 . . . . . . . . . . . . A . 3 ILE CG2 . . . . . . . . . c19595_2mgo 1 . 2 . 174 . 1 1 3 ILE H H 2.298 -1.784 -0.415 . . . 1.0 . . . . . . . . . . . . A . 3 ILE H . . . . . . . . . c19595_2mgo 1 . 2 . 175 . 1 1 3 ILE HA H 2.055 -4.584 0.073 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HA . . . . . . . . . c19595_2mgo 1 . 2 . 176 . 1 1 3 ILE HB H 0.760 -3.992 2.133 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HB . . . . . . . . . c19595_2mgo 1 . 2 . 177 . 1 1 3 ILE HD11 H 0.559 -2.390 4.208 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HD11 . . . . . . . . . c19595_2mgo 1 . 2 . 178 . 1 1 3 ILE HD12 H 1.153 -0.734 4.025 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HD12 . . . . . . . . . c19595_2mgo 1 . 2 . 179 . 1 1 3 ILE HD13 H 2.287 -2.058 4.273 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HD13 . . . . . . . . . c19595_2mgo 1 . 2 . 180 . 1 1 3 ILE HG12 H 2.302 -1.394 1.963 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HG12 . . . . . . . . . c19595_2mgo 1 . 2 . 181 . 1 1 3 ILE HG13 H 0.560 -1.592 1.855 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HG13 . . . . . . . . . c19595_2mgo 1 . 2 . 182 . 1 1 3 ILE HG21 H 2.848 -5.163 2.360 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HG21 . . . . . . . . . c19595_2mgo 1 . 2 . 183 . 1 1 3 ILE HG22 H 2.730 -3.972 3.659 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HG22 . . . . . . . . . c19595_2mgo 1 . 2 . 184 . 1 1 3 ILE HG23 H 3.751 -3.652 2.258 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HG23 . . . . . . . . . c19595_2mgo 1 . 2 . 185 . 1 1 3 ILE N N 2.690 -2.662 -0.227 . . . 1.0 . . . . . . . . . . . . A . 3 ILE N . . . . . . . . . c19595_2mgo 1 . 2 . 186 . 1 1 3 ILE O O 0.311 -2.278 -1.003 . . . 1.0 . . . . . . . . . . . . A . 3 ILE O . . . . . . . . . c19595_2mgo 1 . 2 . 187 . 1 1 4 GLN C C -2.685 -2.788 0.158 . . . 1.0 . . . . . . . . . . . . A . 4 GLN C . . . . . . . . . c19595_2mgo 1 . 2 . 188 . 1 1 4 GLN CA C -1.875 -3.818 -0.627 . . . 1.0 . . . . . . . . . . . . A . 4 GLN CA . . . . . . . . . c19595_2mgo 1 . 2 . 189 . 1 1 4 GLN CB C -2.631 -5.137 -0.788 . . . 1.0 . . . . . . . . . . . . A . 4 GLN CB . . . . . . . . . c19595_2mgo 1 . 2 . 190 . 1 1 4 GLN CD C -3.489 -4.591 -3.083 . . . 1.0 . . . . . . . . . . . . A . 4 GLN CD . . . . . . . . . c19595_2mgo 1 . 2 . 191 . 1 1 4 GLN CG C -3.849 -5.057 -1.691 . . . 1.0 . . . . . . . . . . . . A . 4 GLN CG . . . . . . . . . c19595_2mgo 1 . 2 . 192 . 1 1 4 GLN H H -0.463 -4.786 0.627 . . . 1.0 . . . . . . . . . . . . A . 4 GLN H . . . . . . . . . c19595_2mgo 1 . 2 . 193 . 1 1 4 GLN HA H -1.680 -3.394 -1.597 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HA . . . . . . . . . c19595_2mgo 1 . 2 . 194 . 1 1 4 GLN HB2 H -1.959 -5.878 -1.197 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HB2 . . . . . . . . . c19595_2mgo 1 . 2 . 195 . 1 1 4 GLN HB3 H -2.957 -5.464 0.187 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HB3 . . . . . . . . . c19595_2mgo 1 . 2 . 196 . 1 1 4 GLN HE21 H -3.135 -6.445 -3.629 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HE21 . . . . . . . . . c19595_2mgo 1 . 2 . 197 . 1 1 4 GLN HE22 H -2.898 -5.234 -4.838 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HE22 . . . . . . . . . c19595_2mgo 1 . 2 . 198 . 1 1 4 GLN HG2 H -4.290 -6.037 -1.763 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HG2 . . . . . . . . . c19595_2mgo 1 . 2 . 199 . 1 1 4 GLN HG3 H -4.560 -4.363 -1.266 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HG3 . . . . . . . . . c19595_2mgo 1 . 2 . 200 . 1 1 4 GLN N N -0.578 -4.041 -0.002 . . . 1.0 . . . . . . . . . . . . A . 4 GLN N . . . . . . . . . c19595_2mgo 1 . 2 . 201 . 1 1 4 GLN NE2 N -3.142 -5.510 -3.928 . . . 1.0 . . . . . . . . . . . . A . 4 GLN NE2 . . . . . . . . . c19595_2mgo 1 . 2 . 202 . 1 1 4 GLN O O -3.712 -2.283 -0.295 . . . 1.0 . . . . . . . . . . . . A . 4 GLN O . . . . . . . . . c19595_2mgo 1 . 2 . 203 . 1 1 4 GLN OE1 O -3.507 -3.399 -3.384 . . . 1.0 . . . . . . . . . . . . A . 4 GLN OE1 . . . . . . . . . c19595_2mgo 1 . 2 . 204 . 1 1 5 ASN C C -2.464 -0.036 1.825 . . . 1.0 . . . . . . . . . . . . A . 5 ASN C . . . . . . . . . c19595_2mgo 1 . 2 . 205 . 1 1 5 ASN CA C -2.795 -1.466 2.203 . . . 1.0 . . . . . . . . . . . . A . 5 ASN CA . . . . . . . . . c19595_2mgo 1 . 2 . 206 . 1 1 5 ASN CB C -2.384 -1.720 3.661 . . . 1.0 . . . . . . . . . . . . A . 5 ASN CB . . . . . . . . . c19595_2mgo 1 . 2 . 207 . 1 1 5 ASN CG C -2.787 -3.083 4.187 . . . 1.0 . . . . . . . . . . . . A . 5 ASN CG . . . . . . . . . c19595_2mgo 1 . 2 . 208 . 1 1 5 ASN H H -1.283 -2.827 1.478 . . . 1.0 . . . . . . . . . . . . A . 5 ASN H . . . . . . . . . c19595_2mgo 1 . 2 . 209 . 1 1 5 ASN HA H -3.860 -1.597 2.106 . . . 1.0 . . . . . . . . . . . . A . 5 ASN HA . . . . . . . . . c19595_2mgo 1 . 2 . 210 . 1 1 5 ASN HB2 H -1.310 -1.635 3.738 . . . 1.0 . . . . . . . . . . . . A . 5 ASN HB2 . . . . . . . . . c19595_2mgo 1 . 2 . 211 . 1 1 5 ASN HB3 H -2.838 -0.963 4.285 . . . 1.0 . . . . . . . . . . . . A . 5 ASN HB3 . . . . . . . . . c19595_2mgo 1 . 2 . 212 . 1 1 5 ASN HD21 H -4.435 -2.343 4.992 . . . 1.0 . . . . . . . . . . . . A . 5 ASN HD21 . . . . . . . . . c19595_2mgo 1 . 2 . 213 . 1 1 5 ASN HD22 H -4.184 -4.035 5.211 . . . 1.0 . . . . . . . . . . . . A . 5 ASN HD22 . . . . . . . . . c19595_2mgo 1 . 2 . 214 . 1 1 5 ASN N N -2.150 -2.420 1.285 . . . 1.0 . . . . . . . . . . . . A . 5 ASN N . . . . . . . . . c19595_2mgo 1 . 2 . 215 . 1 1 5 ASN ND2 N -3.907 -3.162 4.858 . . . 1.0 . . . . . . . . . . . . A . 5 ASN ND2 . . . . . . . . . c19595_2mgo 1 . 2 . 216 . 1 1 5 ASN O O -2.735 0.900 2.576 . . . 1.0 . . . . . . . . . . . . A . 5 ASN O . . . . . . . . . c19595_2mgo 1 . 2 . 217 . 1 1 5 ASN OD1 O -2.053 -4.061 4.024 . . . 1.0 . . . . . . . . . . . . A . 5 ASN OD1 . . . . . . . . . c19595_2mgo 1 . 2 . 218 . 1 1 6 CYS C C -2.828 2.059 -0.416 . . . 1.0 . . . . . . . . . . . . A . 6 CYS C . . . . . . . . . c19595_2mgo 1 . 2 . 219 . 1 1 6 CYS CA C -1.562 1.434 0.167 . . . 1.0 . . . . . . . . . . . . A . 6 CYS CA . . . . . . . . . c19595_2mgo 1 . 2 . 220 . 1 1 6 CYS CB C -0.460 1.334 -0.888 . . . 1.0 . . . . . . . . . . . . A . 6 CYS CB . . . . . . . . . c19595_2mgo 1 . 2 . 221 . 1 1 6 CYS H H -1.718 -0.672 0.139 . . . 1.0 . . . . . . . . . . . . A . 6 CYS H . . . . . . . . . c19595_2mgo 1 . 2 . 222 . 1 1 6 CYS HA H -1.209 2.024 1.002 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HA . . . . . . . . . c19595_2mgo 1 . 2 . 223 . 1 1 6 CYS HB2 H -0.793 0.678 -1.678 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HB2 . . . . . . . . . c19595_2mgo 1 . 2 . 224 . 1 1 6 CYS HB3 H -0.268 2.316 -1.295 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HB3 . . . . . . . . . c19595_2mgo 1 . 2 . 225 . 1 1 6 CYS N N -1.888 0.128 0.675 . . . 1.0 . . . . . . . . . . . . A . 6 CYS N . . . . . . . . . c19595_2mgo 1 . 2 . 226 . 1 1 6 CYS O O -3.506 1.430 -1.229 . . . 1.0 . . . . . . . . . . . . A . 6 CYS O . . . . . . . . . c19595_2mgo 1 . 2 . 227 . 1 1 6 CYS SG S 1.118 0.676 -0.235 . . . 1.0 . . . . . . . . . . . . A . 6 CYS SG . . . . . . . . . c19595_2mgo 1 . 2 . 228 . 1 1 7 PRO C C -4.426 4.237 -1.923 . . . 1.0 . . . . . . . . . . . . A . 7 PRO C . . . . . . . . . c19595_2mgo 1 . 2 . 229 . 1 1 7 PRO CA C -4.421 3.928 -0.428 . . . 1.0 . . . . . . . . . . . . A . 7 PRO CA . . . . . . . . . c19595_2mgo 1 . 2 . 230 . 1 1 7 PRO CB C -4.472 5.221 0.390 . . . 1.0 . . . . . . . . . . . . A . 7 PRO CB . . . . . . . . . c19595_2mgo 1 . 2 . 231 . 1 1 7 PRO CD C -2.424 4.122 0.952 . . . 1.0 . . . . . . . . . . . . A . 7 PRO CD . . . . . . . . . c19595_2mgo 1 . 2 . 232 . 1 1 7 PRO CG C -3.070 5.468 0.819 . . . 1.0 . . . . . . . . . . . . A . 7 PRO CG . . . . . . . . . c19595_2mgo 1 . 2 . 233 . 1 1 7 PRO HA H -5.284 3.321 -0.198 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HA . . . . . . . . . c19595_2mgo 1 . 2 . 234 . 1 1 7 PRO HB2 H -4.847 6.025 -0.228 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HB2 . . . . . . . . . c19595_2mgo 1 . 2 . 235 . 1 1 7 PRO HB3 H -5.124 5.082 1.238 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HB3 . . . . . . . . . c19595_2mgo 1 . 2 . 236 . 1 1 7 PRO HD2 H -1.384 4.174 0.667 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HD2 . . . . . . . . . c19595_2mgo 1 . 2 . 237 . 1 1 7 PRO HD3 H -2.519 3.754 1.962 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HD3 . . . . . . . . . c19595_2mgo 1 . 2 . 238 . 1 1 7 PRO HG2 H -2.559 6.061 0.074 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HG2 . . . . . . . . . c19595_2mgo 1 . 2 . 239 . 1 1 7 PRO HG3 H -3.066 5.983 1.768 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HG3 . . . . . . . . . c19595_2mgo 1 . 2 . 240 . 1 1 7 PRO N N -3.189 3.278 0.012 . . . 1.0 . . . . . . . . . . . . A . 7 PRO N . . . . . . . . . c19595_2mgo 1 . 2 . 241 . 1 1 7 PRO O O -3.374 4.494 -2.530 . . . 1.0 . . . . . . . . . . . . A . 7 PRO O . . . . . . . . . c19595_2mgo 1 . 2 . 242 . 1 1 8 LEU C C -6.052 5.954 -4.167 . . . 1.0 . . . . . . . . . . . . A . 8 LEU C . . . . . . . . . c19595_2mgo 1 . 2 . 243 . 1 1 8 LEU CA C -5.780 4.476 -3.936 . . . 1.0 . . . . . . . . . . . . A . 8 LEU CA . . . . . . . . . c19595_2mgo 1 . 2 . 244 . 1 1 8 LEU CB C -6.905 3.634 -4.495 . . . 1.0 . . . . . . . . . . . . A . 8 LEU CB . . . . . . . . . c19595_2mgo 1 . 2 . 245 . 1 1 8 LEU CD1 C -7.936 1.397 -4.961 . . . 1.0 . . . . . . . . . . . . A . 8 LEU CD1 . . . . . . . . . c19595_2mgo 1 . 2 . 246 . 1 1 8 LEU CD2 C -5.503 1.727 -5.334 . . . 1.0 . . . . . . . . . . . . A . 8 LEU CD2 . . . . . . . . . c19595_2mgo 1 . 2 . 247 . 1 1 8 LEU CG C -6.693 2.114 -4.477 . . . 1.0 . . . . . . . . . . . . A . 8 LEU CG . . . . . . . . . c19595_2mgo 1 . 2 . 248 . 1 1 8 LEU H H -6.401 3.970 -1.983 . . . 1.0 . . . . . . . . . . . . A . 8 LEU H . . . . . . . . . c19595_2mgo 1 . 2 . 249 . 1 1 8 LEU HA H -4.857 4.226 -4.427 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HA . . . . . . . . . c19595_2mgo 1 . 2 . 250 . 1 1 8 LEU HB2 H -7.793 3.862 -3.923 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HB2 . . . . . . . . . c19595_2mgo 1 . 2 . 251 . 1 1 8 LEU HB3 H -7.051 3.969 -5.506 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HB3 . . . . . . . . . c19595_2mgo 1 . 2 . 252 . 1 1 8 LEU HD11 H -8.767 1.634 -4.311 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HD11 . . . . . . . . . c19595_2mgo 1 . 2 . 253 . 1 1 8 LEU HD12 H -7.762 0.331 -4.954 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HD12 . . . . . . . . . c19595_2mgo 1 . 2 . 254 . 1 1 8 LEU HD13 H -8.163 1.716 -5.966 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HD13 . . . . . . . . . c19595_2mgo 1 . 2 . 255 . 1 1 8 LEU HD21 H -4.603 2.180 -4.944 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HD21 . . . . . . . . . c19595_2mgo 1 . 2 . 256 . 1 1 8 LEU HD22 H -5.666 2.060 -6.348 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HD22 . . . . . . . . . c19595_2mgo 1 . 2 . 257 . 1 1 8 LEU HD23 H -5.394 0.653 -5.328 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HD23 . . . . . . . . . c19595_2mgo 1 . 2 . 258 . 1 1 8 LEU HG H -6.500 1.796 -3.463 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HG . . . . . . . . . c19595_2mgo 1 . 2 . 259 . 1 1 8 LEU N N -5.605 4.202 -2.510 . . . 1.0 . . . . . . . . . . . . A . 8 LEU N . . . . . . . . . c19595_2mgo 1 . 2 . 260 . 1 1 8 LEU O O -6.295 6.423 -5.294 . . . 1.0 . . . . . . . . . . . . A . 8 LEU O . . . . . . . . . c19595_2mgo 1 . 2 . 261 . 1 1 9 GLY C C -6.020 8.497 -1.657 . . . 1.0 . . . . . . . . . . . . A . 9 GLY C . . . . . . . . . c19595_2mgo 1 . 2 . 262 . 1 1 9 GLY CA C -6.185 8.047 -3.066 . . . 1.0 . . . . . . . . . . . . A . 9 GLY CA . . . . . . . . . c19595_2mgo 1 . 2 . 263 . 1 1 9 GLY H H -5.838 6.128 -2.297 . . . 1.0 . . . . . . . . . . . . A . 9 GLY H . . . . . . . . . c19595_2mgo 1 . 2 . 264 . 1 1 9 GLY HA2 H -5.447 8.522 -3.697 . . . 1.0 . . . . . . . . . . . . A . 9 GLY HA2 . . . . . . . . . c19595_2mgo 1 . 2 . 265 . 1 1 9 GLY HA3 H -7.177 8.299 -3.405 . . . 1.0 . . . . . . . . . . . . A . 9 GLY HA3 . . . . . . . . . c19595_2mgo 1 . 2 . 266 . 1 1 9 GLY N N -6.005 6.641 -3.111 . . . 1.0 . . . . . . . . . . . . A . 9 GLY N . . . . . . . . . c19595_2mgo 1 . 2 . 267 . 1 1 9 GLY O O -6.319 7.696 -0.754 . . . 1.0 . . . . . . . . . . . . A . 9 GLY O . . . . . . . . . c19595_2mgo 1 . 2 . 268 . 1 1 9 GLY OXT O -5.565 9.622 -1.411 . . . 1.0 . . . . . . . . . . . . A . 9 GLY OXT . . . . . . . . . c19595_2mgo 1 . 3 . 269 . 1 1 1 CYS C C 4.491 -0.004 -0.667 . . . 1.0 . . . . . . . . . . . . A . 1 CYS C . . . . . . . . . c19595_2mgo 1 . 3 . 270 . 1 1 1 CYS CA C 4.180 1.396 -0.140 . . . 1.0 . . . . . . . . . . . . A . 1 CYS CA . . . . . . . . . c19595_2mgo 1 . 3 . 271 . 1 1 1 CYS CB C 3.029 1.355 0.881 . . . 1.0 . . . . . . . . . . . . A . 1 CYS CB . . . . . . . . . c19595_2mgo 1 . 3 . 272 . 1 1 1 CYS H1 H 3.036 1.885 -1.778 . . . 1.0 . . . . . . . . . . . . A . 1 CYS H1 . . . . . . . . . c19595_2mgo 1 . 3 . 273 . 1 1 1 CYS H2 H 4.649 2.312 -1.909 . . . 1.0 . . . . . . . . . . . . A . 1 CYS H2 . . . . . . . . . c19595_2mgo 1 . 3 . 274 . 1 1 1 CYS H3 H 3.613 3.233 -0.935 . . . 1.0 . . . . . . . . . . . . A . 1 CYS H3 . . . . . . . . . c19595_2mgo 1 . 3 . 275 . 1 1 1 CYS HA H 5.067 1.794 0.325 . . . 1.0 . . . . . . . . . . . . A . 1 CYS HA . . . . . . . . . c19595_2mgo 1 . 3 . 276 . 1 1 1 CYS HB2 H 2.149 0.950 0.406 . . . 1.0 . . . . . . . . . . . . A . 1 CYS HB2 . . . . . . . . . c19595_2mgo 1 . 3 . 277 . 1 1 1 CYS HB3 H 3.305 0.710 1.703 . . . 1.0 . . . . . . . . . . . . A . 1 CYS HB3 . . . . . . . . . c19595_2mgo 1 . 3 . 278 . 1 1 1 CYS N N 3.846 2.272 -1.252 . . . 1.0 . . . . . . . . . . . . A . 1 CYS N . . . . . . . . . c19595_2mgo 1 . 3 . 279 . 1 1 1 CYS O O 4.300 -0.271 -1.862 . . . 1.0 . . . . . . . . . . . . A . 1 CYS O . . . . . . . . . c19595_2mgo 1 . 3 . 280 . 1 1 1 CYS SG S 2.573 2.984 1.575 . . . 1.0 . . . . . . . . . . . . A . 1 CYS SG . . . . . . . . . c19595_2mgo 1 . 3 . 281 . 1 1 2 TYR C C 4.070 -3.195 -0.171 . . . 1.0 . . . . . . . . . . . . A . 2 TYR C . . . . . . . . . c19595_2mgo 1 . 3 . 282 . 1 1 2 TYR CA C 5.296 -2.273 -0.203 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CA . . . . . . . . . c19595_2mgo 1 . 3 . 283 . 1 1 2 TYR CB C 6.451 -2.853 0.649 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CB . . . . . . . . . c19595_2mgo 1 . 3 . 284 . 1 1 2 TYR CD1 C 5.562 -4.137 2.651 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CD1 . . . . . . . . . c19595_2mgo 1 . 3 . 285 . 1 1 2 TYR CD2 C 6.445 -1.969 3.032 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CD2 . . . . . . . . . c19595_2mgo 1 . 3 . 286 . 1 1 2 TYR CE1 C 5.278 -4.268 3.992 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CE1 . . . . . . . . . c19595_2mgo 1 . 3 . 287 . 1 1 2 TYR CE2 C 6.163 -2.089 4.379 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CE2 . . . . . . . . . c19595_2mgo 1 . 3 . 288 . 1 1 2 TYR CG C 6.149 -2.989 2.143 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CG . . . . . . . . . c19595_2mgo 1 . 3 . 289 . 1 1 2 TYR CZ C 5.577 -3.242 4.851 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CZ . . . . . . . . . c19595_2mgo 1 . 3 . 290 . 1 1 2 TYR H H 5.154 -0.623 1.132 . . . 1.0 . . . . . . . . . . . . A . 2 TYR H . . . . . . . . . c19595_2mgo 1 . 3 . 291 . 1 1 2 TYR HA H 5.612 -2.212 -1.230 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HA . . . . . . . . . c19595_2mgo 1 . 3 . 292 . 1 1 2 TYR HB2 H 6.696 -3.838 0.279 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HB2 . . . . . . . . . c19595_2mgo 1 . 3 . 293 . 1 1 2 TYR HB3 H 7.317 -2.218 0.541 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HB3 . . . . . . . . . c19595_2mgo 1 . 3 . 294 . 1 1 2 TYR HD1 H 5.327 -4.948 1.976 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HD1 . . . . . . . . . c19595_2mgo 1 . 3 . 295 . 1 1 2 TYR HD2 H 6.907 -1.066 2.659 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HD2 . . . . . . . . . c19595_2mgo 1 . 3 . 296 . 1 1 2 TYR HE1 H 4.814 -5.176 4.349 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HE1 . . . . . . . . . c19595_2mgo 1 . 3 . 297 . 1 1 2 TYR HE2 H 6.404 -1.279 5.051 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HE2 . . . . . . . . . c19595_2mgo 1 . 3 . 298 . 1 1 2 TYR HH H 4.812 -2.593 6.494 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HH . . . . . . . . . c19595_2mgo 1 . 3 . 299 . 1 1 2 TYR N N 4.965 -0.898 0.206 . . . 1.0 . . . . . . . . . . . . A . 2 TYR N . . . . . . . . . c19595_2mgo 1 . 3 . 300 . 1 1 2 TYR O O 4.137 -4.363 -0.553 . . . 1.0 . . . . . . . . . . . . A . 2 TYR O . . . . . . . . . c19595_2mgo 1 . 3 . 301 . 1 1 2 TYR OH O 5.295 -3.372 6.188 . . . 1.0 . . . . . . . . . . . . A . 2 TYR OH . . . . . . . . . c19595_2mgo 1 . 3 . 302 . 1 1 3 ILE C C 0.633 -2.487 -0.118 . . . 1.0 . . . . . . . . . . . . A . 3 ILE C . . . . . . . . . c19595_2mgo 1 . 3 . 303 . 1 1 3 ILE CA C 1.744 -3.356 0.406 . . . 1.0 . . . . . . . . . . . . A . 3 ILE CA . . . . . . . . . c19595_2mgo 1 . 3 . 304 . 1 1 3 ILE CB C 1.438 -3.753 1.869 . . . 1.0 . . . . . . . . . . . . A . 3 ILE CB . . . . . . . . . c19595_2mgo 1 . 3 . 305 . 1 1 3 ILE CD1 C 1.476 -2.902 4.307 . . . 1.0 . . . . . . . . . . . . A . 3 ILE CD1 . . . . . . . . . c19595_2mgo 1 . 3 . 306 . 1 1 3 ILE CG1 C 1.756 -2.592 2.846 . . . 1.0 . . . . . . . . . . . . A . 3 ILE CG1 . . . . . . . . . c19595_2mgo 1 . 3 . 307 . 1 1 3 ILE CG2 C 2.141 -5.049 2.255 . . . 1.0 . . . . . . . . . . . . A . 3 ILE CG2 . . . . . . . . . c19595_2mgo 1 . 3 . 308 . 1 1 3 ILE H H 2.983 -1.717 0.520 . . . 1.0 . . . . . . . . . . . . A . 3 ILE H . . . . . . . . . c19595_2mgo 1 . 3 . 309 . 1 1 3 ILE HA H 1.804 -4.253 -0.192 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HA . . . . . . . . . c19595_2mgo 1 . 3 . 310 . 1 1 3 ILE HB H 0.376 -3.932 1.890 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HB . . . . . . . . . c19595_2mgo 1 . 3 . 311 . 1 1 3 ILE HD11 H 1.729 -2.043 4.910 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HD11 . . . . . . . . . c19595_2mgo 1 . 3 . 312 . 1 1 3 ILE HD12 H 2.072 -3.748 4.613 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HD12 . . . . . . . . . c19595_2mgo 1 . 3 . 313 . 1 1 3 ILE HD13 H 0.429 -3.135 4.429 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HD13 . . . . . . . . . c19595_2mgo 1 . 3 . 314 . 1 1 3 ILE HG12 H 2.803 -2.342 2.762 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HG12 . . . . . . . . . c19595_2mgo 1 . 3 . 315 . 1 1 3 ILE HG13 H 1.165 -1.732 2.568 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HG13 . . . . . . . . . c19595_2mgo 1 . 3 . 316 . 1 1 3 ILE HG21 H 1.902 -5.296 3.279 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HG21 . . . . . . . . . c19595_2mgo 1 . 3 . 317 . 1 1 3 ILE HG22 H 3.208 -4.921 2.153 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HG22 . . . . . . . . . c19595_2mgo 1 . 3 . 318 . 1 1 3 ILE HG23 H 1.811 -5.846 1.604 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HG23 . . . . . . . . . c19595_2mgo 1 . 3 . 319 . 1 1 3 ILE N N 2.982 -2.659 0.282 . . . 1.0 . . . . . . . . . . . . A . 3 ILE N . . . . . . . . . c19595_2mgo 1 . 3 . 320 . 1 1 3 ILE O O 0.700 -1.255 -0.026 . . . 1.0 . . . . . . . . . . . . A . 3 ILE O . . . . . . . . . c19595_2mgo 1 . 3 . 321 . 1 1 4 GLN C C -2.555 -2.080 -0.149 . . . 1.0 . . . . . . . . . . . . A . 4 GLN C . . . . . . . . . c19595_2mgo 1 . 3 . 322 . 1 1 4 GLN CA C -1.543 -2.430 -1.223 . . . 1.0 . . . . . . . . . . . . A . 4 GLN CA . . . . . . . . . c19595_2mgo 1 . 3 . 323 . 1 1 4 GLN CB C -2.197 -3.276 -2.307 . . . 1.0 . . . . . . . . . . . . A . 4 GLN CB . . . . . . . . . c19595_2mgo 1 . 3 . 324 . 1 1 4 GLN CD C -1.970 -4.369 -4.571 . . . 1.0 . . . . . . . . . . . . A . 4 GLN CD . . . . . . . . . c19595_2mgo 1 . 3 . 325 . 1 1 4 GLN CG C -1.299 -3.554 -3.494 . . . 1.0 . . . . . . . . . . . . A . 4 GLN CG . . . . . . . . . c19595_2mgo 1 . 3 . 326 . 1 1 4 GLN H H -0.335 -4.096 -0.661 . . . 1.0 . . . . . . . . . . . . A . 4 GLN H . . . . . . . . . c19595_2mgo 1 . 3 . 327 . 1 1 4 GLN HA H -1.186 -1.509 -1.658 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HA . . . . . . . . . c19595_2mgo 1 . 3 . 328 . 1 1 4 GLN HB2 H -2.472 -4.223 -1.865 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HB2 . . . . . . . . . c19595_2mgo 1 . 3 . 329 . 1 1 4 GLN HB3 H -3.087 -2.774 -2.655 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HB3 . . . . . . . . . c19595_2mgo 1 . 3 . 330 . 1 1 4 GLN HE21 H -0.236 -5.154 -5.072 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HE21 . . . . . . . . . c19595_2mgo 1 . 3 . 331 . 1 1 4 GLN HE22 H -1.602 -5.688 -5.984 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HE22 . . . . . . . . . c19595_2mgo 1 . 3 . 332 . 1 1 4 GLN HG2 H -1.004 -2.610 -3.925 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HG2 . . . . . . . . . c19595_2mgo 1 . 3 . 333 . 1 1 4 GLN HG3 H -0.426 -4.086 -3.148 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HG3 . . . . . . . . . c19595_2mgo 1 . 3 . 334 . 1 1 4 GLN N N -0.378 -3.116 -0.648 . . . 1.0 . . . . . . . . . . . . A . 4 GLN N . . . . . . . . . c19595_2mgo 1 . 3 . 335 . 1 1 4 GLN NE2 N -1.195 -5.143 -5.276 . . . 1.0 . . . . . . . . . . . . A . 4 GLN NE2 . . . . . . . . . c19595_2mgo 1 . 3 . 336 . 1 1 4 GLN O O -3.618 -1.540 -0.421 . . . 1.0 . . . . . . . . . . . . A . 4 GLN O . . . . . . . . . c19595_2mgo 1 . 3 . 337 . 1 1 4 GLN OE1 O -3.184 -4.300 -4.770 . . . 1.0 . . . . . . . . . . . . A . 4 GLN OE1 . . . . . . . . . c19595_2mgo 1 . 3 . 338 . 1 1 5 ASN C C -2.075 -1.358 3.148 . . . 1.0 . . . . . . . . . . . . A . 5 ASN C . . . . . . . . . c19595_2mgo 1 . 3 . 339 . 1 1 5 ASN CA C -2.989 -2.085 2.213 . . . 1.0 . . . . . . . . . . . . A . 5 ASN CA . . . . . . . . . c19595_2mgo 1 . 3 . 340 . 1 1 5 ASN CB C -3.537 -3.365 2.878 . . . 1.0 . . . . . . . . . . . . A . 5 ASN CB . . . . . . . . . c19595_2mgo 1 . 3 . 341 . 1 1 5 ASN CG C -4.524 -3.088 4.012 . . . 1.0 . . . . . . . . . . . . A . 5 ASN CG . . . . . . . . . c19595_2mgo 1 . 3 . 342 . 1 1 5 ASN H H -1.316 -2.776 1.167 . . . 1.0 . . . . . . . . . . . . A . 5 ASN H . . . . . . . . . c19595_2mgo 1 . 3 . 343 . 1 1 5 ASN HA H -3.799 -1.437 1.913 . . . 1.0 . . . . . . . . . . . . A . 5 ASN HA . . . . . . . . . c19595_2mgo 1 . 3 . 344 . 1 1 5 ASN HB2 H -4.044 -3.958 2.132 . . . 1.0 . . . . . . . . . . . . A . 5 ASN HB2 . . . . . . . . . c19595_2mgo 1 . 3 . 345 . 1 1 5 ASN HB3 H -2.709 -3.932 3.278 . . . 1.0 . . . . . . . . . . . . A . 5 ASN HB3 . . . . . . . . . c19595_2mgo 1 . 3 . 346 . 1 1 5 ASN HD21 H -3.051 -2.981 5.320 . . . 1.0 . . . . . . . . . . . . A . 5 ASN HD21 . . . . . . . . . c19595_2mgo 1 . 3 . 347 . 1 1 5 ASN HD22 H -4.627 -2.721 5.977 . . . 1.0 . . . . . . . . . . . . A . 5 ASN HD22 . . . . . . . . . c19595_2mgo 1 . 3 . 348 . 1 1 5 ASN N N -2.197 -2.374 1.053 . . . 1.0 . . . . . . . . . . . . A . 5 ASN N . . . . . . . . . c19595_2mgo 1 . 3 . 349 . 1 1 5 ASN ND2 N -4.028 -2.923 5.224 . . . 1.0 . . . . . . . . . . . . A . 5 ASN ND2 . . . . . . . . . c19595_2mgo 1 . 3 . 350 . 1 1 5 ASN O O -1.670 -1.861 4.191 . . . 1.0 . . . . . . . . . . . . A . 5 ASN O . . . . . . . . . c19595_2mgo 1 . 3 . 351 . 1 1 5 ASN OD1 O -5.725 -3.024 3.796 . . . 1.0 . . . . . . . . . . . . A . 5 ASN OD1 . . . . . . . . . c19595_2mgo 1 . 3 . 352 . 1 1 6 CYS C C -1.529 1.437 4.393 . . . 1.0 . . . . . . . . . . . . A . 6 CYS C . . . . . . . . . c19595_2mgo 1 . 3 . 353 . 1 1 6 CYS CA C -0.727 0.598 3.399 . . . 1.0 . . . . . . . . . . . . A . 6 CYS CA . . . . . . . . . c19595_2mgo 1 . 3 . 354 . 1 1 6 CYS CB C 0.028 1.490 2.404 . . . 1.0 . . . . . . . . . . . . A . 6 CYS CB . . . . . . . . . c19595_2mgo 1 . 3 . 355 . 1 1 6 CYS H H -1.944 0.006 1.784 . . . 1.0 . . . . . . . . . . . . A . 6 CYS H . . . . . . . . . c19595_2mgo 1 . 3 . 356 . 1 1 6 CYS HA H -0.019 -0.024 3.924 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HA . . . . . . . . . c19595_2mgo 1 . 3 . 357 . 1 1 6 CYS HB2 H 0.500 0.860 1.667 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HB2 . . . . . . . . . c19595_2mgo 1 . 3 . 358 . 1 1 6 CYS HB3 H -0.684 2.130 1.907 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HB3 . . . . . . . . . c19595_2mgo 1 . 3 . 359 . 1 1 6 CYS N N -1.629 -0.250 2.677 . . . 1.0 . . . . . . . . . . . . A . 6 CYS N . . . . . . . . . c19595_2mgo 1 . 3 . 360 . 1 1 6 CYS O O -2.371 2.241 3.986 . . . 1.0 . . . . . . . . . . . . A . 6 CYS O . . . . . . . . . c19595_2mgo 1 . 3 . 361 . 1 1 6 CYS SG S 1.331 2.550 3.131 . . . 1.0 . . . . . . . . . . . . A . 6 CYS SG . . . . . . . . . c19595_2mgo 1 . 3 . 362 . 1 1 7 PRO C C -1.674 3.453 6.697 . . . 1.0 . . . . . . . . . . . . A . 7 PRO C . . . . . . . . . c19595_2mgo 1 . 3 . 363 . 1 1 7 PRO CA C -2.041 1.971 6.744 . . . 1.0 . . . . . . . . . . . . A . 7 PRO CA . . . . . . . . . c19595_2mgo 1 . 3 . 364 . 1 1 7 PRO CB C -1.549 1.337 8.058 . . . 1.0 . . . . . . . . . . . . A . 7 PRO CB . . . . . . . . . c19595_2mgo 1 . 3 . 365 . 1 1 7 PRO CD C -0.421 0.218 6.294 . . . 1.0 . . . . . . . . . . . . A . 7 PRO CD . . . . . . . . . c19595_2mgo 1 . 3 . 366 . 1 1 7 PRO CG C -0.987 0.019 7.664 . . . 1.0 . . . . . . . . . . . . A . 7 PRO CG . . . . . . . . . c19595_2mgo 1 . 3 . 367 . 1 1 7 PRO HA H -3.109 1.850 6.648 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HA . . . . . . . . . c19595_2mgo 1 . 3 . 368 . 1 1 7 PRO HB2 H -0.790 1.970 8.493 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HB2 . . . . . . . . . c19595_2mgo 1 . 3 . 369 . 1 1 7 PRO HB3 H -2.375 1.228 8.746 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HB3 . . . . . . . . . c19595_2mgo 1 . 3 . 370 . 1 1 7 PRO HD2 H 0.589 0.593 6.353 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HD2 . . . . . . . . . c19595_2mgo 1 . 3 . 371 . 1 1 7 PRO HD3 H -0.458 -0.711 5.744 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HD3 . . . . . . . . . c19595_2mgo 1 . 3 . 372 . 1 1 7 PRO HG2 H -0.212 -0.276 8.356 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HG2 . . . . . . . . . c19595_2mgo 1 . 3 . 373 . 1 1 7 PRO HG3 H -1.771 -0.722 7.641 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HG3 . . . . . . . . . c19595_2mgo 1 . 3 . 374 . 1 1 7 PRO N N -1.333 1.217 5.708 . . . 1.0 . . . . . . . . . . . . A . 7 PRO N . . . . . . . . . c19595_2mgo 1 . 3 . 375 . 1 1 7 PRO O O -0.489 3.808 6.686 . . . 1.0 . . . . . . . . . . . . A . 7 PRO O . . . . . . . . . c19595_2mgo 1 . 3 . 376 . 1 1 8 LEU C C -3.210 6.468 7.651 . . . 1.0 . . . . . . . . . . . . A . 8 LEU C . . . . . . . . . c19595_2mgo 1 . 3 . 377 . 1 1 8 LEU CA C -2.443 5.749 6.578 . . . 1.0 . . . . . . . . . . . . A . 8 LEU CA . . . . . . . . . c19595_2mgo 1 . 3 . 378 . 1 1 8 LEU CB C -2.819 6.328 5.228 . . . 1.0 . . . . . . . . . . . . A . 8 LEU CB . . . . . . . . . c19595_2mgo 1 . 3 . 379 . 1 1 8 LEU CD1 C -2.491 6.619 2.771 . . . 1.0 . . . . . . . . . . . . A . 8 LEU CD1 . . . . . . . . . c19595_2mgo 1 . 3 . 380 . 1 1 8 LEU CD2 C -0.505 6.271 4.255 . . . 1.0 . . . . . . . . . . . . A . 8 LEU CD2 . . . . . . . . . c19595_2mgo 1 . 3 . 381 . 1 1 8 LEU CG C -1.971 5.927 4.021 . . . 1.0 . . . . . . . . . . . . A . 8 LEU CG . . . . . . . . . c19595_2mgo 1 . 3 . 382 . 1 1 8 LEU H H -3.592 3.958 6.621 . . . 1.0 . . . . . . . . . . . . A . 8 LEU H . . . . . . . . . c19595_2mgo 1 . 3 . 383 . 1 1 8 LEU HA H -1.395 5.913 6.753 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HA . . . . . . . . . c19595_2mgo 1 . 3 . 384 . 1 1 8 LEU HB2 H -3.840 6.036 5.030 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HB2 . . . . . . . . . c19595_2mgo 1 . 3 . 385 . 1 1 8 LEU HB3 H -2.790 7.397 5.353 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HB3 . . . . . . . . . c19595_2mgo 1 . 3 . 386 . 1 1 8 LEU HD11 H -3.513 6.321 2.593 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HD11 . . . . . . . . . c19595_2mgo 1 . 3 . 387 . 1 1 8 LEU HD12 H -1.881 6.347 1.923 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HD12 . . . . . . . . . c19595_2mgo 1 . 3 . 388 . 1 1 8 LEU HD13 H -2.449 7.690 2.912 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HD13 . . . . . . . . . c19595_2mgo 1 . 3 . 389 . 1 1 8 LEU HD21 H -0.120 5.694 5.081 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HD21 . . . . . . . . . c19595_2mgo 1 . 3 . 390 . 1 1 8 LEU HD22 H -0.413 7.324 4.474 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HD22 . . . . . . . . . c19595_2mgo 1 . 3 . 391 . 1 1 8 LEU HD23 H 0.064 6.045 3.368 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HD23 . . . . . . . . . c19595_2mgo 1 . 3 . 392 . 1 1 8 LEU HG H -2.057 4.861 3.871 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HG . . . . . . . . . c19595_2mgo 1 . 3 . 393 . 1 1 8 LEU N N -2.673 4.306 6.632 . . . 1.0 . . . . . . . . . . . . A . 8 LEU N . . . . . . . . . c19595_2mgo 1 . 3 . 394 . 1 1 8 LEU O O -3.158 7.700 7.771 . . . 1.0 . . . . . . . . . . . . A . 8 LEU O . . . . . . . . . c19595_2mgo 1 . 3 . 395 . 1 1 9 GLY C C -4.624 5.383 10.669 . . . 1.0 . . . . . . . . . . . . A . 9 GLY C . . . . . . . . . c19595_2mgo 1 . 3 . 396 . 1 1 9 GLY CA C -4.719 6.225 9.441 . . . 1.0 . . . . . . . . . . . . A . 9 GLY CA . . . . . . . . . c19595_2mgo 1 . 3 . 397 . 1 1 9 GLY H H -3.748 4.757 8.265 . . . 1.0 . . . . . . . . . . . . A . 9 GLY H . . . . . . . . . c19595_2mgo 1 . 3 . 398 . 1 1 9 GLY HA2 H -4.420 7.235 9.674 . . . 1.0 . . . . . . . . . . . . A . 9 GLY HA2 . . . . . . . . . c19595_2mgo 1 . 3 . 399 . 1 1 9 GLY HA3 H -5.742 6.226 9.093 . . . 1.0 . . . . . . . . . . . . A . 9 GLY HA3 . . . . . . . . . c19595_2mgo 1 . 3 . 400 . 1 1 9 GLY N N -3.874 5.714 8.412 . . . 1.0 . . . . . . . . . . . . A . 9 GLY N . . . . . . . . . c19595_2mgo 1 . 3 . 401 . 1 1 9 GLY O O -4.860 5.890 11.773 . . . 1.0 . . . . . . . . . . . . A . 9 GLY O . . . . . . . . . c19595_2mgo 1 . 3 . 402 . 1 1 9 GLY OXT O -4.268 4.178 10.555 . . . 1.0 . . . . . . . . . . . . A . 9 GLY OXT . . . . . . . . . c19595_2mgo 1 . 4 . 403 . 1 1 1 CYS C C 4.258 0.457 0.165 . . . 1.0 . . . . . . . . . . . . A . 1 CYS C . . . . . . . . . c19595_2mgo 1 . 4 . 404 . 1 1 1 CYS CA C 3.894 1.914 0.018 . . . 1.0 . . . . . . . . . . . . A . 1 CYS CA . . . . . . . . . c19595_2mgo 1 . 4 . 405 . 1 1 1 CYS CB C 2.719 2.038 -0.952 . . . 1.0 . . . . . . . . . . . . A . 1 CYS CB . . . . . . . . . c19595_2mgo 1 . 4 . 406 . 1 1 1 CYS H1 H 5.332 2.335 -1.402 . . . 1.0 . . . . . . . . . . . . A . 1 CYS H1 . . . . . . . . . c19595_2mgo 1 . 4 . 407 . 1 1 1 CYS H2 H 5.837 2.505 0.175 . . . 1.0 . . . . . . . . . . . . A . 1 CYS H2 . . . . . . . . . c19595_2mgo 1 . 4 . 408 . 1 1 1 CYS H3 H 4.837 3.688 -0.506 . . . 1.0 . . . . . . . . . . . . A . 1 CYS H3 . . . . . . . . . c19595_2mgo 1 . 4 . 409 . 1 1 1 CYS HA H 3.598 2.300 0.982 . . . 1.0 . . . . . . . . . . . . A . 1 CYS HA . . . . . . . . . c19595_2mgo 1 . 4 . 410 . 1 1 1 CYS HB2 H 3.028 1.714 -1.933 . . . 1.0 . . . . . . . . . . . . A . 1 CYS HB2 . . . . . . . . . c19595_2mgo 1 . 4 . 411 . 1 1 1 CYS HB3 H 1.934 1.385 -0.603 . . . 1.0 . . . . . . . . . . . . A . 1 CYS HB3 . . . . . . . . . c19595_2mgo 1 . 4 . 412 . 1 1 1 CYS N N 5.037 2.668 -0.464 . . . 1.0 . . . . . . . . . . . . A . 1 CYS N . . . . . . . . . c19595_2mgo 1 . 4 . 413 . 1 1 1 CYS O O 5.361 0.042 -0.197 . . . 1.0 . . . . . . . . . . . . A . 1 CYS O . . . . . . . . . c19595_2mgo 1 . 4 . 414 . 1 1 1 CYS SG S 2.009 3.709 -1.140 . . . 1.0 . . . . . . . . . . . . A . 1 CYS SG . . . . . . . . . c19595_2mgo 1 . 4 . 415 . 1 1 2 TYR C C 2.734 -2.332 -0.314 . . . 1.0 . . . . . . . . . . . . A . 2 TYR C . . . . . . . . . c19595_2mgo 1 . 4 . 416 . 1 1 2 TYR CA C 3.499 -1.716 0.829 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CA . . . . . . . . . c19595_2mgo 1 . 4 . 417 . 1 1 2 TYR CB C 2.908 -2.185 2.163 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CB . . . . . . . . . c19595_2mgo 1 . 4 . 418 . 1 1 2 TYR CD1 C 4.617 -1.872 3.989 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CD1 . . . . . . . . . c19595_2mgo 1 . 4 . 419 . 1 1 2 TYR CD2 C 2.775 -0.371 3.909 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CD2 . . . . . . . . . c19595_2mgo 1 . 4 . 420 . 1 1 2 TYR CE1 C 5.103 -1.211 5.094 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CE1 . . . . . . . . . c19595_2mgo 1 . 4 . 421 . 1 1 2 TYR CE2 C 3.254 0.290 5.010 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CE2 . . . . . . . . . c19595_2mgo 1 . 4 . 422 . 1 1 2 TYR CG C 3.446 -1.464 3.378 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CG . . . . . . . . . c19595_2mgo 1 . 4 . 423 . 1 1 2 TYR CZ C 4.417 -0.132 5.600 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CZ . . . . . . . . . c19595_2mgo 1 . 4 . 424 . 1 1 2 TYR H H 2.461 -0.006 0.996 . . . 1.0 . . . . . . . . . . . . A . 2 TYR H . . . . . . . . . c19595_2mgo 1 . 4 . 425 . 1 1 2 TYR HA H 4.547 -1.968 0.776 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HA . . . . . . . . . c19595_2mgo 1 . 4 . 426 . 1 1 2 TYR HB2 H 1.840 -2.039 2.127 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HB2 . . . . . . . . . c19595_2mgo 1 . 4 . 427 . 1 1 2 TYR HB3 H 3.109 -3.240 2.283 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HB3 . . . . . . . . . c19595_2mgo 1 . 4 . 428 . 1 1 2 TYR HD1 H 5.155 -2.720 3.593 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HD1 . . . . . . . . . c19595_2mgo 1 . 4 . 429 . 1 1 2 TYR HD2 H 1.859 -0.035 3.445 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HD2 . . . . . . . . . c19595_2mgo 1 . 4 . 430 . 1 1 2 TYR HE1 H 6.020 -1.547 5.554 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HE1 . . . . . . . . . c19595_2mgo 1 . 4 . 431 . 1 1 2 TYR HE2 H 2.710 1.138 5.402 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HE2 . . . . . . . . . c19595_2mgo 1 . 4 . 432 . 1 1 2 TYR HH H 4.143 0.776 7.251 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HH . . . . . . . . . c19595_2mgo 1 . 4 . 433 . 1 1 2 TYR N N 3.332 -0.324 0.692 . . . 1.0 . . . . . . . . . . . . A . 2 TYR N . . . . . . . . . c19595_2mgo 1 . 4 . 434 . 1 1 2 TYR O O 2.328 -1.629 -1.241 . . . 1.0 . . . . . . . . . . . . A . 2 TYR O . . . . . . . . . c19595_2mgo 1 . 4 . 435 . 1 1 2 TYR OH O 4.898 0.528 6.702 . . . 1.0 . . . . . . . . . . . . A . 2 TYR OH . . . . . . . . . c19595_2mgo 1 . 4 . 436 . 1 1 3 ILE C C 0.345 -3.972 -1.365 . . . 1.0 . . . . . . . . . . . . A . 3 ILE C . . . . . . . . . c19595_2mgo 1 . 4 . 437 . 1 1 3 ILE CA C 1.809 -4.306 -1.278 . . . 1.0 . . . . . . . . . . . . A . 3 ILE CA . . . . . . . . . c19595_2mgo 1 . 4 . 438 . 1 1 3 ILE CB C 2.025 -5.836 -1.166 . . . 1.0 . . . . . . . . . . . . A . 3 ILE CB . . . . . . . . . c19595_2mgo 1 . 4 . 439 . 1 1 3 ILE CD1 C 3.836 -7.631 -0.974 . . . 1.0 . . . . . . . . . . . . A . 3 ILE CD1 . . . . . . . . . c19595_2mgo 1 . 4 . 440 . 1 1 3 ILE CG1 C 3.524 -6.158 -1.126 . . . 1.0 . . . . . . . . . . . . A . 3 ILE CG1 . . . . . . . . . c19595_2mgo 1 . 4 . 441 . 1 1 3 ILE CG2 C 1.360 -6.556 -2.328 . . . 1.0 . . . . . . . . . . . . A . 3 ILE CG2 . . . . . . . . . c19595_2mgo 1 . 4 . 442 . 1 1 3 ILE H H 2.697 -3.989 0.646 . . . 1.0 . . . . . . . . . . . . A . 3 ILE H . . . . . . . . . c19595_2mgo 1 . 4 . 443 . 1 1 3 ILE HA H 2.230 -3.965 -2.198 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HA . . . . . . . . . c19595_2mgo 1 . 4 . 444 . 1 1 3 ILE HB H 1.569 -6.187 -0.255 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HB . . . . . . . . . c19595_2mgo 1 . 4 . 445 . 1 1 3 ILE HD11 H 3.417 -8.175 -1.807 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HD11 . . . . . . . . . c19595_2mgo 1 . 4 . 446 . 1 1 3 ILE HD12 H 3.401 -7.994 -0.055 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HD12 . . . . . . . . . c19595_2mgo 1 . 4 . 447 . 1 1 3 ILE HD13 H 4.907 -7.775 -0.948 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HD13 . . . . . . . . . c19595_2mgo 1 . 4 . 448 . 1 1 3 ILE HG12 H 3.984 -5.820 -2.042 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HG12 . . . . . . . . . c19595_2mgo 1 . 4 . 449 . 1 1 3 ILE HG13 H 3.970 -5.636 -0.293 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HG13 . . . . . . . . . c19595_2mgo 1 . 4 . 450 . 1 1 3 ILE HG21 H 1.773 -6.194 -3.258 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HG21 . . . . . . . . . c19595_2mgo 1 . 4 . 451 . 1 1 3 ILE HG22 H 0.297 -6.363 -2.306 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HG22 . . . . . . . . . c19595_2mgo 1 . 4 . 452 . 1 1 3 ILE HG23 H 1.542 -7.616 -2.238 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HG23 . . . . . . . . . c19595_2mgo 1 . 4 . 453 . 1 1 3 ILE N N 2.458 -3.575 -0.207 . . . 1.0 . . . . . . . . . . . . A . 3 ILE N . . . . . . . . . c19595_2mgo 1 . 4 . 454 . 1 1 3 ILE O O -0.151 -3.503 -2.383 . . . 1.0 . . . . . . . . . . . . A . 3 ILE O . . . . . . . . . c19595_2mgo 1 . 4 . 455 . 1 1 4 GLN C C -2.036 -2.837 0.816 . . . 1.0 . . . . . . . . . . . . A . 4 GLN C . . . . . . . . . c19595_2mgo 1 . 4 . 456 . 1 1 4 GLN CA C -1.734 -3.928 -0.212 . . . 1.0 . . . . . . . . . . . . A . 4 GLN CA . . . . . . . . . c19595_2mgo 1 . 4 . 457 . 1 1 4 GLN CB C -2.427 -5.251 0.143 . . . 1.0 . . . . . . . . . . . . A . 4 GLN CB . . . . . . . . . c19595_2mgo 1 . 4 . 458 . 1 1 4 GLN CD C -4.365 -4.834 -1.425 . . . 1.0 . . . . . . . . . . . . A . 4 GLN CD . . . . . . . . . c19595_2mgo 1 . 4 . 459 . 1 1 4 GLN CG C -3.944 -5.238 -0.023 . . . 1.0 . . . . . . . . . . . . A . 4 GLN CG . . . . . . . . . c19595_2mgo 1 . 4 . 460 . 1 1 4 GLN H H 0.278 -4.448 0.434 . . . 1.0 . . . . . . . . . . . . A . 4 GLN H . . . . . . . . . c19595_2mgo 1 . 4 . 461 . 1 1 4 GLN HA H -2.077 -3.595 -1.180 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HA . . . . . . . . . c19595_2mgo 1 . 4 . 462 . 1 1 4 GLN HB2 H -2.023 -6.020 -0.498 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HB2 . . . . . . . . . c19595_2mgo 1 . 4 . 463 . 1 1 4 GLN HB3 H -2.196 -5.497 1.170 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HB3 . . . . . . . . . c19595_2mgo 1 . 4 . 464 . 1 1 4 GLN HE21 H -6.042 -4.062 -0.731 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HE21 . . . . . . . . . c19595_2mgo 1 . 4 . 465 . 1 1 4 GLN HE22 H -5.796 -3.932 -2.429 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HE22 . . . . . . . . . c19595_2mgo 1 . 4 . 466 . 1 1 4 GLN HG2 H -4.328 -6.224 0.189 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HG2 . . . . . . . . . c19595_2mgo 1 . 4 . 467 . 1 1 4 GLN HG3 H -4.360 -4.532 0.680 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HG3 . . . . . . . . . c19595_2mgo 1 . 4 . 468 . 1 1 4 GLN N N -0.297 -4.146 -0.298 . . . 1.0 . . . . . . . . . . . . A . 4 GLN N . . . . . . . . . c19595_2mgo 1 . 4 . 469 . 1 1 4 GLN NE2 N -5.508 -4.226 -1.537 . . . 1.0 . . . . . . . . . . . . A . 4 GLN NE2 . . . . . . . . . c19595_2mgo 1 . 4 . 470 . 1 1 4 GLN O O -3.127 -2.741 1.372 . . . 1.0 . . . . . . . . . . . . A . 4 GLN O . . . . . . . . . c19595_2mgo 1 . 4 . 471 . 1 1 4 GLN OE1 O -3.651 -5.075 -2.404 . . . 1.0 . . . . . . . . . . . . A . 4 GLN OE1 . . . . . . . . . c19595_2mgo 1 . 4 . 472 . 1 1 5 ASN C C -0.559 0.325 1.394 . . . 1.0 . . . . . . . . . . . . A . 5 ASN C . . . . . . . . . c19595_2mgo 1 . 4 . 473 . 1 1 5 ASN CA C -1.193 -0.901 1.956 . . . 1.0 . . . . . . . . . . . . A . 5 ASN CA . . . . . . . . . c19595_2mgo 1 . 4 . 474 . 1 1 5 ASN CB C -0.652 -1.238 3.370 . . . 1.0 . . . . . . . . . . . . A . 5 ASN CB . . . . . . . . . c19595_2mgo 1 . 4 . 475 . 1 1 5 ASN CG C -1.507 -2.239 4.131 . . . 1.0 . . . . . . . . . . . . A . 5 ASN CG . . . . . . . . . c19595_2mgo 1 . 4 . 476 . 1 1 5 ASN H H -0.289 -2.010 0.433 . . . 1.0 . . . . . . . . . . . . A . 5 ASN H . . . . . . . . . c19595_2mgo 1 . 4 . 477 . 1 1 5 ASN HA H -2.251 -0.695 2.027 . . . 1.0 . . . . . . . . . . . . A . 5 ASN HA . . . . . . . . . c19595_2mgo 1 . 4 . 478 . 1 1 5 ASN HB2 H 0.338 -1.657 3.289 . . . 1.0 . . . . . . . . . . . . A . 5 ASN HB2 . . . . . . . . . c19595_2mgo 1 . 4 . 479 . 1 1 5 ASN HB3 H -0.600 -0.328 3.950 . . . 1.0 . . . . . . . . . . . . A . 5 ASN HB3 . . . . . . . . . c19595_2mgo 1 . 4 . 480 . 1 1 5 ASN HD21 H -2.541 -0.782 4.958 . . . 1.0 . . . . . . . . . . . . A . 5 ASN HD21 . . . . . . . . . c19595_2mgo 1 . 4 . 481 . 1 1 5 ASN HD22 H -3.006 -2.378 5.410 . . . 1.0 . . . . . . . . . . . . A . 5 ASN HD22 . . . . . . . . . c19595_2mgo 1 . 4 . 482 . 1 1 5 ASN N N -1.078 -1.974 1.007 . . . 1.0 . . . . . . . . . . . . A . 5 ASN N . . . . . . . . . c19595_2mgo 1 . 4 . 483 . 1 1 5 ASN ND2 N -2.439 -1.757 4.904 . . . 1.0 . . . . . . . . . . . . A . 5 ASN ND2 . . . . . . . . . c19595_2mgo 1 . 4 . 484 . 1 1 5 ASN O O 0.593 0.684 1.706 . . . 1.0 . . . . . . . . . . . . A . 5 ASN O . . . . . . . . . c19595_2mgo 1 . 4 . 485 . 1 1 5 ASN OD1 O -1.320 -3.450 4.020 . . . 1.0 . . . . . . . . . . . . A . 5 ASN OD1 . . . . . . . . . c19595_2mgo 1 . 4 . 486 . 1 1 6 CYS C C -2.140 2.970 -0.079 . . . 1.0 . . . . . . . . . . . . A . 6 CYS C . . . . . . . . . c19595_2mgo 1 . 4 . 487 . 1 1 6 CYS CA C -0.890 2.115 -0.153 . . . 1.0 . . . . . . . . . . . . A . 6 CYS CA . . . . . . . . . c19595_2mgo 1 . 4 . 488 . 1 1 6 CYS CB C -0.444 1.934 -1.613 . . . 1.0 . . . . . . . . . . . . A . 6 CYS CB . . . . . . . . . c19595_2mgo 1 . 4 . 489 . 1 1 6 CYS H H -2.018 0.362 0.121 . . . 1.0 . . . . . . . . . . . . A . 6 CYS H . . . . . . . . . c19595_2mgo 1 . 4 . 490 . 1 1 6 CYS HA H -0.100 2.562 0.433 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HA . . . . . . . . . c19595_2mgo 1 . 4 . 491 . 1 1 6 CYS HB2 H 0.229 1.093 -1.684 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HB2 . . . . . . . . . c19595_2mgo 1 . 4 . 492 . 1 1 6 CYS HB3 H -1.320 1.726 -2.210 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HB3 . . . . . . . . . c19595_2mgo 1 . 4 . 493 . 1 1 6 CYS N N -1.233 0.857 0.446 . . . 1.0 . . . . . . . . . . . . A . 6 CYS N . . . . . . . . . c19595_2mgo 1 . 4 . 494 . 1 1 6 CYS O O -3.194 2.527 -0.513 . . . 1.0 . . . . . . . . . . . . A . 6 CYS O . . . . . . . . . c19595_2mgo 1 . 4 . 495 . 1 1 6 CYS SG S 0.395 3.402 -2.343 . . . 1.0 . . . . . . . . . . . . A . 6 CYS SG . . . . . . . . . c19595_2mgo 1 . 4 . 496 . 1 1 7 PRO C C -4.037 5.307 -0.543 . . . 1.0 . . . . . . . . . . . . A . 7 PRO C . . . . . . . . . c19595_2mgo 1 . 4 . 497 . 1 1 7 PRO CA C -3.227 5.031 0.732 . . . 1.0 . . . . . . . . . . . . A . 7 PRO CA . . . . . . . . . c19595_2mgo 1 . 4 . 498 . 1 1 7 PRO CB C -2.625 6.338 1.280 . . . 1.0 . . . . . . . . . . . . A . 7 PRO CB . . . . . . . . . c19595_2mgo 1 . 4 . 499 . 1 1 7 PRO CD C -0.823 4.808 0.999 . . . 1.0 . . . . . . . . . . . . A . 7 PRO CD . . . . . . . . . c19595_2mgo 1 . 4 . 500 . 1 1 7 PRO CG C -1.170 6.259 0.972 . . . 1.0 . . . . . . . . . . . . A . 7 PRO CG . . . . . . . . . c19595_2mgo 1 . 4 . 501 . 1 1 7 PRO HA H -3.878 4.601 1.477 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HA . . . . . . . . . c19595_2mgo 1 . 4 . 502 . 1 1 7 PRO HB2 H -3.087 7.180 0.789 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HB2 . . . . . . . . . c19595_2mgo 1 . 4 . 503 . 1 1 7 PRO HB3 H -2.798 6.396 2.343 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HB3 . . . . . . . . . c19595_2mgo 1 . 4 . 504 . 1 1 7 PRO HD2 H 0.007 4.614 0.337 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HD2 . . . . . . . . . c19595_2mgo 1 . 4 . 505 . 1 1 7 PRO HD3 H -0.591 4.487 2.004 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HD3 . . . . . . . . . c19595_2mgo 1 . 4 . 506 . 1 1 7 PRO HG2 H -0.982 6.666 -0.010 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HG2 . . . . . . . . . c19595_2mgo 1 . 4 . 507 . 1 1 7 PRO HG3 H -0.601 6.796 1.716 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HG3 . . . . . . . . . c19595_2mgo 1 . 4 . 508 . 1 1 7 PRO N N -2.056 4.171 0.511 . . . 1.0 . . . . . . . . . . . . A . 7 PRO N . . . . . . . . . c19595_2mgo 1 . 4 . 509 . 1 1 7 PRO O O -3.480 5.652 -1.586 . . . 1.0 . . . . . . . . . . . . A . 7 PRO O . . . . . . . . . c19595_2mgo 1 . 4 . 510 . 1 1 8 LEU C C -6.697 6.869 -1.510 . . . 1.0 . . . . . . . . . . . . A . 8 LEU C . . . . . . . . . c19595_2mgo 1 . 4 . 511 . 1 1 8 LEU CA C -6.258 5.431 -1.580 . . . 1.0 . . . . . . . . . . . . A . 8 LEU CA . . . . . . . . . c19595_2mgo 1 . 4 . 512 . 1 1 8 LEU CB C -7.485 4.513 -1.607 . . . 1.0 . . . . . . . . . . . . A . 8 LEU CB . . . . . . . . . c19595_2mgo 1 . 4 . 513 . 1 1 8 LEU CD1 C -6.583 2.278 -0.822 . . . 1.0 . . . . . . . . . . . . A . 8 LEU CD1 . . . . . . . . . c19595_2mgo 1 . 4 . 514 . 1 1 8 LEU CD2 C -8.570 2.368 -2.319 . . . 1.0 . . . . . . . . . . . . A . 8 LEU CD2 . . . . . . . . . c19595_2mgo 1 . 4 . 515 . 1 1 8 LEU CG C -7.265 3.030 -1.948 . . . 1.0 . . . . . . . . . . . . A . 8 LEU CG . . . . . . . . . c19595_2mgo 1 . 4 . 516 . 1 1 8 LEU H H -5.723 4.795 0.387 . . . 1.0 . . . . . . . . . . . . A . 8 LEU H . . . . . . . . . c19595_2mgo 1 . 4 . 517 . 1 1 8 LEU HA H -5.680 5.304 -2.479 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HA . . . . . . . . . c19595_2mgo 1 . 4 . 518 . 1 1 8 LEU HB2 H -7.947 4.566 -0.631 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HB2 . . . . . . . . . c19595_2mgo 1 . 4 . 519 . 1 1 8 LEU HB3 H -8.166 4.944 -2.324 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HB3 . . . . . . . . . c19595_2mgo 1 . 4 . 520 . 1 1 8 LEU HD11 H -5.621 2.727 -0.620 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HD11 . . . . . . . . . c19595_2mgo 1 . 4 . 521 . 1 1 8 LEU HD12 H -6.446 1.248 -1.113 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HD12 . . . . . . . . . c19595_2mgo 1 . 4 . 522 . 1 1 8 LEU HD13 H -7.196 2.323 0.066 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HD13 . . . . . . . . . c19595_2mgo 1 . 4 . 523 . 1 1 8 LEU HD21 H -9.000 2.870 -3.173 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HD21 . . . . . . . . . c19595_2mgo 1 . 4 . 524 . 1 1 8 LEU HD22 H -9.251 2.431 -1.484 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HD22 . . . . . . . . . c19595_2mgo 1 . 4 . 525 . 1 1 8 LEU HD23 H -8.391 1.331 -2.560 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HD23 . . . . . . . . . c19595_2mgo 1 . 4 . 526 . 1 1 8 LEU HG H -6.613 2.978 -2.807 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HG . . . . . . . . . c19595_2mgo 1 . 4 . 527 . 1 1 8 LEU N N -5.350 5.139 -0.454 . . . 1.0 . . . . . . . . . . . . A . 8 LEU N . . . . . . . . . c19595_2mgo 1 . 4 . 528 . 1 1 8 LEU O O -7.473 7.378 -2.329 . . . 1.0 . . . . . . . . . . . . A . 8 LEU O . . . . . . . . . c19595_2mgo 1 . 4 . 529 . 1 1 9 GLY C C -5.597 9.096 0.960 . . . 1.0 . . . . . . . . . . . . A . 9 GLY C . . . . . . . . . c19595_2mgo 1 . 4 . 530 . 1 1 9 GLY CA C -6.410 8.819 -0.232 . . . 1.0 . . . . . . . . . . . . A . 9 GLY CA . . . . . . . . . c19595_2mgo 1 . 4 . 531 . 1 1 9 GLY H H -5.620 6.946 0.050 . . . 1.0 . . . . . . . . . . . . A . 9 GLY H . . . . . . . . . c19595_2mgo 1 . 4 . 532 . 1 1 9 GLY HA2 H -6.102 9.438 -1.063 . . . 1.0 . . . . . . . . . . . . A . 9 GLY HA2 . . . . . . . . . c19595_2mgo 1 . 4 . 533 . 1 1 9 GLY HA3 H -7.448 8.991 0.006 . . . 1.0 . . . . . . . . . . . . A . 9 GLY HA3 . . . . . . . . . c19595_2mgo 1 . 4 . 534 . 1 1 9 GLY N N -6.200 7.475 -0.534 . . . 1.0 . . . . . . . . . . . . A . 9 GLY N . . . . . . . . . c19595_2mgo 1 . 4 . 535 . 1 1 9 GLY O O -5.149 10.233 1.163 . . . 1.0 . . . . . . . . . . . . A . 9 GLY O . . . . . . . . . c19595_2mgo 1 . 4 . 536 . 1 1 9 GLY OXT O -5.347 8.137 1.711 . . . 1.0 . . . . . . . . . . . . A . 9 GLY OXT . . . . . . . . . c19595_2mgo 1 . 5 . 537 . 1 1 1 CYS C C 4.710 0.388 -0.722 . . . 1.0 . . . . . . . . . . . . A . 1 CYS C . . . . . . . . . c19595_2mgo 1 . 5 . 538 . 1 1 1 CYS CA C 4.866 1.538 0.253 . . . 1.0 . . . . . . . . . . . . A . 1 CYS CA . . . . . . . . . c19595_2mgo 1 . 5 . 539 . 1 1 1 CYS CB C 3.515 1.943 0.847 . . . 1.0 . . . . . . . . . . . . A . 1 CYS CB . . . . . . . . . c19595_2mgo 1 . 5 . 540 . 1 1 1 CYS H1 H 4.867 2.928 -1.236 . . . 1.0 . . . . . . . . . . . . A . 1 CYS H1 . . . . . . . . . c19595_2mgo 1 . 5 . 541 . 1 1 1 CYS H2 H 6.410 2.408 -0.780 . . . 1.0 . . . . . . . . . . . . A . 1 CYS H2 . . . . . . . . . c19595_2mgo 1 . 5 . 542 . 1 1 1 CYS H3 H 5.561 3.495 0.200 . . . 1.0 . . . . . . . . . . . . A . 1 CYS H3 . . . . . . . . . c19595_2mgo 1 . 5 . 543 . 1 1 1 CYS HA H 5.528 1.230 1.047 . . . 1.0 . . . . . . . . . . . . A . 1 CYS HA . . . . . . . . . c19595_2mgo 1 . 5 . 544 . 1 1 1 CYS HB2 H 3.030 1.065 1.244 . . . 1.0 . . . . . . . . . . . . A . 1 CYS HB2 . . . . . . . . . c19595_2mgo 1 . 5 . 545 . 1 1 1 CYS HB3 H 3.677 2.648 1.648 . . . 1.0 . . . . . . . . . . . . A . 1 CYS HB3 . . . . . . . . . c19595_2mgo 1 . 5 . 546 . 1 1 1 CYS N N 5.470 2.673 -0.428 . . . 1.0 . . . . . . . . . . . . A . 1 CYS N . . . . . . . . . c19595_2mgo 1 . 5 . 547 . 1 1 1 CYS O O 4.463 0.608 -1.902 . . . 1.0 . . . . . . . . . . . . A . 1 CYS O . . . . . . . . . c19595_2mgo 1 . 5 . 548 . 1 1 1 CYS SG S 2.365 2.710 -0.341 . . . 1.0 . . . . . . . . . . . . A . 1 CYS SG . . . . . . . . . c19595_2mgo 1 . 5 . 549 . 1 1 2 TYR C C 3.666 -2.925 -0.636 . . . 1.0 . . . . . . . . . . . . A . 2 TYR C . . . . . . . . . c19595_2mgo 1 . 5 . 550 . 1 1 2 TYR CA C 4.785 -2.001 -1.097 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CA . . . . . . . . . c19595_2mgo 1 . 5 . 551 . 1 1 2 TYR CB C 6.127 -2.745 -1.153 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CB . . . . . . . . . c19595_2mgo 1 . 5 . 552 . 1 1 2 TYR CD1 C 6.300 -4.083 1.000 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CD1 . . . . . . . . . c19595_2mgo 1 . 5 . 553 . 1 1 2 TYR CD2 C 7.839 -2.309 0.653 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CD2 . . . . . . . . . c19595_2mgo 1 . 5 . 554 . 1 1 2 TYR CE1 C 6.888 -4.358 2.210 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CE1 . . . . . . . . . c19595_2mgo 1 . 5 . 555 . 1 1 2 TYR CE2 C 8.432 -2.577 1.860 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CE2 . . . . . . . . . c19595_2mgo 1 . 5 . 556 . 1 1 2 TYR CG C 6.762 -3.052 0.197 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CG . . . . . . . . . c19595_2mgo 1 . 5 . 557 . 1 1 2 TYR CZ C 7.957 -3.599 2.636 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CZ . . . . . . . . . c19595_2mgo 1 . 5 . 558 . 1 1 2 TYR H H 5.118 -0.975 0.693 . . . 1.0 . . . . . . . . . . . . A . 2 TYR H . . . . . . . . . c19595_2mgo 1 . 5 . 559 . 1 1 2 TYR HA H 4.549 -1.654 -2.091 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HA . . . . . . . . . c19595_2mgo 1 . 5 . 560 . 1 1 2 TYR HB2 H 5.971 -3.687 -1.653 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HB2 . . . . . . . . . c19595_2mgo 1 . 5 . 561 . 1 1 2 TYR HB3 H 6.824 -2.154 -1.725 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HB3 . . . . . . . . . c19595_2mgo 1 . 5 . 562 . 1 1 2 TYR HD1 H 5.462 -4.676 0.668 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HD1 . . . . . . . . . c19595_2mgo 1 . 5 . 563 . 1 1 2 TYR HD2 H 8.217 -1.502 0.046 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HD2 . . . . . . . . . c19595_2mgo 1 . 5 . 564 . 1 1 2 TYR HE1 H 6.500 -5.168 2.809 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HE1 . . . . . . . . . c19595_2mgo 1 . 5 . 565 . 1 1 2 TYR HE2 H 9.269 -1.976 2.185 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HE2 . . . . . . . . . c19595_2mgo 1 . 5 . 566 . 1 1 2 TYR HH H 8.690 -3.034 4.309 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HH . . . . . . . . . c19595_2mgo 1 . 5 . 567 . 1 1 2 TYR N N 4.889 -0.830 -0.251 . . . 1.0 . . . . . . . . . . . . A . 2 TYR N . . . . . . . . . c19595_2mgo 1 . 5 . 568 . 1 1 2 TYR O O 3.558 -4.072 -1.084 . . . 1.0 . . . . . . . . . . . . A . 2 TYR O . . . . . . . . . c19595_2mgo 1 . 5 . 569 . 1 1 2 TYR OH O 8.551 -3.866 3.840 . . . 1.0 . . . . . . . . . . . . A . 2 TYR OH . . . . . . . . . c19595_2mgo 1 . 5 . 570 . 1 1 3 ILE C C 0.479 -2.732 0.069 . . . 1.0 . . . . . . . . . . . . A . 3 ILE C . . . . . . . . . c19595_2mgo 1 . 5 . 571 . 1 1 3 ILE CA C 1.746 -3.168 0.756 . . . 1.0 . . . . . . . . . . . . A . 3 ILE CA . . . . . . . . . c19595_2mgo 1 . 5 . 572 . 1 1 3 ILE CB C 1.604 -3.015 2.293 . . . 1.0 . . . . . . . . . . . . A . 3 ILE CB . . . . . . . . . c19595_2mgo 1 . 5 . 573 . 1 1 3 ILE CD1 C 1.300 -1.296 4.185 . . . 1.0 . . . . . . . . . . . . A . 3 ILE CD1 . . . . . . . . . c19595_2mgo 1 . 5 . 574 . 1 1 3 ILE CG1 C 1.531 -1.526 2.707 . . . 1.0 . . . . . . . . . . . . A . 3 ILE CG1 . . . . . . . . . c19595_2mgo 1 . 5 . 575 . 1 1 3 ILE CG2 C 2.737 -3.741 3.006 . . . 1.0 . . . . . . . . . . . . A . 3 ILE CG2 . . . . . . . . . c19595_2mgo 1 . 5 . 576 . 1 1 3 ILE H H 2.908 -1.499 0.527 . . . 1.0 . . . . . . . . . . . . A . 3 ILE H . . . . . . . . . c19595_2mgo 1 . 5 . 577 . 1 1 3 ILE HA H 1.921 -4.209 0.527 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HA . . . . . . . . . c19595_2mgo 1 . 5 . 578 . 1 1 3 ILE HB H 0.683 -3.498 2.577 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HB . . . . . . . . . c19595_2mgo 1 . 5 . 579 . 1 1 3 ILE HD11 H 0.357 -1.739 4.472 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HD11 . . . . . . . . . c19595_2mgo 1 . 5 . 580 . 1 1 3 ILE HD12 H 1.274 -0.236 4.385 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HD12 . . . . . . . . . c19595_2mgo 1 . 5 . 581 . 1 1 3 ILE HD13 H 2.098 -1.753 4.751 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HD13 . . . . . . . . . c19595_2mgo 1 . 5 . 582 . 1 1 3 ILE HG12 H 2.458 -1.039 2.442 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HG12 . . . . . . . . . c19595_2mgo 1 . 5 . 583 . 1 1 3 ILE HG13 H 0.724 -1.055 2.166 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HG13 . . . . . . . . . c19595_2mgo 1 . 5 . 584 . 1 1 3 ILE HG21 H 2.627 -3.611 4.073 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HG21 . . . . . . . . . c19595_2mgo 1 . 5 . 585 . 1 1 3 ILE HG22 H 3.685 -3.333 2.689 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HG22 . . . . . . . . . c19595_2mgo 1 . 5 . 586 . 1 1 3 ILE HG23 H 2.700 -4.793 2.767 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HG23 . . . . . . . . . c19595_2mgo 1 . 5 . 587 . 1 1 3 ILE N N 2.836 -2.425 0.238 . . . 1.0 . . . . . . . . . . . . A . 3 ILE N . . . . . . . . . c19595_2mgo 1 . 5 . 588 . 1 1 3 ILE O O 0.267 -1.551 -0.176 . . . 1.0 . . . . . . . . . . . . A . 3 ILE O . . . . . . . . . c19595_2mgo 1 . 5 . 589 . 1 1 4 GLN C C -2.725 -2.927 -0.028 . . . 1.0 . . . . . . . . . . . . A . 4 GLN C . . . . . . . . . c19595_2mgo 1 . 5 . 590 . 1 1 4 GLN CA C -1.610 -3.447 -0.931 . . . 1.0 . . . . . . . . . . . . A . 4 GLN CA . . . . . . . . . c19595_2mgo 1 . 5 . 591 . 1 1 4 GLN CB C -2.046 -4.696 -1.683 . . . 1.0 . . . . . . . . . . . . A . 4 GLN CB . . . . . . . . . c19595_2mgo 1 . 5 . 592 . 1 1 4 GLN CD C -0.989 -3.934 -3.829 . . . 1.0 . . . . . . . . . . . . A . 4 GLN CD . . . . . . . . . c19595_2mgo 1 . 5 . 593 . 1 1 4 GLN CG C -1.141 -5.069 -2.842 . . . 1.0 . . . . . . . . . . . . A . 4 GLN CG . . . . . . . . . c19595_2mgo 1 . 5 . 594 . 1 1 4 GLN H H -0.082 -4.568 0.080 . . . 1.0 . . . . . . . . . . . . A . 4 GLN H . . . . . . . . . c19595_2mgo 1 . 5 . 595 . 1 1 4 GLN HA H -1.404 -2.672 -1.652 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HA . . . . . . . . . c19595_2mgo 1 . 5 . 596 . 1 1 4 GLN HB2 H -2.063 -5.525 -0.993 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HB2 . . . . . . . . . c19595_2mgo 1 . 5 . 597 . 1 1 4 GLN HB3 H -3.040 -4.531 -2.071 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HB3 . . . . . . . . . c19595_2mgo 1 . 5 . 598 . 1 1 4 GLN HE21 H 0.643 -3.290 -2.912 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HE21 . . . . . . . . . c19595_2mgo 1 . 5 . 599 . 1 1 4 GLN HE22 H 0.146 -2.387 -4.282 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HE22 . . . . . . . . . c19595_2mgo 1 . 5 . 600 . 1 1 4 GLN HG2 H -0.164 -5.314 -2.453 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HG2 . . . . . . . . . c19595_2mgo 1 . 5 . 601 . 1 1 4 GLN HG3 H -1.553 -5.925 -3.356 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HG3 . . . . . . . . . c19595_2mgo 1 . 5 . 602 . 1 1 4 GLN N N -0.351 -3.673 -0.215 . . . 1.0 . . . . . . . . . . . . A . 4 GLN N . . . . . . . . . c19595_2mgo 1 . 5 . 603 . 1 1 4 GLN NE2 N 0.027 -3.133 -3.657 . . . 1.0 . . . . . . . . . . . . A . 4 GLN NE2 . . . . . . . . . c19595_2mgo 1 . 5 . 604 . 1 1 4 GLN O O -3.889 -2.858 -0.414 . . . 1.0 . . . . . . . . . . . . A . 4 GLN O . . . . . . . . . c19595_2mgo 1 . 5 . 605 . 1 1 4 GLN OE1 O -1.778 -3.787 -4.755 . . . 1.0 . . . . . . . . . . . . A . 4 GLN OE1 . . . . . . . . . c19595_2mgo 1 . 5 . 606 . 1 1 5 ASN C C -2.674 -0.596 2.466 . . . 1.0 . . . . . . . . . . . . A . 5 ASN C . . . . . . . . . c19595_2mgo 1 . 5 . 607 . 1 1 5 ASN CA C -3.259 -1.935 2.101 . . . 1.0 . . . . . . . . . . . . A . 5 ASN CA . . . . . . . . . c19595_2mgo 1 . 5 . 608 . 1 1 5 ASN CB C -3.488 -2.794 3.358 . . . 1.0 . . . . . . . . . . . . A . 5 ASN CB . . . . . . . . . c19595_2mgo 1 . 5 . 609 . 1 1 5 ASN CG C -4.370 -4.007 3.099 . . . 1.0 . . . . . . . . . . . . A . 5 ASN CG . . . . . . . . . c19595_2mgo 1 . 5 . 610 . 1 1 5 ASN H H -1.441 -2.796 1.424 . . . 1.0 . . . . . . . . . . . . A . 5 ASN H . . . . . . . . . c19595_2mgo 1 . 5 . 611 . 1 1 5 ASN HA H -4.198 -1.776 1.593 . . . 1.0 . . . . . . . . . . . . A . 5 ASN HA . . . . . . . . . c19595_2mgo 1 . 5 . 612 . 1 1 5 ASN HB2 H -2.535 -3.139 3.727 . . . 1.0 . . . . . . . . . . . . A . 5 ASN HB2 . . . . . . . . . c19595_2mgo 1 . 5 . 613 . 1 1 5 ASN HB3 H -3.958 -2.184 4.116 . . . 1.0 . . . . . . . . . . . . A . 5 ASN HB3 . . . . . . . . . c19595_2mgo 1 . 5 . 614 . 1 1 5 ASN HD21 H -5.969 -2.993 3.638 . . . 1.0 . . . . . . . . . . . . A . 5 ASN HD21 . . . . . . . . . c19595_2mgo 1 . 5 . 615 . 1 1 5 ASN HD22 H -6.247 -4.623 3.148 . . . 1.0 . . . . . . . . . . . . A . 5 ASN HD22 . . . . . . . . . c19595_2mgo 1 . 5 . 616 . 1 1 5 ASN N N -2.362 -2.584 1.164 . . . 1.0 . . . . . . . . . . . . A . 5 ASN N . . . . . . . . . c19595_2mgo 1 . 5 . 617 . 1 1 5 ASN ND2 N -5.650 -3.864 3.316 . . . 1.0 . . . . . . . . . . . . A . 5 ASN ND2 . . . . . . . . . c19595_2mgo 1 . 5 . 618 . 1 1 5 ASN O O -2.928 -0.053 3.536 . . . 1.0 . . . . . . . . . . . . A . 5 ASN O . . . . . . . . . c19595_2mgo 1 . 5 . 619 . 1 1 5 ASN OD1 O -3.891 -5.081 2.729 . . . 1.0 . . . . . . . . . . . . A . 5 ASN OD1 . . . . . . . . . c19595_2mgo 1 . 5 . 620 . 1 1 6 CYS C C -2.289 2.332 1.748 . . . 1.0 . . . . . . . . . . . . A . 6 CYS C . . . . . . . . . c19595_2mgo 1 . 5 . 621 . 1 1 6 CYS CA C -1.248 1.220 1.733 . . . 1.0 . . . . . . . . . . . . A . 6 CYS CA . . . . . . . . . c19595_2mgo 1 . 5 . 622 . 1 1 6 CYS CB C -0.241 1.469 0.602 . . . 1.0 . . . . . . . . . . . . A . 6 CYS CB . . . . . . . . . c19595_2mgo 1 . 5 . 623 . 1 1 6 CYS H H -1.766 -0.537 0.704 . . . 1.0 . . . . . . . . . . . . A . 6 CYS H . . . . . . . . . c19595_2mgo 1 . 5 . 624 . 1 1 6 CYS HA H -0.716 1.194 2.673 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HA . . . . . . . . . c19595_2mgo 1 . 5 . 625 . 1 1 6 CYS HB2 H 0.477 0.663 0.581 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HB2 . . . . . . . . . c19595_2mgo 1 . 5 . 626 . 1 1 6 CYS HB3 H -0.772 1.492 -0.338 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HB3 . . . . . . . . . c19595_2mgo 1 . 5 . 627 . 1 1 6 CYS N N -1.895 -0.060 1.551 . . . 1.0 . . . . . . . . . . . . A . 6 CYS N . . . . . . . . . c19595_2mgo 1 . 5 . 628 . 1 1 6 CYS O O -3.140 2.391 0.855 . . . 1.0 . . . . . . . . . . . . A . 6 CYS O . . . . . . . . . c19595_2mgo 1 . 5 . 629 . 1 1 6 CYS SG S 0.692 3.034 0.753 . . . 1.0 . . . . . . . . . . . . A . 6 CYS SG . . . . . . . . . c19595_2mgo 1 . 5 . 630 . 1 1 7 PRO C C -2.903 5.304 1.715 . . . 1.0 . . . . . . . . . . . . A . 7 PRO C . . . . . . . . . c19595_2mgo 1 . 5 . 631 . 1 1 7 PRO CA C -3.184 4.333 2.843 . . . 1.0 . . . . . . . . . . . . A . 7 PRO CA . . . . . . . . . c19595_2mgo 1 . 5 . 632 . 1 1 7 PRO CB C -2.882 4.990 4.195 . . . 1.0 . . . . . . . . . . . . A . 7 PRO CB . . . . . . . . . c19595_2mgo 1 . 5 . 633 . 1 1 7 PRO CD C -1.413 3.128 3.957 . . . 1.0 . . . . . . . . . . . . A . 7 PRO CD . . . . . . . . . c19595_2mgo 1 . 5 . 634 . 1 1 7 PRO CG C -2.142 3.962 4.964 . . . 1.0 . . . . . . . . . . . . A . 7 PRO CG . . . . . . . . . c19595_2mgo 1 . 5 . 635 . 1 1 7 PRO HA H -4.215 4.018 2.802 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HA . . . . . . . . . c19595_2mgo 1 . 5 . 636 . 1 1 7 PRO HB2 H -2.280 5.873 4.036 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HB2 . . . . . . . . . c19595_2mgo 1 . 5 . 637 . 1 1 7 PRO HB3 H -3.804 5.263 4.684 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HB3 . . . . . . . . . c19595_2mgo 1 . 5 . 638 . 1 1 7 PRO HD2 H -0.440 3.543 3.744 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HD2 . . . . . . . . . c19595_2mgo 1 . 5 . 639 . 1 1 7 PRO HD3 H -1.329 2.112 4.317 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HD3 . . . . . . . . . c19595_2mgo 1 . 5 . 640 . 1 1 7 PRO HG2 H -1.442 4.443 5.630 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HG2 . . . . . . . . . c19595_2mgo 1 . 5 . 641 . 1 1 7 PRO HG3 H -2.836 3.354 5.526 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HG3 . . . . . . . . . c19595_2mgo 1 . 5 . 642 . 1 1 7 PRO N N -2.283 3.197 2.779 . . . 1.0 . . . . . . . . . . . . A . 7 PRO N . . . . . . . . . c19595_2mgo 1 . 5 . 643 . 1 1 7 PRO O O -1.911 6.031 1.732 . . . 1.0 . . . . . . . . . . . . A . 7 PRO O . . . . . . . . . c19595_2mgo 1 . 5 . 644 . 1 1 8 LEU C C -4.584 7.240 -0.413 . . . 1.0 . . . . . . . . . . . . A . 8 LEU C . . . . . . . . . c19595_2mgo 1 . 5 . 645 . 1 1 8 LEU CA C -3.567 6.129 -0.440 . . . 1.0 . . . . . . . . . . . . A . 8 LEU CA . . . . . . . . . c19595_2mgo 1 . 5 . 646 . 1 1 8 LEU CB C -3.673 5.328 -1.719 . . . 1.0 . . . . . . . . . . . . A . 8 LEU CB . . . . . . . . . c19595_2mgo 1 . 5 . 647 . 1 1 8 LEU CD1 C -2.891 3.481 -3.231 . . . 1.0 . . . . . . . . . . . . A . 8 LEU CD1 . . . . . . . . . c19595_2mgo 1 . 5 . 648 . 1 1 8 LEU CD2 C -1.216 4.790 -1.918 . . . 1.0 . . . . . . . . . . . . A . 8 LEU CD2 . . . . . . . . . c19595_2mgo 1 . 5 . 649 . 1 1 8 LEU CG C -2.629 4.220 -1.931 . . . 1.0 . . . . . . . . . . . . A . 8 LEU CG . . . . . . . . . c19595_2mgo 1 . 5 . 650 . 1 1 8 LEU H H -4.468 4.614 0.741 . . . 1.0 . . . . . . . . . . . . A . 8 LEU H . . . . . . . . . c19595_2mgo 1 . 5 . 651 . 1 1 8 LEU HA H -2.592 6.573 -0.367 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HA . . . . . . . . . c19595_2mgo 1 . 5 . 652 . 1 1 8 LEU HB2 H -4.655 4.882 -1.740 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HB2 . . . . . . . . . c19595_2mgo 1 . 5 . 653 . 1 1 8 LEU HB3 H -3.603 6.042 -2.522 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HB3 . . . . . . . . . c19595_2mgo 1 . 5 . 654 . 1 1 8 LEU HD11 H -3.873 3.034 -3.203 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HD11 . . . . . . . . . c19595_2mgo 1 . 5 . 655 . 1 1 8 LEU HD12 H -2.147 2.709 -3.363 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HD12 . . . . . . . . . c19595_2mgo 1 . 5 . 656 . 1 1 8 LEU HD13 H -2.837 4.177 -4.056 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HD13 . . . . . . . . . c19595_2mgo 1 . 5 . 657 . 1 1 8 LEU HD21 H -1.012 5.242 -0.960 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HD21 . . . . . . . . . c19595_2mgo 1 . 5 . 658 . 1 1 8 LEU HD22 H -1.122 5.530 -2.698 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HD22 . . . . . . . . . c19595_2mgo 1 . 5 . 659 . 1 1 8 LEU HD23 H -0.508 3.992 -2.095 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HD23 . . . . . . . . . c19595_2mgo 1 . 5 . 660 . 1 1 8 LEU HG H -2.716 3.505 -1.124 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HG . . . . . . . . . c19595_2mgo 1 . 5 . 661 . 1 1 8 LEU N N -3.733 5.267 0.713 . . . 1.0 . . . . . . . . . . . . A . 8 LEU N . . . . . . . . . c19595_2mgo 1 . 5 . 662 . 1 1 8 LEU O O -4.626 8.119 -1.279 . . . 1.0 . . . . . . . . . . . . A . 8 LEU O . . . . . . . . . c19595_2mgo 1 . 5 . 663 . 1 1 9 GLY C C -7.488 7.478 1.596 . . . 1.0 . . . . . . . . . . . . A . 9 GLY C . . . . . . . . . c19595_2mgo 1 . 5 . 664 . 1 1 9 GLY CA C -6.392 8.129 0.824 . . . 1.0 . . . . . . . . . . . . A . 9 GLY CA . . . . . . . . . c19595_2mgo 1 . 5 . 665 . 1 1 9 GLY H H -5.224 6.409 1.156 . . . 1.0 . . . . . . . . . . . . A . 9 GLY H . . . . . . . . . c19595_2mgo 1 . 5 . 666 . 1 1 9 GLY HA2 H -5.981 8.952 1.391 . . . 1.0 . . . . . . . . . . . . A . 9 GLY HA2 . . . . . . . . . c19595_2mgo 1 . 5 . 667 . 1 1 9 GLY HA3 H -6.789 8.495 -0.112 . . . 1.0 . . . . . . . . . . . . A . 9 GLY HA3 . . . . . . . . . c19595_2mgo 1 . 5 . 668 . 1 1 9 GLY N N -5.368 7.177 0.571 . . . 1.0 . . . . . . . . . . . . A . 9 GLY N . . . . . . . . . c19595_2mgo 1 . 5 . 669 . 1 1 9 GLY O O -8.639 7.922 1.525 . . . 1.0 . . . . . . . . . . . . A . 9 GLY O . . . . . . . . . c19595_2mgo 1 . 5 . 670 . 1 1 9 GLY OXT O -7.221 6.457 2.260 . . . 1.0 . . . . . . . . . . . . A . 9 GLY OXT . . . . . . . . . c19595_2mgo 1 . 6 . 671 . 1 1 1 CYS C C 4.683 0.470 -0.596 . . . 1.0 . . . . . . . . . . . . A . 1 CYS C . . . . . . . . . c19595_2mgo 1 . 6 . 672 . 1 1 1 CYS CA C 5.029 1.585 0.373 . . . 1.0 . . . . . . . . . . . . A . 1 CYS CA . . . . . . . . . c19595_2mgo 1 . 6 . 673 . 1 1 1 CYS CB C 3.854 1.813 1.333 . . . 1.0 . . . . . . . . . . . . A . 1 CYS CB . . . . . . . . . c19595_2mgo 1 . 6 . 674 . 1 1 1 CYS H1 H 5.587 3.587 0.280 . . . 1.0 . . . . . . . . . . . . A . 1 CYS H1 . . . . . . . . . c19595_2mgo 1 . 6 . 675 . 1 1 1 CYS H2 H 4.473 3.100 -0.893 . . . 1.0 . . . . . . . . . . . . A . 1 CYS H2 . . . . . . . . . c19595_2mgo 1 . 6 . 676 . 1 1 1 CYS H3 H 6.081 2.648 -1.048 . . . 1.0 . . . . . . . . . . . . A . 1 CYS H3 . . . . . . . . . c19595_2mgo 1 . 6 . 677 . 1 1 1 CYS HA H 5.902 1.308 0.942 . . . 1.0 . . . . . . . . . . . . A . 1 CYS HA . . . . . . . . . c19595_2mgo 1 . 6 . 678 . 1 1 1 CYS HB2 H 3.567 0.865 1.764 . . . 1.0 . . . . . . . . . . . . A . 1 CYS HB2 . . . . . . . . . c19595_2mgo 1 . 6 . 679 . 1 1 1 CYS HB3 H 4.149 2.483 2.127 . . . 1.0 . . . . . . . . . . . . A . 1 CYS HB3 . . . . . . . . . c19595_2mgo 1 . 6 . 680 . 1 1 1 CYS N N 5.317 2.813 -0.360 . . . 1.0 . . . . . . . . . . . . A . 1 CYS N . . . . . . . . . c19595_2mgo 1 . 6 . 681 . 1 1 1 CYS O O 4.059 0.710 -1.630 . . . 1.0 . . . . . . . . . . . . A . 1 CYS O . . . . . . . . . c19595_2mgo 1 . 6 . 682 . 1 1 1 CYS SG S 2.369 2.515 0.532 . . . 1.0 . . . . . . . . . . . . A . 1 CYS SG . . . . . . . . . c19595_2mgo 1 . 6 . 683 . 1 1 2 TYR C C 3.925 -2.838 -0.256 . . . 1.0 . . . . . . . . . . . . A . 2 TYR C . . . . . . . . . c19595_2mgo 1 . 6 . 684 . 1 1 2 TYR CA C 4.763 -1.879 -1.079 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CA . . . . . . . . . c19595_2mgo 1 . 6 . 685 . 1 1 2 TYR CB C 6.015 -2.565 -1.687 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CB . . . . . . . . . c19595_2mgo 1 . 6 . 686 . 1 1 2 TYR CD1 C 5.076 -3.878 -3.666 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CD1 . . . . . . . . . c19595_2mgo 1 . 6 . 687 . 1 1 2 TYR CD2 C 6.112 -5.095 -1.898 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CD2 . . . . . . . . . c19595_2mgo 1 . 6 . 688 . 1 1 2 TYR CE1 C 4.811 -5.069 -4.324 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CE1 . . . . . . . . . c19595_2mgo 1 . 6 . 689 . 1 1 2 TYR CE2 C 5.854 -6.278 -2.548 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CE2 . . . . . . . . . c19595_2mgo 1 . 6 . 690 . 1 1 2 TYR CG C 5.729 -3.871 -2.438 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CG . . . . . . . . . c19595_2mgo 1 . 6 . 691 . 1 1 2 TYR CZ C 5.204 -6.263 -3.757 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CZ . . . . . . . . . c19595_2mgo 1 . 6 . 692 . 1 1 2 TYR H H 5.626 -0.877 0.532 . . . 1.0 . . . . . . . . . . . . A . 2 TYR H . . . . . . . . . c19595_2mgo 1 . 6 . 693 . 1 1 2 TYR HA H 4.136 -1.515 -1.881 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HA . . . . . . . . . c19595_2mgo 1 . 6 . 694 . 1 1 2 TYR HB2 H 6.487 -1.885 -2.381 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HB2 . . . . . . . . . c19595_2mgo 1 . 6 . 695 . 1 1 2 TYR HB3 H 6.709 -2.786 -0.890 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HB3 . . . . . . . . . c19595_2mgo 1 . 6 . 696 . 1 1 2 TYR HD1 H 4.769 -2.942 -4.110 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HD1 . . . . . . . . . c19595_2mgo 1 . 6 . 697 . 1 1 2 TYR HD2 H 6.624 -5.113 -0.949 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HD2 . . . . . . . . . c19595_2mgo 1 . 6 . 698 . 1 1 2 TYR HE1 H 4.304 -5.060 -5.277 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HE1 . . . . . . . . . c19595_2mgo 1 . 6 . 699 . 1 1 2 TYR HE2 H 6.163 -7.211 -2.100 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HE2 . . . . . . . . . c19595_2mgo 1 . 6 . 700 . 1 1 2 TYR HH H 4.579 -8.074 -3.759 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HH . . . . . . . . . c19595_2mgo 1 . 6 . 701 . 1 1 2 TYR N N 5.096 -0.735 -0.282 . . . 1.0 . . . . . . . . . . . . A . 2 TYR N . . . . . . . . . c19595_2mgo 1 . 6 . 702 . 1 1 2 TYR O O 4.429 -3.785 0.337 . . . 1.0 . . . . . . . . . . . . A . 2 TYR O . . . . . . . . . c19595_2mgo 1 . 6 . 703 . 1 1 2 TYR OH O 4.943 -7.449 -4.400 . . . 1.0 . . . . . . . . . . . . A . 2 TYR OH . . . . . . . . . c19595_2mgo 1 . 6 . 704 . 1 1 3 ILE C C 0.407 -3.045 -0.202 . . . 1.0 . . . . . . . . . . . . A . 3 ILE C . . . . . . . . . c19595_2mgo 1 . 6 . 705 . 1 1 3 ILE CA C 1.694 -3.299 0.522 . . . 1.0 . . . . . . . . . . . . A . 3 ILE CA . . . . . . . . . c19595_2mgo 1 . 6 . 706 . 1 1 3 ILE CB C 1.520 -2.973 2.037 . . . 1.0 . . . . . . . . . . . . A . 3 ILE CB . . . . . . . . . c19595_2mgo 1 . 6 . 707 . 1 1 3 ILE CD1 C 1.217 -1.069 3.733 . . . 1.0 . . . . . . . . . . . . A . 3 ILE CD1 . . . . . . . . . c19595_2mgo 1 . 6 . 708 . 1 1 3 ILE CG1 C 1.457 -1.460 2.292 . . . 1.0 . . . . . . . . . . . . A . 3 ILE CG1 . . . . . . . . . c19595_2mgo 1 . 6 . 709 . 1 1 3 ILE CG2 C 2.576 -3.658 2.900 . . . 1.0 . . . . . . . . . . . . A . 3 ILE CG2 . . . . . . . . . c19595_2mgo 1 . 6 . 710 . 1 1 3 ILE H H 2.331 -1.652 -0.466 . . . 1.0 . . . . . . . . . . . . A . 3 ILE H . . . . . . . . . c19595_2mgo 1 . 6 . 711 . 1 1 3 ILE HA H 1.966 -4.336 0.397 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HA . . . . . . . . . c19595_2mgo 1 . 6 . 712 . 1 1 3 ILE HB H 0.563 -3.397 2.285 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HB . . . . . . . . . c19595_2mgo 1 . 6 . 713 . 1 1 3 ILE HD11 H 2.014 -1.459 4.348 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HD11 . . . . . . . . . c19595_2mgo 1 . 6 . 714 . 1 1 3 ILE HD12 H 0.274 -1.480 4.062 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HD12 . . . . . . . . . c19595_2mgo 1 . 6 . 715 . 1 1 3 ILE HD13 H 1.189 0.007 3.815 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HD13 . . . . . . . . . c19595_2mgo 1 . 6 . 716 . 1 1 3 ILE HG12 H 2.393 -1.018 1.987 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HG12 . . . . . . . . . c19595_2mgo 1 . 6 . 717 . 1 1 3 ILE HG13 H 0.662 -1.039 1.694 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HG13 . . . . . . . . . c19595_2mgo 1 . 6 . 718 . 1 1 3 ILE HG21 H 2.423 -3.391 3.935 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HG21 . . . . . . . . . c19595_2mgo 1 . 6 . 719 . 1 1 3 ILE HG22 H 3.560 -3.340 2.588 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HG22 . . . . . . . . . c19595_2mgo 1 . 6 . 720 . 1 1 3 ILE HG23 H 2.495 -4.730 2.791 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HG23 . . . . . . . . . c19595_2mgo 1 . 6 . 721 . 1 1 3 ILE N N 2.678 -2.501 -0.122 . . . 1.0 . . . . . . . . . . . . A . 3 ILE N . . . . . . . . . c19595_2mgo 1 . 6 . 722 . 1 1 3 ILE O O 0.280 -2.032 -0.889 . . . 1.0 . . . . . . . . . . . . A . 3 ILE O . . . . . . . . . c19595_2mgo 1 . 6 . 723 . 1 1 4 GLN C C -2.777 -2.959 0.053 . . . 1.0 . . . . . . . . . . . . A . 4 GLN C . . . . . . . . . c19595_2mgo 1 . 6 . 724 . 1 1 4 GLN CA C -1.804 -3.777 -0.761 . . . 1.0 . . . . . . . . . . . . A . 4 GLN CA . . . . . . . . . c19595_2mgo 1 . 6 . 725 . 1 1 4 GLN CB C -2.388 -5.143 -1.053 . . . 1.0 . . . . . . . . . . . . A . 4 GLN CB . . . . . . . . . c19595_2mgo 1 . 6 . 726 . 1 1 4 GLN CD C -2.076 -7.418 -2.030 . . . 1.0 . . . . . . . . . . . . A . 4 GLN CD . . . . . . . . . c19595_2mgo 1 . 6 . 727 . 1 1 4 GLN CG C -1.474 -6.055 -1.840 . . . 1.0 . . . . . . . . . . . . A . 4 GLN CG . . . . . . . . . c19595_2mgo 1 . 6 . 728 . 1 1 4 GLN H H -0.408 -4.657 0.570 . . . 1.0 . . . . . . . . . . . . A . 4 GLN H . . . . . . . . . c19595_2mgo 1 . 6 . 729 . 1 1 4 GLN HA H -1.611 -3.262 -1.687 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HA . . . . . . . . . c19595_2mgo 1 . 6 . 730 . 1 1 4 GLN HB2 H -2.611 -5.626 -0.114 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HB2 . . . . . . . . . c19595_2mgo 1 . 6 . 731 . 1 1 4 GLN HB3 H -3.306 -5.019 -1.610 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HB3 . . . . . . . . . c19595_2mgo 1 . 6 . 732 . 1 1 4 GLN HE21 H -2.861 -6.857 -3.747 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HE21 . . . . . . . . . c19595_2mgo 1 . 6 . 733 . 1 1 4 GLN HE22 H -3.183 -8.482 -3.261 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HE22 . . . . . . . . . c19595_2mgo 1 . 6 . 734 . 1 1 4 GLN HG2 H -1.287 -5.616 -2.809 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HG2 . . . . . . . . . c19595_2mgo 1 . 6 . 735 . 1 1 4 GLN HG3 H -0.541 -6.159 -1.305 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HG3 . . . . . . . . . c19595_2mgo 1 . 6 . 736 . 1 1 4 GLN N N -0.538 -3.907 -0.051 . . . 1.0 . . . . . . . . . . . . A . 4 GLN N . . . . . . . . . c19595_2mgo 1 . 6 . 737 . 1 1 4 GLN NE2 N -2.772 -7.604 -3.114 . . . 1.0 . . . . . . . . . . . . A . 4 GLN NE2 . . . . . . . . . c19595_2mgo 1 . 6 . 738 . 1 1 4 GLN O O -3.915 -2.735 -0.339 . . . 1.0 . . . . . . . . . . . . A . 4 GLN O . . . . . . . . . c19595_2mgo 1 . 6 . 739 . 1 1 4 GLN OE1 O -1.889 -8.311 -1.198 . . . 1.0 . . . . . . . . . . . . A . 4 GLN OE1 . . . . . . . . . c19595_2mgo 1 . 6 . 740 . 1 1 5 ASN C C -2.564 -0.329 2.231 . . . 1.0 . . . . . . . . . . . . A . 5 ASN C . . . . . . . . . c19595_2mgo 1 . 6 . 741 . 1 1 5 ASN CA C -3.124 -1.732 2.090 . . . 1.0 . . . . . . . . . . . . A . 5 ASN CA . . . . . . . . . c19595_2mgo 1 . 6 . 742 . 1 1 5 ASN CB C -3.251 -2.419 3.469 . . . 1.0 . . . . . . . . . . . . A . 5 ASN CB . . . . . . . . . c19595_2mgo 1 . 6 . 743 . 1 1 5 ASN CG C -4.067 -3.717 3.443 . . . 1.0 . . . . . . . . . . . . A . 5 ASN CG . . . . . . . . . c19595_2mgo 1 . 6 . 744 . 1 1 5 ASN H H -1.391 -2.756 1.386 . . . 1.0 . . . . . . . . . . . . A . 5 ASN H . . . . . . . . . c19595_2mgo 1 . 6 . 745 . 1 1 5 ASN HA H -4.108 -1.655 1.651 . . . 1.0 . . . . . . . . . . . . A . 5 ASN HA . . . . . . . . . c19595_2mgo 1 . 6 . 746 . 1 1 5 ASN HB2 H -2.260 -2.662 3.825 . . . 1.0 . . . . . . . . . . . . A . 5 ASN HB2 . . . . . . . . . c19595_2mgo 1 . 6 . 747 . 1 1 5 ASN HB3 H -3.716 -1.735 4.163 . . . 1.0 . . . . . . . . . . . . A . 5 ASN HB3 . . . . . . . . . c19595_2mgo 1 . 6 . 748 . 1 1 5 ASN HD21 H -4.777 -3.350 5.245 . . . 1.0 . . . . . . . . . . . . A . 5 ASN HD21 . . . . . . . . . c19595_2mgo 1 . 6 . 749 . 1 1 5 ASN HD22 H -5.331 -4.798 4.471 . . . 1.0 . . . . . . . . . . . . A . 5 ASN HD22 . . . . . . . . . c19595_2mgo 1 . 6 . 750 . 1 1 5 ASN N N -2.316 -2.513 1.177 . . . 1.0 . . . . . . . . . . . . A . 5 ASN N . . . . . . . . . c19595_2mgo 1 . 6 . 751 . 1 1 5 ASN ND2 N -4.788 -3.983 4.494 . . . 1.0 . . . . . . . . . . . . A . 5 ASN ND2 . . . . . . . . . c19595_2mgo 1 . 6 . 752 . 1 1 5 ASN O O -2.709 0.313 3.272 . . . 1.0 . . . . . . . . . . . . A . 5 ASN O . . . . . . . . . c19595_2mgo 1 . 6 . 753 . 1 1 5 ASN OD1 O -4.071 -4.454 2.469 . . . 1.0 . . . . . . . . . . . . A . 5 ASN OD1 . . . . . . . . . c19595_2mgo 1 . 6 . 754 . 1 1 6 CYS C C -2.611 2.483 0.975 . . . 1.0 . . . . . . . . . . . . A . 6 CYS C . . . . . . . . . c19595_2mgo 1 . 6 . 755 . 1 1 6 CYS CA C -1.435 1.515 1.128 . . . 1.0 . . . . . . . . . . . . A . 6 CYS CA . . . . . . . . . c19595_2mgo 1 . 6 . 756 . 1 1 6 CYS CB C -0.473 1.715 -0.061 . . . 1.0 . . . . . . . . . . . . A . 6 CYS CB . . . . . . . . . c19595_2mgo 1 . 6 . 757 . 1 1 6 CYS H H -1.788 -0.441 0.403 . . . 1.0 . . . . . . . . . . . . A . 6 CYS H . . . . . . . . . c19595_2mgo 1 . 6 . 758 . 1 1 6 CYS HA H -0.906 1.721 2.047 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HA . . . . . . . . . c19595_2mgo 1 . 6 . 759 . 1 1 6 CYS HB2 H -0.928 1.303 -0.950 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HB2 . . . . . . . . . c19595_2mgo 1 . 6 . 760 . 1 1 6 CYS HB3 H -0.321 2.774 -0.209 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HB3 . . . . . . . . . c19595_2mgo 1 . 6 . 761 . 1 1 6 CYS N N -1.925 0.143 1.178 . . . 1.0 . . . . . . . . . . . . A . 6 CYS N . . . . . . . . . c19595_2mgo 1 . 6 . 762 . 1 1 6 CYS O O -3.650 2.108 0.408 . . . 1.0 . . . . . . . . . . . . A . 6 CYS O . . . . . . . . . c19595_2mgo 1 . 6 . 763 . 1 1 6 CYS SG S 1.161 0.936 0.116 . . . 1.0 . . . . . . . . . . . . A . 6 CYS SG . . . . . . . . . c19595_2mgo 1 . 6 . 764 . 1 1 7 PRO C C -3.589 5.075 -0.186 . . . 1.0 . . . . . . . . . . . . A . 7 PRO C . . . . . . . . . c19595_2mgo 1 . 6 . 765 . 1 1 7 PRO CA C -3.509 4.753 1.307 . . . 1.0 . . . . . . . . . . . . A . 7 PRO CA . . . . . . . . . c19595_2mgo 1 . 6 . 766 . 1 1 7 PRO CB C -2.979 5.966 2.094 . . . 1.0 . . . . . . . . . . . . A . 7 PRO CB . . . . . . . . . c19595_2mgo 1 . 6 . 767 . 1 1 7 PRO CD C -1.433 4.166 2.427 . . . 1.0 . . . . . . . . . . . . A . 7 PRO CD . . . . . . . . . c19595_2mgo 1 . 6 . 768 . 1 1 7 PRO CG C -1.547 5.662 2.375 . . . 1.0 . . . . . . . . . . . . A . 7 PRO CG . . . . . . . . . c19595_2mgo 1 . 6 . 769 . 1 1 7 PRO HA H -4.482 4.451 1.669 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HA . . . . . . . . . c19595_2mgo 1 . 6 . 770 . 1 1 7 PRO HB2 H -3.081 6.857 1.490 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HB2 . . . . . . . . . c19595_2mgo 1 . 6 . 771 . 1 1 7 PRO HB3 H -3.541 6.083 3.007 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HB3 . . . . . . . . . c19595_2mgo 1 . 6 . 772 . 1 1 7 PRO HD2 H -0.468 3.848 2.062 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HD2 . . . . . . . . . c19595_2mgo 1 . 6 . 773 . 1 1 7 PRO HD3 H -1.598 3.807 3.432 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HD3 . . . . . . . . . c19595_2mgo 1 . 6 . 774 . 1 1 7 PRO HG2 H -0.930 6.057 1.581 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HG2 . . . . . . . . . c19595_2mgo 1 . 6 . 775 . 1 1 7 PRO HG3 H -1.257 6.095 3.322 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HG3 . . . . . . . . . c19595_2mgo 1 . 6 . 776 . 1 1 7 PRO N N -2.507 3.712 1.526 . . . 1.0 . . . . . . . . . . . . A . 7 PRO N . . . . . . . . . c19595_2mgo 1 . 6 . 777 . 1 1 7 PRO O O -2.642 5.605 -0.772 . . . 1.0 . . . . . . . . . . . . A . 7 PRO O . . . . . . . . . c19595_2mgo 1 . 6 . 778 . 1 1 8 LEU C C -6.165 5.494 -2.548 . . . 1.0 . . . . . . . . . . . . A . 8 LEU C . . . . . . . . . c19595_2mgo 1 . 6 . 779 . 1 1 8 LEU CA C -4.844 4.847 -2.233 . . . 1.0 . . . . . . . . . . . . A . 8 LEU CA . . . . . . . . . c19595_2mgo 1 . 6 . 780 . 1 1 8 LEU CB C -4.798 3.491 -2.881 . . . 1.0 . . . . . . . . . . . . A . 8 LEU CB . . . . . . . . . c19595_2mgo 1 . 6 . 781 . 1 1 8 LEU CD1 C -3.641 1.335 -3.398 . . . 1.0 . . . . . . . . . . . . A . 8 LEU CD1 . . . . . . . . . c19595_2mgo 1 . 6 . 782 . 1 1 8 LEU CD2 C -2.386 3.457 -3.575 . . . 1.0 . . . . . . . . . . . . A . 8 LEU CD2 . . . . . . . . . c19595_2mgo 1 . 6 . 783 . 1 1 8 LEU CG C -3.471 2.721 -2.824 . . . 1.0 . . . . . . . . . . . . A . 8 LEU CG . . . . . . . . . c19595_2mgo 1 . 6 . 784 . 1 1 8 LEU H H -5.412 4.303 -0.278 . . . 1.0 . . . . . . . . . . . . A . 8 LEU H . . . . . . . . . c19595_2mgo 1 . 6 . 785 . 1 1 8 LEU HA H -4.037 5.448 -2.624 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HA . . . . . . . . . c19595_2mgo 1 . 6 . 786 . 1 1 8 LEU HB2 H -5.568 2.888 -2.421 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HB2 . . . . . . . . . c19595_2mgo 1 . 6 . 787 . 1 1 8 LEU HB3 H -5.071 3.707 -3.897 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HB3 . . . . . . . . . c19595_2mgo 1 . 6 . 788 . 1 1 8 LEU HD11 H -2.703 0.802 -3.338 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HD11 . . . . . . . . . c19595_2mgo 1 . 6 . 789 . 1 1 8 LEU HD12 H -3.946 1.407 -4.432 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HD12 . . . . . . . . . c19595_2mgo 1 . 6 . 790 . 1 1 8 LEU HD13 H -4.394 0.804 -2.838 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HD13 . . . . . . . . . c19595_2mgo 1 . 6 . 791 . 1 1 8 LEU HD21 H -1.467 2.898 -3.512 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HD21 . . . . . . . . . c19595_2mgo 1 . 6 . 792 . 1 1 8 LEU HD22 H -2.242 4.436 -3.142 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HD22 . . . . . . . . . c19595_2mgo 1 . 6 . 793 . 1 1 8 LEU HD23 H -2.673 3.557 -4.611 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HD23 . . . . . . . . . c19595_2mgo 1 . 6 . 794 . 1 1 8 LEU HG H -3.165 2.622 -1.793 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HG . . . . . . . . . c19595_2mgo 1 . 6 . 795 . 1 1 8 LEU N N -4.678 4.702 -0.798 . . . 1.0 . . . . . . . . . . . . A . 8 LEU N . . . . . . . . . c19595_2mgo 1 . 6 . 796 . 1 1 8 LEU O O -6.709 5.374 -3.650 . . . 1.0 . . . . . . . . . . . . A . 8 LEU O . . . . . . . . . c19595_2mgo 1 . 6 . 797 . 1 1 9 GLY C C -8.069 7.729 -0.510 . . . 1.0 . . . . . . . . . . . . A . 9 GLY C . . . . . . . . . c19595_2mgo 1 . 6 . 798 . 1 1 9 GLY CA C -7.895 6.854 -1.702 . . . 1.0 . . . . . . . . . . . . A . 9 GLY CA . . . . . . . . . c19595_2mgo 1 . 6 . 799 . 1 1 9 GLY H H -6.104 6.232 -0.797 . . . 1.0 . . . . . . . . . . . . A . 9 GLY H . . . . . . . . . c19595_2mgo 1 . 6 . 800 . 1 1 9 GLY HA2 H -7.910 7.452 -2.601 . . . 1.0 . . . . . . . . . . . . A . 9 GLY HA2 . . . . . . . . . c19595_2mgo 1 . 6 . 801 . 1 1 9 GLY HA3 H -8.698 6.133 -1.732 . . . 1.0 . . . . . . . . . . . . A . 9 GLY HA3 . . . . . . . . . c19595_2mgo 1 . 6 . 802 . 1 1 9 GLY N N -6.646 6.176 -1.607 . . . 1.0 . . . . . . . . . . . . A . 9 GLY N . . . . . . . . . c19595_2mgo 1 . 6 . 803 . 1 1 9 GLY O O -9.208 7.938 -0.059 . . . 1.0 . . . . . . . . . . . . A . 9 GLY O . . . . . . . . . c19595_2mgo 1 . 6 . 804 . 1 1 9 GLY OXT O -7.037 8.190 0.031 . . . 1.0 . . . . . . . . . . . . A . 9 GLY OXT . . . . . . . . . c19595_2mgo 1 . 7 . 805 . 1 1 1 CYS C C 4.526 0.432 -0.664 . . . 1.0 . . . . . . . . . . . . A . 1 CYS C . . . . . . . . . c19595_2mgo 1 . 7 . 806 . 1 1 1 CYS CA C 4.431 1.471 0.438 . . . 1.0 . . . . . . . . . . . . A . 1 CYS CA . . . . . . . . . c19595_2mgo 1 . 7 . 807 . 1 1 1 CYS CB C 2.980 1.903 0.610 . . . 1.0 . . . . . . . . . . . . A . 1 CYS CB . . . . . . . . . c19595_2mgo 1 . 7 . 808 . 1 1 1 CYS H1 H 5.215 3.323 0.881 . . . 1.0 . . . . . . . . . . . . A . 1 CYS H1 . . . . . . . . . c19595_2mgo 1 . 7 . 809 . 1 1 1 CYS H2 H 4.895 3.066 -0.762 . . . 1.0 . . . . . . . . . . . . A . 1 CYS H2 . . . . . . . . . c19595_2mgo 1 . 7 . 810 . 1 1 1 CYS H3 H 6.234 2.332 -0.045 . . . 1.0 . . . . . . . . . . . . A . 1 CYS H3 . . . . . . . . . c19595_2mgo 1 . 7 . 811 . 1 1 1 CYS HA H 4.786 1.039 1.361 . . . 1.0 . . . . . . . . . . . . A . 1 CYS HA . . . . . . . . . c19595_2mgo 1 . 7 . 812 . 1 1 1 CYS HB2 H 2.622 2.293 -0.329 . . . 1.0 . . . . . . . . . . . . A . 1 CYS HB2 . . . . . . . . . c19595_2mgo 1 . 7 . 813 . 1 1 1 CYS HB3 H 2.391 1.037 0.865 . . . 1.0 . . . . . . . . . . . . A . 1 CYS HB3 . . . . . . . . . c19595_2mgo 1 . 7 . 814 . 1 1 1 CYS N N 5.252 2.627 0.110 . . . 1.0 . . . . . . . . . . . . A . 1 CYS N . . . . . . . . . c19595_2mgo 1 . 7 . 815 . 1 1 1 CYS O O 4.537 0.782 -1.842 . . . 1.0 . . . . . . . . . . . . A . 1 CYS O . . . . . . . . . c19595_2mgo 1 . 7 . 816 . 1 1 1 CYS SG S 2.717 3.172 1.902 . . . 1.0 . . . . . . . . . . . . A . 1 CYS SG . . . . . . . . . c19595_2mgo 1 . 7 . 817 . 1 1 2 TYR C C 3.672 -2.994 -0.925 . . . 1.0 . . . . . . . . . . . . A . 2 TYR C . . . . . . . . . c19595_2mgo 1 . 7 . 818 . 1 1 2 TYR CA C 4.680 -1.898 -1.264 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CA . . . . . . . . . c19595_2mgo 1 . 7 . 819 . 1 1 2 TYR CB C 6.101 -2.458 -1.415 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CB . . . . . . . . . c19595_2mgo 1 . 7 . 820 . 1 1 2 TYR CD1 C 7.261 -2.577 0.838 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CD1 . . . . . . . . . c19595_2mgo 1 . 7 . 821 . 1 1 2 TYR CD2 C 6.609 -4.614 -0.201 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CD2 . . . . . . . . . c19595_2mgo 1 . 7 . 822 . 1 1 2 TYR CE1 C 7.783 -3.291 1.898 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CE1 . . . . . . . . . c19595_2mgo 1 . 7 . 823 . 1 1 2 TYR CE2 C 7.128 -5.329 0.850 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CE2 . . . . . . . . . c19595_2mgo 1 . 7 . 824 . 1 1 2 TYR CG C 6.663 -3.226 -0.229 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CG . . . . . . . . . c19595_2mgo 1 . 7 . 825 . 1 1 2 TYR CZ C 7.714 -4.664 1.899 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CZ . . . . . . . . . c19595_2mgo 1 . 7 . 826 . 1 1 2 TYR H H 4.698 -1.095 0.649 . . . 1.0 . . . . . . . . . . . . A . 2 TYR H . . . . . . . . . c19595_2mgo 1 . 7 . 827 . 1 1 2 TYR HA H 4.372 -1.466 -2.202 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HA . . . . . . . . . c19595_2mgo 1 . 7 . 828 . 1 1 2 TYR HB2 H 6.061 -3.155 -2.232 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HB2 . . . . . . . . . c19595_2mgo 1 . 7 . 829 . 1 1 2 TYR HB3 H 6.781 -1.654 -1.661 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HB3 . . . . . . . . . c19595_2mgo 1 . 7 . 830 . 1 1 2 TYR HD1 H 7.315 -1.499 0.838 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HD1 . . . . . . . . . c19595_2mgo 1 . 7 . 831 . 1 1 2 TYR HD2 H 6.145 -5.137 -1.025 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HD2 . . . . . . . . . c19595_2mgo 1 . 7 . 832 . 1 1 2 TYR HE1 H 8.244 -2.768 2.722 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HE1 . . . . . . . . . c19595_2mgo 1 . 7 . 833 . 1 1 2 TYR HE2 H 7.065 -6.408 0.838 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HE2 . . . . . . . . . c19595_2mgo 1 . 7 . 834 . 1 1 2 TYR HH H 7.936 -4.956 3.768 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HH . . . . . . . . . c19595_2mgo 1 . 7 . 835 . 1 1 2 TYR N N 4.632 -0.840 -0.294 . . . 1.0 . . . . . . . . . . . . A . 2 TYR N . . . . . . . . . c19595_2mgo 1 . 7 . 836 . 1 1 2 TYR O O 3.604 -4.025 -1.583 . . . 1.0 . . . . . . . . . . . . A . 2 TYR O . . . . . . . . . c19595_2mgo 1 . 7 . 837 . 1 1 2 TYR OH O 8.236 -5.371 2.950 . . . 1.0 . . . . . . . . . . . . A . 2 TYR OH . . . . . . . . . c19595_2mgo 1 . 7 . 838 . 1 1 3 ILE C C 0.588 -3.120 -0.109 . . . 1.0 . . . . . . . . . . . . A . 3 ILE C . . . . . . . . . c19595_2mgo 1 . 7 . 839 . 1 1 3 ILE CA C 1.869 -3.676 0.488 . . . 1.0 . . . . . . . . . . . . A . 3 ILE CA . . . . . . . . . c19595_2mgo 1 . 7 . 840 . 1 1 3 ILE CB C 1.742 -3.757 2.061 . . . 1.0 . . . . . . . . . . . . A . 3 ILE CB . . . . . . . . . c19595_2mgo 1 . 7 . 841 . 1 1 3 ILE CD1 C 3.844 -5.195 2.389 . . . 1.0 . . . . . . . . . . . . A . 3 ILE CD1 . . . . . . . . . c19595_2mgo 1 . 7 . 842 . 1 1 3 ILE CG1 C 3.114 -3.918 2.742 . . . 1.0 . . . . . . . . . . . . A . 3 ILE CG1 . . . . . . . . . c19595_2mgo 1 . 7 . 843 . 1 1 3 ILE CG2 C 0.800 -4.876 2.528 . . . 1.0 . . . . . . . . . . . . A . 3 ILE CG2 . . . . . . . . . c19595_2mgo 1 . 7 . 844 . 1 1 3 ILE H H 2.949 -1.911 0.571 . . . 1.0 . . . . . . . . . . . . A . 3 ILE H . . . . . . . . . c19595_2mgo 1 . 7 . 845 . 1 1 3 ILE HA H 2.081 -4.652 0.073 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HA . . . . . . . . . c19595_2mgo 1 . 7 . 846 . 1 1 3 ILE HB H 1.290 -2.837 2.370 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HB . . . . . . . . . c19595_2mgo 1 . 7 . 847 . 1 1 3 ILE HD11 H 3.992 -5.238 1.320 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HD11 . . . . . . . . . c19595_2mgo 1 . 7 . 848 . 1 1 3 ILE HD12 H 3.259 -6.044 2.706 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HD12 . . . . . . . . . c19595_2mgo 1 . 7 . 849 . 1 1 3 ILE HD13 H 4.805 -5.209 2.882 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HD13 . . . . . . . . . c19595_2mgo 1 . 7 . 850 . 1 1 3 ILE HG12 H 3.760 -3.109 2.442 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HG12 . . . . . . . . . c19595_2mgo 1 . 7 . 851 . 1 1 3 ILE HG13 H 2.984 -3.895 3.813 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HG13 . . . . . . . . . c19595_2mgo 1 . 7 . 852 . 1 1 3 ILE HG21 H 0.831 -4.928 3.608 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HG21 . . . . . . . . . c19595_2mgo 1 . 7 . 853 . 1 1 3 ILE HG22 H 1.116 -5.820 2.114 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HG22 . . . . . . . . . c19595_2mgo 1 . 7 . 854 . 1 1 3 ILE HG23 H -0.210 -4.654 2.219 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HG23 . . . . . . . . . c19595_2mgo 1 . 7 . 855 . 1 1 3 ILE N N 2.889 -2.758 0.090 . . . 1.0 . . . . . . . . . . . . A . 3 ILE N . . . . . . . . . c19595_2mgo 1 . 7 . 856 . 1 1 3 ILE O O 0.539 -1.959 -0.510 . . . 1.0 . . . . . . . . . . . . A . 3 ILE O . . . . . . . . . c19595_2mgo 1 . 7 . 857 . 1 1 4 GLN C C -2.639 -2.902 0.243 . . . 1.0 . . . . . . . . . . . . A . 4 GLN C . . . . . . . . . c19595_2mgo 1 . 7 . 858 . 1 1 4 GLN CA C -1.678 -3.556 -0.749 . . . 1.0 . . . . . . . . . . . . A . 4 GLN CA . . . . . . . . . c19595_2mgo 1 . 7 . 859 . 1 1 4 GLN CB C -2.291 -4.811 -1.363 . . . 1.0 . . . . . . . . . . . . A . 4 GLN CB . . . . . . . . . c19595_2mgo 1 . 7 . 860 . 1 1 4 GLN CD C -1.201 -4.496 -3.632 . . . 1.0 . . . . . . . . . . . . A . 4 GLN CD . . . . . . . . . c19595_2mgo 1 . 7 . 861 . 1 1 4 GLN CG C -1.438 -5.435 -2.465 . . . 1.0 . . . . . . . . . . . . A . 4 GLN CG . . . . . . . . . c19595_2mgo 1 . 7 . 862 . 1 1 4 GLN H H -0.262 -4.712 0.399 . . . 1.0 . . . . . . . . . . . . A . 4 GLN H . . . . . . . . . c19595_2mgo 1 . 7 . 863 . 1 1 4 GLN HA H -1.462 -2.853 -1.539 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HA . . . . . . . . . c19595_2mgo 1 . 7 . 864 . 1 1 4 GLN HB2 H -2.417 -5.547 -0.583 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HB2 . . . . . . . . . c19595_2mgo 1 . 7 . 865 . 1 1 4 GLN HB3 H -3.254 -4.559 -1.777 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HB3 . . . . . . . . . c19595_2mgo 1 . 7 . 866 . 1 1 4 GLN HE21 H -2.815 -5.171 -4.544 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HE21 . . . . . . . . . c19595_2mgo 1 . 7 . 867 . 1 1 4 GLN HE22 H -1.933 -3.957 -5.380 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HE22 . . . . . . . . . c19595_2mgo 1 . 7 . 868 . 1 1 4 GLN HG2 H -0.478 -5.702 -2.048 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HG2 . . . . . . . . . c19595_2mgo 1 . 7 . 869 . 1 1 4 GLN HG3 H -1.928 -6.325 -2.831 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HG3 . . . . . . . . . c19595_2mgo 1 . 7 . 870 . 1 1 4 GLN N N -0.410 -3.890 -0.107 . . . 1.0 . . . . . . . . . . . . A . 4 GLN N . . . . . . . . . c19595_2mgo 1 . 7 . 871 . 1 1 4 GLN NE2 N -2.064 -4.544 -4.604 . . . 1.0 . . . . . . . . . . . . A . 4 GLN NE2 . . . . . . . . . c19595_2mgo 1 . 7 . 872 . 1 1 4 GLN O O -3.866 -3.053 0.157 . . . 1.0 . . . . . . . . . . . . A . 4 GLN O . . . . . . . . . c19595_2mgo 1 . 7 . 873 . 1 1 4 GLN OE1 O -0.230 -3.741 -3.649 . . . 1.0 . . . . . . . . . . . . A . 4 GLN OE1 . . . . . . . . . c19595_2mgo 1 . 7 . 874 . 1 1 5 ASN C C -2.430 0.034 2.157 . . . 1.0 . . . . . . . . . . . . A . 5 ASN C . . . . . . . . . c19595_2mgo 1 . 7 . 875 . 1 1 5 ASN CA C -2.839 -1.425 2.166 . . . 1.0 . . . . . . . . . . . . A . 5 ASN CA . . . . . . . . . c19595_2mgo 1 . 7 . 876 . 1 1 5 ASN CB C -2.618 -2.016 3.576 . . . 1.0 . . . . . . . . . . . . A . 5 ASN CB . . . . . . . . . c19595_2mgo 1 . 7 . 877 . 1 1 5 ASN CG C -3.176 -3.420 3.756 . . . 1.0 . . . . . . . . . . . . A . 5 ASN CG . . . . . . . . . c19595_2mgo 1 . 7 . 878 . 1 1 5 ASN H H -1.099 -2.063 1.139 . . . 1.0 . . . . . . . . . . . . A . 5 ASN H . . . . . . . . . c19595_2mgo 1 . 7 . 879 . 1 1 5 ASN HA H -3.883 -1.493 1.907 . . . 1.0 . . . . . . . . . . . . A . 5 ASN HA . . . . . . . . . c19595_2mgo 1 . 7 . 880 . 1 1 5 ASN HB2 H -1.559 -2.055 3.775 . . . 1.0 . . . . . . . . . . . . A . 5 ASN HB2 . . . . . . . . . c19595_2mgo 1 . 7 . 881 . 1 1 5 ASN HB3 H -3.086 -1.368 4.300 . . . 1.0 . . . . . . . . . . . . A . 5 ASN HB3 . . . . . . . . . c19595_2mgo 1 . 7 . 882 . 1 1 5 ASN HD21 H -4.890 -2.695 4.422 . . . 1.0 . . . . . . . . . . . . A . 5 ASN HD21 . . . . . . . . . c19595_2mgo 1 . 7 . 883 . 1 1 5 ASN HD22 H -4.788 -4.411 4.354 . . . 1.0 . . . . . . . . . . . . A . 5 ASN HD22 . . . . . . . . . c19595_2mgo 1 . 7 . 884 . 1 1 5 ASN N N -2.076 -2.148 1.157 . . . 1.0 . . . . . . . . . . . . A . 5 ASN N . . . . . . . . . c19595_2mgo 1 . 7 . 885 . 1 1 5 ASN ND2 N -4.398 -3.520 4.216 . . . 1.0 . . . . . . . . . . . . A . 5 ASN ND2 . . . . . . . . . c19595_2mgo 1 . 7 . 886 . 1 1 5 ASN O O -2.726 0.787 3.085 . . . 1.0 . . . . . . . . . . . . A . 5 ASN O . . . . . . . . . c19595_2mgo 1 . 7 . 887 . 1 1 5 ASN OD1 O -2.490 -4.415 3.500 . . . 1.0 . . . . . . . . . . . . A . 5 ASN OD1 . . . . . . . . . c19595_2mgo 1 . 7 . 888 . 1 1 6 CYS C C -0.811 2.015 -0.500 . . . 1.0 . . . . . . . . . . . . A . 6 CYS C . . . . . . . . . c19595_2mgo 1 . 7 . 889 . 1 1 6 CYS CA C -1.261 1.784 0.943 . . . 1.0 . . . . . . . . . . . . A . 6 CYS CA . . . . . . . . . c19595_2mgo 1 . 7 . 890 . 1 1 6 CYS CB C -0.091 2.007 1.913 . . . 1.0 . . . . . . . . . . . . A . 6 CYS CB . . . . . . . . . c19595_2mgo 1 . 7 . 891 . 1 1 6 CYS H H -1.683 -0.177 0.324 . . . 1.0 . . . . . . . . . . . . A . 6 CYS H . . . . . . . . . c19595_2mgo 1 . 7 . 892 . 1 1 6 CYS HA H -2.056 2.473 1.183 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HA . . . . . . . . . c19595_2mgo 1 . 7 . 893 . 1 1 6 CYS HB2 H -0.464 1.931 2.924 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HB2 . . . . . . . . . c19595_2mgo 1 . 7 . 894 . 1 1 6 CYS HB3 H 0.644 1.233 1.754 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HB3 . . . . . . . . . c19595_2mgo 1 . 7 . 895 . 1 1 6 CYS N N -1.785 0.436 1.085 . . . 1.0 . . . . . . . . . . . . A . 6 CYS N . . . . . . . . . c19595_2mgo 1 . 7 . 896 . 1 1 6 CYS O O 0.061 1.294 -1.013 . . . 1.0 . . . . . . . . . . . . A . 6 CYS O . . . . . . . . . c19595_2mgo 1 . 7 . 897 . 1 1 6 CYS SG S 0.743 3.623 1.763 . . . 1.0 . . . . . . . . . . . . A . 6 CYS SG . . . . . . . . . c19595_2mgo 1 . 7 . 898 . 1 1 7 PRO C C 0.161 4.155 -2.739 . . . 1.0 . . . . . . . . . . . . A . 7 PRO C . . . . . . . . . c19595_2mgo 1 . 7 . 899 . 1 1 7 PRO CA C -1.093 3.283 -2.572 . . . 1.0 . . . . . . . . . . . . A . 7 PRO CA . . . . . . . . . c19595_2mgo 1 . 7 . 900 . 1 1 7 PRO CB C -2.332 4.041 -3.042 . . . 1.0 . . . . . . . . . . . . A . 7 PRO CB . . . . . . . . . c19595_2mgo 1 . 7 . 901 . 1 1 7 PRO CD C -2.442 3.910 -0.653 . . . 1.0 . . . . . . . . . . . . A . 7 PRO CD . . . . . . . . . c19595_2mgo 1 . 7 . 902 . 1 1 7 PRO CG C -2.791 4.779 -1.834 . . . 1.0 . . . . . . . . . . . . A . 7 PRO CG . . . . . . . . . c19595_2mgo 1 . 7 . 903 . 1 1 7 PRO HA H -0.989 2.376 -3.147 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HA . . . . . . . . . c19595_2mgo 1 . 7 . 904 . 1 1 7 PRO HB2 H -2.063 4.713 -3.843 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HB2 . . . . . . . . . c19595_2mgo 1 . 7 . 905 . 1 1 7 PRO HB3 H -3.081 3.342 -3.383 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HB3 . . . . . . . . . c19595_2mgo 1 . 7 . 906 . 1 1 7 PRO HD2 H -2.048 4.507 0.156 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HD2 . . . . . . . . . c19595_2mgo 1 . 7 . 907 . 1 1 7 PRO HD3 H -3.310 3.355 -0.330 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HD3 . . . . . . . . . c19595_2mgo 1 . 7 . 908 . 1 1 7 PRO HG2 H -2.280 5.727 -1.766 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HG2 . . . . . . . . . c19595_2mgo 1 . 7 . 909 . 1 1 7 PRO HG3 H -3.858 4.931 -1.881 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HG3 . . . . . . . . . c19595_2mgo 1 . 7 . 910 . 1 1 7 PRO N N -1.405 2.996 -1.183 . . . 1.0 . . . . . . . . . . . . A . 7 PRO N . . . . . . . . . c19595_2mgo 1 . 7 . 911 . 1 1 7 PRO O O 0.730 4.668 -1.762 . . . 1.0 . . . . . . . . . . . . A . 7 PRO O . . . . . . . . . c19595_2mgo 1 . 7 . 912 . 1 1 8 LEU C C 1.289 6.432 -4.909 . . . 1.0 . . . . . . . . . . . . A . 8 LEU C . . . . . . . . . c19595_2mgo 1 . 7 . 913 . 1 1 8 LEU CA C 1.745 5.145 -4.293 . . . 1.0 . . . . . . . . . . . . A . 8 LEU CA . . . . . . . . . c19595_2mgo 1 . 7 . 914 . 1 1 8 LEU CB C 2.747 4.457 -5.226 . . . 1.0 . . . . . . . . . . . . A . 8 LEU CB . . . . . . . . . c19595_2mgo 1 . 7 . 915 . 1 1 8 LEU CD1 C 2.723 2.067 -4.379 . . . 1.0 . . . . . . . . . . . . A . 8 LEU CD1 . . . . . . . . . c19595_2mgo 1 . 7 . 916 . 1 1 8 LEU CD2 C 4.701 2.950 -5.628 . . . 1.0 . . . . . . . . . . . . A . 8 LEU CD2 . . . . . . . . . c19595_2mgo 1 . 7 . 917 . 1 1 8 LEU CG C 3.579 3.291 -4.669 . . . 1.0 . . . . . . . . . . . . A . 8 LEU CG . . . . . . . . . c19595_2mgo 1 . 7 . 918 . 1 1 8 LEU H H 0.163 3.801 -4.698 . . . 1.0 . . . . . . . . . . . . A . 8 LEU H . . . . . . . . . c19595_2mgo 1 . 7 . 919 . 1 1 8 LEU HA H 2.224 5.387 -3.362 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HA . . . . . . . . . c19595_2mgo 1 . 7 . 920 . 1 1 8 LEU HB2 H 2.190 4.088 -6.075 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HB2 . . . . . . . . . c19595_2mgo 1 . 7 . 921 . 1 1 8 LEU HB3 H 3.414 5.229 -5.578 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HB3 . . . . . . . . . c19595_2mgo 1 . 7 . 922 . 1 1 8 LEU HD11 H 2.271 1.716 -5.293 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HD11 . . . . . . . . . c19595_2mgo 1 . 7 . 923 . 1 1 8 LEU HD12 H 1.946 2.336 -3.678 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HD12 . . . . . . . . . c19595_2mgo 1 . 7 . 924 . 1 1 8 LEU HD13 H 3.336 1.287 -3.950 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HD13 . . . . . . . . . c19595_2mgo 1 . 7 . 925 . 1 1 8 LEU HD21 H 4.284 2.665 -6.583 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HD21 . . . . . . . . . c19595_2mgo 1 . 7 . 926 . 1 1 8 LEU HD22 H 5.279 2.131 -5.230 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HD22 . . . . . . . . . c19595_2mgo 1 . 7 . 927 . 1 1 8 LEU HD23 H 5.339 3.811 -5.756 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HD23 . . . . . . . . . c19595_2mgo 1 . 7 . 928 . 1 1 8 LEU HG H 4.027 3.600 -3.736 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HG . . . . . . . . . c19595_2mgo 1 . 7 . 929 . 1 1 8 LEU N N 0.599 4.299 -3.973 . . . 1.0 . . . . . . . . . . . . A . 8 LEU N . . . . . . . . . c19595_2mgo 1 . 7 . 930 . 1 1 8 LEU O O 2.077 7.313 -5.230 . . . 1.0 . . . . . . . . . . . . A . 8 LEU O . . . . . . . . . c19595_2mgo 1 . 7 . 931 . 1 1 9 GLY C C -1.737 7.168 -6.454 . . . 1.0 . . . . . . . . . . . . A . 9 GLY C . . . . . . . . . c19595_2mgo 1 . 7 . 932 . 1 1 9 GLY CA C -0.587 7.633 -5.650 . . . 1.0 . . . . . . . . . . . . A . 9 GLY CA . . . . . . . . . c19595_2mgo 1 . 7 . 933 . 1 1 9 GLY H H -0.475 5.744 -4.747 . . . 1.0 . . . . . . . . . . . . A . 9 GLY H . . . . . . . . . c19595_2mgo 1 . 7 . 934 . 1 1 9 GLY HA2 H -0.927 8.304 -4.879 . . . 1.0 . . . . . . . . . . . . A . 9 GLY HA2 . . . . . . . . . c19595_2mgo 1 . 7 . 935 . 1 1 9 GLY HA3 H 0.112 8.138 -6.299 . . . 1.0 . . . . . . . . . . . . A . 9 GLY HA3 . . . . . . . . . c19595_2mgo 1 . 7 . 936 . 1 1 9 GLY N N 0.039 6.513 -5.058 . . . 1.0 . . . . . . . . . . . . A . 9 GLY N . . . . . . . . . c19595_2mgo 1 . 7 . 937 . 1 1 9 GLY O O -2.304 6.107 -6.103 . . . 1.0 . . . . . . . . . . . . A . 9 GLY O . . . . . . . . . c19595_2mgo 1 . 7 . 938 . 1 1 9 GLY OXT O -2.098 7.820 -7.448 . . . 1.0 . . . . . . . . . . . . A . 9 GLY OXT . . . . . . . . . c19595_2mgo 1 . 8 . 939 . 1 1 1 CYS C C 4.164 0.270 0.113 . . . 1.0 . . . . . . . . . . . . A . 1 CYS C . . . . . . . . . c19595_2mgo 1 . 8 . 940 . 1 1 1 CYS CA C 4.068 1.780 0.113 . . . 1.0 . . . . . . . . . . . . A . 1 CYS CA . . . . . . . . . c19595_2mgo 1 . 8 . 941 . 1 1 1 CYS CB C 2.792 2.250 -0.621 . . . 1.0 . . . . . . . . . . . . A . 1 CYS CB . . . . . . . . . c19595_2mgo 1 . 8 . 942 . 1 1 1 CYS H1 H 6.088 2.015 -0.013 . . . 1.0 . . . . . . . . . . . . A . 1 CYS H1 . . . . . . . . . c19595_2mgo 1 . 8 . 943 . 1 1 1 CYS H2 H 5.222 3.362 -0.546 . . . 1.0 . . . . . . . . . . . . A . 1 CYS H2 . . . . . . . . . c19595_2mgo 1 . 8 . 944 . 1 1 1 CYS H3 H 5.309 1.960 -1.505 . . . 1.0 . . . . . . . . . . . . A . 1 CYS H3 . . . . . . . . . c19595_2mgo 1 . 8 . 945 . 1 1 1 CYS HA H 4.050 2.133 1.133 . . . 1.0 . . . . . . . . . . . . A . 1 CYS HA . . . . . . . . . c19595_2mgo 1 . 8 . 946 . 1 1 1 CYS HB2 H 1.934 1.774 -0.172 . . . 1.0 . . . . . . . . . . . . A . 1 CYS HB2 . . . . . . . . . c19595_2mgo 1 . 8 . 947 . 1 1 1 CYS HB3 H 2.690 3.320 -0.521 . . . 1.0 . . . . . . . . . . . . A . 1 CYS HB3 . . . . . . . . . c19595_2mgo 1 . 8 . 948 . 1 1 1 CYS N N 5.244 2.325 -0.535 . . . 1.0 . . . . . . . . . . . . A . 1 CYS N . . . . . . . . . c19595_2mgo 1 . 8 . 949 . 1 1 1 CYS O O 4.954 -0.299 -0.650 . . . 1.0 . . . . . . . . . . . . A . 1 CYS O . . . . . . . . . c19595_2mgo 1 . 8 . 950 . 1 1 1 CYS SG S 2.731 1.856 -2.404 . . . 1.0 . . . . . . . . . . . . A . 1 CYS SG . . . . . . . . . c19595_2mgo 1 . 8 . 951 . 1 1 2 TYR C C 2.351 -2.189 0.030 . . . 1.0 . . . . . . . . . . . . A . 2 TYR C . . . . . . . . . c19595_2mgo 1 . 8 . 952 . 1 1 2 TYR CA C 3.378 -1.773 1.022 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CA . . . . . . . . . c19595_2mgo 1 . 8 . 953 . 1 1 2 TYR CB C 2.986 -2.269 2.421 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CB . . . . . . . . . c19595_2mgo 1 . 8 . 954 . 1 1 2 TYR CD1 C 5.094 -2.062 3.806 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CD1 . . . . . . . . . c19595_2mgo 1 . 8 . 955 . 1 1 2 TYR CD2 C 3.213 -0.744 4.426 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CD2 . . . . . . . . . c19595_2mgo 1 . 8 . 956 . 1 1 2 TYR CE1 C 5.811 -1.542 4.863 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CE1 . . . . . . . . . c19595_2mgo 1 . 8 . 957 . 1 1 2 TYR CE2 C 3.926 -0.216 5.481 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CE2 . . . . . . . . . c19595_2mgo 1 . 8 . 958 . 1 1 2 TYR CG C 3.786 -1.675 3.566 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CG . . . . . . . . . c19595_2mgo 1 . 8 . 959 . 1 1 2 TYR CZ C 5.221 -0.618 5.696 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CZ . . . . . . . . . c19595_2mgo 1 . 8 . 960 . 1 1 2 TYR H H 2.753 0.035 1.551 . . . 1.0 . . . . . . . . . . . . A . 2 TYR H . . . . . . . . . c19595_2mgo 1 . 8 . 961 . 1 1 2 TYR HA H 4.352 -2.152 0.752 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HA . . . . . . . . . c19595_2mgo 1 . 8 . 962 . 1 1 2 TYR HB2 H 1.942 -2.066 2.600 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HB2 . . . . . . . . . c19595_2mgo 1 . 8 . 963 . 1 1 2 TYR HB3 H 3.129 -3.339 2.449 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HB3 . . . . . . . . . c19595_2mgo 1 . 8 . 964 . 1 1 2 TYR HD1 H 5.558 -2.781 3.150 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HD1 . . . . . . . . . c19595_2mgo 1 . 8 . 965 . 1 1 2 TYR HD2 H 2.195 -0.425 4.262 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HD2 . . . . . . . . . c19595_2mgo 1 . 8 . 966 . 1 1 2 TYR HE1 H 6.830 -1.862 5.028 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HE1 . . . . . . . . . c19595_2mgo 1 . 8 . 967 . 1 1 2 TYR HE2 H 3.464 0.511 6.134 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HE2 . . . . . . . . . c19595_2mgo 1 . 8 . 968 . 1 1 2 TYR HH H 6.810 0.137 6.468 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HH . . . . . . . . . c19595_2mgo 1 . 8 . 969 . 1 1 2 TYR N N 3.399 -0.384 0.960 . . . 1.0 . . . . . . . . . . . . A . 2 TYR N . . . . . . . . . c19595_2mgo 1 . 8 . 970 . 1 1 2 TYR O O 1.366 -1.491 -0.163 . . . 1.0 . . . . . . . . . . . . A . 2 TYR O . . . . . . . . . c19595_2mgo 1 . 8 . 971 . 1 1 2 TYR OH O 5.921 -0.106 6.752 . . . 1.0 . . . . . . . . . . . . A . 2 TYR OH . . . . . . . . . c19595_2mgo 1 . 8 . 972 . 1 1 3 ILE C C 0.261 -3.841 -1.373 . . . 1.0 . . . . . . . . . . . . A . 3 ILE C . . . . . . . . . c19595_2mgo 1 . 8 . 973 . 1 1 3 ILE CA C 1.755 -3.853 -1.656 . . . 1.0 . . . . . . . . . . . . A . 3 ILE CA . . . . . . . . . c19595_2mgo 1 . 8 . 974 . 1 1 3 ILE CB C 2.224 -5.286 -2.080 . . . 1.0 . . . . . . . . . . . . A . 3 ILE CB . . . . . . . . . c19595_2mgo 1 . 8 . 975 . 1 1 3 ILE CD1 C 4.237 -6.603 -2.982 . . . 1.0 . . . . . . . . . . . . A . 3 ILE CD1 . . . . . . . . . c19595_2mgo 1 . 8 . 976 . 1 1 3 ILE CG1 C 3.679 -5.250 -2.574 . . . 1.0 . . . . . . . . . . . . A . 3 ILE CG1 . . . . . . . . . c19595_2mgo 1 . 8 . 977 . 1 1 3 ILE CG2 C 1.307 -5.877 -3.162 . . . 1.0 . . . . . . . . . . . . A . 3 ILE CG2 . . . . . . . . . c19595_2mgo 1 . 8 . 978 . 1 1 3 ILE H H 3.356 -3.710 -0.141 . . . 1.0 . . . . . . . . . . . . A . 3 ILE H . . . . . . . . . c19595_2mgo 1 . 8 . 979 . 1 1 3 ILE HA H 1.888 -3.192 -2.484 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HA . . . . . . . . . c19595_2mgo 1 . 8 . 980 . 1 1 3 ILE HB H 2.168 -5.927 -1.211 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HB . . . . . . . . . c19595_2mgo 1 . 8 . 981 . 1 1 3 ILE HD11 H 3.652 -7.002 -3.797 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HD11 . . . . . . . . . c19595_2mgo 1 . 8 . 982 . 1 1 3 ILE HD12 H 4.194 -7.282 -2.145 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HD12 . . . . . . . . . c19595_2mgo 1 . 8 . 983 . 1 1 3 ILE HD13 H 5.264 -6.492 -3.295 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HD13 . . . . . . . . . c19595_2mgo 1 . 8 . 984 . 1 1 3 ILE HG12 H 3.734 -4.606 -3.439 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HG12 . . . . . . . . . c19595_2mgo 1 . 8 . 985 . 1 1 3 ILE HG13 H 4.310 -4.847 -1.797 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HG13 . . . . . . . . . c19595_2mgo 1 . 8 . 986 . 1 1 3 ILE HG21 H 1.327 -5.240 -4.034 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HG21 . . . . . . . . . c19595_2mgo 1 . 8 . 987 . 1 1 3 ILE HG22 H 0.297 -5.936 -2.787 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HG22 . . . . . . . . . c19595_2mgo 1 . 8 . 988 . 1 1 3 ILE HG23 H 1.653 -6.865 -3.426 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HG23 . . . . . . . . . c19595_2mgo 1 . 8 . 989 . 1 1 3 ILE N N 2.572 -3.290 -0.544 . . . 1.0 . . . . . . . . . . . . A . 3 ILE N . . . . . . . . . c19595_2mgo 1 . 8 . 990 . 1 1 3 ILE O O -0.563 -3.481 -2.223 . . . 1.0 . . . . . . . . . . . . A . 3 ILE O . . . . . . . . . c19595_2mgo 1 . 8 . 991 . 1 1 4 GLN C C -1.861 -2.995 1.003 . . . 1.0 . . . . . . . . . . . . A . 4 GLN C . . . . . . . . . c19595_2mgo 1 . 8 . 992 . 1 1 4 GLN CA C -1.436 -4.246 0.243 . . . 1.0 . . . . . . . . . . . . A . 4 GLN CA . . . . . . . . . c19595_2mgo 1 . 8 . 993 . 1 1 4 GLN CB C -1.636 -5.476 1.114 . . . 1.0 . . . . . . . . . . . . A . 4 GLN CB . . . . . . . . . c19595_2mgo 1 . 8 . 994 . 1 1 4 GLN CD C -1.453 -7.992 1.340 . . . 1.0 . . . . . . . . . . . . A . 4 GLN CD . . . . . . . . . c19595_2mgo 1 . 8 . 995 . 1 1 4 GLN CG C -1.373 -6.796 0.405 . . . 1.0 . . . . . . . . . . . . A . 4 GLN CG . . . . . . . . . c19595_2mgo 1 . 8 . 996 . 1 1 4 GLN H H 0.731 -4.347 0.359 . . . 1.0 . . . . . . . . . . . . A . 4 GLN H . . . . . . . . . c19595_2mgo 1 . 8 . 997 . 1 1 4 GLN HA H -2.056 -4.334 -0.632 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HA . . . . . . . . . c19595_2mgo 1 . 8 . 998 . 1 1 4 GLN HB2 H -0.968 -5.404 1.957 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HB2 . . . . . . . . . c19595_2mgo 1 . 8 . 999 . 1 1 4 GLN HB3 H -2.655 -5.482 1.476 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HB3 . . . . . . . . . c19595_2mgo 1 . 8 . 1000 . 1 1 4 GLN HE21 H -0.720 -6.938 2.853 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HE21 . . . . . . . . . c19595_2mgo 1 . 8 . 1001 . 1 1 4 GLN HE22 H -1.099 -8.578 3.187 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HE22 . . . . . . . . . c19595_2mgo 1 . 8 . 1002 . 1 1 4 GLN HG2 H -2.108 -6.925 -0.377 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HG2 . . . . . . . . . c19595_2mgo 1 . 8 . 1003 . 1 1 4 GLN HG3 H -0.387 -6.764 -0.034 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HG3 . . . . . . . . . c19595_2mgo 1 . 8 . 1004 . 1 1 4 GLN N N -0.053 -4.163 -0.201 . . . 1.0 . . . . . . . . . . . . A . 4 GLN N . . . . . . . . . c19595_2mgo 1 . 8 . 1005 . 1 1 4 GLN NE2 N -1.057 -7.817 2.571 . . . 1.0 . . . . . . . . . . . . A . 4 GLN NE2 . . . . . . . . . c19595_2mgo 1 . 8 . 1006 . 1 1 4 GLN O O -2.945 -2.944 1.579 . . . 1.0 . . . . . . . . . . . . A . 4 GLN O . . . . . . . . . c19595_2mgo 1 . 8 . 1007 . 1 1 4 GLN OE1 O -1.843 -9.088 0.936 . . . 1.0 . . . . . . . . . . . . A . 4 GLN OE1 . . . . . . . . . c19595_2mgo 1 . 8 . 1008 . 1 1 5 ASN C C -1.040 0.464 0.860 . . . 1.0 . . . . . . . . . . . . A . 5 ASN C . . . . . . . . . c19595_2mgo 1 . 8 . 1009 . 1 1 5 ASN CA C -1.302 -0.761 1.720 . . . 1.0 . . . . . . . . . . . . A . 5 ASN CA . . . . . . . . . c19595_2mgo 1 . 8 . 1010 . 1 1 5 ASN CB C -0.452 -0.670 3.006 . . . 1.0 . . . . . . . . . . . . A . 5 ASN CB . . . . . . . . . c19595_2mgo 1 . 8 . 1011 . 1 1 5 ASN CG C -0.683 -1.803 3.999 . . . 1.0 . . . . . . . . . . . . A . 5 ASN CG . . . . . . . . . c19595_2mgo 1 . 8 . 1012 . 1 1 5 ASN H H -0.212 -2.071 0.445 . . . 1.0 . . . . . . . . . . . . A . 5 ASN H . . . . . . . . . c19595_2mgo 1 . 8 . 1013 . 1 1 5 ASN HA H -2.344 -0.774 1.993 . . . 1.0 . . . . . . . . . . . . A . 5 ASN HA . . . . . . . . . c19595_2mgo 1 . 8 . 1014 . 1 1 5 ASN HB2 H 0.590 -0.663 2.733 . . . 1.0 . . . . . . . . . . . . A . 5 ASN HB2 . . . . . . . . . c19595_2mgo 1 . 8 . 1015 . 1 1 5 ASN HB3 H -0.680 0.264 3.497 . . . 1.0 . . . . . . . . . . . . A . 5 ASN HB3 . . . . . . . . . c19595_2mgo 1 . 8 . 1016 . 1 1 5 ASN HD21 H -2.089 -0.771 4.929 . . . 1.0 . . . . . . . . . . . . A . 5 ASN HD21 . . . . . . . . . c19595_2mgo 1 . 8 . 1017 . 1 1 5 ASN HD22 H -1.735 -2.330 5.571 . . . 1.0 . . . . . . . . . . . . A . 5 ASN HD22 . . . . . . . . . c19595_2mgo 1 . 8 . 1018 . 1 1 5 ASN N N -1.032 -1.990 0.981 . . . 1.0 . . . . . . . . . . . . A . 5 ASN N . . . . . . . . . c19595_2mgo 1 . 8 . 1019 . 1 1 5 ASN ND2 N -1.591 -1.617 4.914 . . . 1.0 . . . . . . . . . . . . A . 5 ASN ND2 . . . . . . . . . c19595_2mgo 1 . 8 . 1020 . 1 1 5 ASN O O -0.816 1.558 1.382 . . . 1.0 . . . . . . . . . . . . A . 5 ASN O . . . . . . . . . c19595_2mgo 1 . 8 . 1021 . 1 1 5 ASN OD1 O -0.023 -2.835 3.939 . . . 1.0 . . . . . . . . . . . . A . 5 ASN OD1 . . . . . . . . . c19595_2mgo 1 . 8 . 1022 . 1 1 6 CYS C C -2.292 1.979 -1.631 . . . 1.0 . . . . . . . . . . . . A . 6 CYS C . . . . . . . . . c19595_2mgo 1 . 8 . 1023 . 1 1 6 CYS CA C -0.900 1.427 -1.343 . . . 1.0 . . . . . . . . . . . . A . 6 CYS CA . . . . . . . . . c19595_2mgo 1 . 8 . 1024 . 1 1 6 CYS CB C -0.217 1.021 -2.670 . . . 1.0 . . . . . . . . . . . . A . 6 CYS CB . . . . . . . . . c19595_2mgo 1 . 8 . 1025 . 1 1 6 CYS H H -1.193 -0.604 -0.795 . . . 1.0 . . . . . . . . . . . . A . 6 CYS H . . . . . . . . . c19595_2mgo 1 . 8 . 1026 . 1 1 6 CYS HA H -0.308 2.177 -0.839 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HA . . . . . . . . . c19595_2mgo 1 . 8 . 1027 . 1 1 6 CYS HB2 H -0.837 0.300 -3.181 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HB2 . . . . . . . . . c19595_2mgo 1 . 8 . 1028 . 1 1 6 CYS HB3 H -0.126 1.898 -3.292 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HB3 . . . . . . . . . c19595_2mgo 1 . 8 . 1029 . 1 1 6 CYS N N -1.051 0.295 -0.437 . . . 1.0 . . . . . . . . . . . . A . 6 CYS N . . . . . . . . . c19595_2mgo 1 . 8 . 1030 . 1 1 6 CYS O O -3.091 1.308 -2.286 . . . 1.0 . . . . . . . . . . . . A . 6 CYS O . . . . . . . . . c19595_2mgo 1 . 8 . 1031 . 1 1 6 CYS SG S 1.452 0.281 -2.514 . . . 1.0 . . . . . . . . . . . . A . 6 CYS SG . . . . . . . . . c19595_2mgo 1 . 8 . 1032 . 1 1 7 PRO C C -4.151 4.237 -2.727 . . . 1.0 . . . . . . . . . . . . A . 7 PRO C . . . . . . . . . c19595_2mgo 1 . 8 . 1033 . 1 1 7 PRO CA C -3.959 3.735 -1.301 . . . 1.0 . . . . . . . . . . . . A . 7 PRO CA . . . . . . . . . c19595_2mgo 1 . 8 . 1034 . 1 1 7 PRO CB C -4.009 4.916 -0.310 . . . 1.0 . . . . . . . . . . . . A . 7 PRO CB . . . . . . . . . c19595_2mgo 1 . 8 . 1035 . 1 1 7 PRO CD C -1.786 4.047 -0.301 . . . 1.0 . . . . . . . . . . . . A . 7 PRO CD . . . . . . . . . c19595_2mgo 1 . 8 . 1036 . 1 1 7 PRO CG C -2.787 4.787 0.531 . . . 1.0 . . . . . . . . . . . . A . 7 PRO CG . . . . . . . . . c19595_2mgo 1 . 8 . 1037 . 1 1 7 PRO HA H -4.732 3.022 -1.060 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HA . . . . . . . . . c19595_2mgo 1 . 8 . 1038 . 1 1 7 PRO HB2 H -4.014 5.845 -0.860 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HB2 . . . . . . . . . c19595_2mgo 1 . 8 . 1039 . 1 1 7 PRO HB3 H -4.905 4.849 0.289 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HB3 . . . . . . . . . c19595_2mgo 1 . 8 . 1040 . 1 1 7 PRO HD2 H -1.226 4.730 -0.923 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HD2 . . . . . . . . . c19595_2mgo 1 . 8 . 1041 . 1 1 7 PRO HD3 H -1.133 3.480 0.344 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HD3 . . . . . . . . . c19595_2mgo 1 . 8 . 1042 . 1 1 7 PRO HG2 H -2.411 5.766 0.789 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HG2 . . . . . . . . . c19595_2mgo 1 . 8 . 1043 . 1 1 7 PRO HG3 H -3.018 4.228 1.424 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HG3 . . . . . . . . . c19595_2mgo 1 . 8 . 1044 . 1 1 7 PRO N N -2.637 3.163 -1.107 . . . 1.0 . . . . . . . . . . . . A . 7 PRO N . . . . . . . . . c19595_2mgo 1 . 8 . 1045 . 1 1 7 PRO O O -3.288 4.933 -3.273 . . . 1.0 . . . . . . . . . . . . A . 7 PRO O . . . . . . . . . c19595_2mgo 1 . 8 . 1046 . 1 1 8 LEU C C -6.321 5.651 -4.648 . . . 1.0 . . . . . . . . . . . . A . 8 LEU C . . . . . . . . . c19595_2mgo 1 . 8 . 1047 . 1 1 8 LEU CA C -5.575 4.337 -4.700 . . . 1.0 . . . . . . . . . . . . A . 8 LEU CA . . . . . . . . . c19595_2mgo 1 . 8 . 1048 . 1 1 8 LEU CB C -6.369 3.302 -5.520 . . . 1.0 . . . . . . . . . . . . A . 8 LEU CB . . . . . . . . . c19595_2mgo 1 . 8 . 1049 . 1 1 8 LEU CD1 C -5.296 1.098 -4.812 . . . 1.0 . . . . . . . . . . . . A . 8 LEU CD1 . . . . . . . . . c19595_2mgo 1 . 8 . 1050 . 1 1 8 LEU CD2 C -6.462 1.275 -7.014 . . . 1.0 . . . . . . . . . . . . A . 8 LEU CD2 . . . . . . . . . c19595_2mgo 1 . 8 . 1051 . 1 1 8 LEU CG C -5.636 2.016 -5.977 . . . 1.0 . . . . . . . . . . . . A . 8 LEU CG . . . . . . . . . c19595_2mgo 1 . 8 . 1052 . 1 1 8 LEU H H -5.895 3.295 -2.861 . . . 1.0 . . . . . . . . . . . . A . 8 LEU H . . . . . . . . . c19595_2mgo 1 . 8 . 1053 . 1 1 8 LEU HA H -4.629 4.532 -5.169 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HA . . . . . . . . . c19595_2mgo 1 . 8 . 1054 . 1 1 8 LEU HB2 H -7.220 3.002 -4.928 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HB2 . . . . . . . . . c19595_2mgo 1 . 8 . 1055 . 1 1 8 LEU HB3 H -6.739 3.817 -6.394 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HB3 . . . . . . . . . c19595_2mgo 1 . 8 . 1056 . 1 1 8 LEU HD11 H -4.780 0.226 -5.183 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HD11 . . . . . . . . . c19595_2mgo 1 . 8 . 1057 . 1 1 8 LEU HD12 H -6.206 0.794 -4.317 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HD12 . . . . . . . . . c19595_2mgo 1 . 8 . 1058 . 1 1 8 LEU HD13 H -4.661 1.623 -4.114 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HD13 . . . . . . . . . c19595_2mgo 1 . 8 . 1059 . 1 1 8 LEU HD21 H -7.413 1.000 -6.585 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HD21 . . . . . . . . . c19595_2mgo 1 . 8 . 1060 . 1 1 8 LEU HD22 H -5.935 0.383 -7.321 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HD22 . . . . . . . . . c19595_2mgo 1 . 8 . 1061 . 1 1 8 LEU HD23 H -6.623 1.912 -7.872 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HD23 . . . . . . . . . c19595_2mgo 1 . 8 . 1062 . 1 1 8 LEU HG H -4.704 2.303 -6.441 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HG . . . . . . . . . c19595_2mgo 1 . 8 . 1063 . 1 1 8 LEU N N -5.265 3.880 -3.337 . . . 1.0 . . . . . . . . . . . . A . 8 LEU N . . . . . . . . . c19595_2mgo 1 . 8 . 1064 . 1 1 8 LEU O O -6.639 6.274 -5.665 . . . 1.0 . . . . . . . . . . . . A . 8 LEU O . . . . . . . . . c19595_2mgo 1 . 8 . 1065 . 1 1 9 GLY C C -7.110 7.535 -1.711 . . . 1.0 . . . . . . . . . . . . A . 9 GLY C . . . . . . . . . c19595_2mgo 1 . 8 . 1066 . 1 1 9 GLY CA C -7.246 7.256 -3.171 . . . 1.0 . . . . . . . . . . . . A . 9 GLY CA . . . . . . . . . c19595_2mgo 1 . 8 . 1067 . 1 1 9 GLY H H -6.277 5.425 -2.770 . . . 1.0 . . . . . . . . . . . . A . 9 GLY H . . . . . . . . . c19595_2mgo 1 . 8 . 1068 . 1 1 9 GLY HA2 H -6.803 8.061 -3.741 . . . 1.0 . . . . . . . . . . . . A . 9 GLY HA2 . . . . . . . . . c19595_2mgo 1 . 8 . 1069 . 1 1 9 GLY HA3 H -8.294 7.169 -3.415 . . . 1.0 . . . . . . . . . . . . A . 9 GLY HA3 . . . . . . . . . c19595_2mgo 1 . 8 . 1070 . 1 1 9 GLY N N -6.578 6.038 -3.472 . . . 1.0 . . . . . . . . . . . . A . 9 GLY N . . . . . . . . . c19595_2mgo 1 . 8 . 1071 . 1 1 9 GLY O O -6.146 8.202 -1.308 . . . 1.0 . . . . . . . . . . . . A . 9 GLY O . . . . . . . . . c19595_2mgo 1 . 8 . 1072 . 1 1 9 GLY OXT O -7.932 7.018 -0.919 . . . 1.0 . . . . . . . . . . . . A . 9 GLY OXT . . . . . . . . . c19595_2mgo 1 . 9 . 1073 . 1 1 1 CYS C C 4.554 0.310 0.280 . . . 1.0 . . . . . . . . . . . . A . 1 CYS C . . . . . . . . . c19595_2mgo 1 . 9 . 1074 . 1 1 1 CYS CA C 4.434 1.807 0.024 . . . 1.0 . . . . . . . . . . . . A . 1 CYS CA . . . . . . . . . c19595_2mgo 1 . 9 . 1075 . 1 1 1 CYS CB C 3.586 2.086 -1.250 . . . 1.0 . . . . . . . . . . . . A . 1 CYS CB . . . . . . . . . c19595_2mgo 1 . 9 . 1076 . 1 1 1 CYS H1 H 5.755 3.360 -0.334 . . . 1.0 . . . . . . . . . . . . A . 1 CYS H1 . . . . . . . . . c19595_2mgo 1 . 9 . 1077 . 1 1 1 CYS H2 H 6.268 1.851 -0.912 . . . 1.0 . . . . . . . . . . . . A . 1 CYS H2 . . . . . . . . . c19595_2mgo 1 . 9 . 1078 . 1 1 1 CYS H3 H 6.329 2.190 0.721 . . . 1.0 . . . . . . . . . . . . A . 1 CYS H3 . . . . . . . . . c19595_2mgo 1 . 9 . 1079 . 1 1 1 CYS HA H 3.978 2.281 0.881 . . . 1.0 . . . . . . . . . . . . A . 1 CYS HA . . . . . . . . . c19595_2mgo 1 . 9 . 1080 . 1 1 1 CYS HB2 H 3.638 3.135 -1.494 . . . 1.0 . . . . . . . . . . . . A . 1 CYS HB2 . . . . . . . . . c19595_2mgo 1 . 9 . 1081 . 1 1 1 CYS HB3 H 4.011 1.520 -2.065 . . . 1.0 . . . . . . . . . . . . A . 1 CYS HB3 . . . . . . . . . c19595_2mgo 1 . 9 . 1082 . 1 1 1 CYS N N 5.772 2.342 -0.145 . . . 1.0 . . . . . . . . . . . . A . 1 CYS N . . . . . . . . . c19595_2mgo 1 . 9 . 1083 . 1 1 1 CYS O O 5.634 -0.274 0.092 . . . 1.0 . . . . . . . . . . . . A . 1 CYS O . . . . . . . . . c19595_2mgo 1 . 9 . 1084 . 1 1 1 CYS SG S 1.796 1.642 -1.149 . . . 1.0 . . . . . . . . . . . . A . 1 CYS SG . . . . . . . . . c19595_2mgo 1 . 9 . 1085 . 1 1 2 TYR C C 2.267 -2.088 0.064 . . . 1.0 . . . . . . . . . . . . A . 2 TYR C . . . . . . . . . c19595_2mgo 1 . 9 . 1086 . 1 1 2 TYR CA C 3.388 -1.685 0.945 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CA . . . . . . . . . c19595_2mgo 1 . 9 . 1087 . 1 1 2 TYR CB C 2.989 -1.961 2.404 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CB . . . . . . . . . c19595_2mgo 1 . 9 . 1088 . 1 1 2 TYR CD1 C 5.055 -1.711 3.845 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CD1 . . . . . . . . . c19595_2mgo 1 . 9 . 1089 . 1 1 2 TYR CD2 C 3.337 -0.090 4.050 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CD2 . . . . . . . . . c19595_2mgo 1 . 9 . 1090 . 1 1 2 TYR CE1 C 5.795 -1.053 4.805 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CE1 . . . . . . . . . c19595_2mgo 1 . 9 . 1091 . 1 1 2 TYR CE2 C 4.064 0.571 5.005 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CE2 . . . . . . . . . c19595_2mgo 1 . 9 . 1092 . 1 1 2 TYR CG C 3.814 -1.242 3.453 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CG . . . . . . . . . c19595_2mgo 1 . 9 . 1093 . 1 1 2 TYR CZ C 5.292 0.090 5.381 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CZ . . . . . . . . . c19595_2mgo 1 . 9 . 1094 . 1 1 2 TYR H H 2.613 0.154 0.774 . . . 1.0 . . . . . . . . . . . . A . 2 TYR H . . . . . . . . . c19595_2mgo 1 . 9 . 1095 . 1 1 2 TYR HA H 4.308 -2.183 0.683 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HA . . . . . . . . . c19595_2mgo 1 . 9 . 1096 . 1 1 2 TYR HB2 H 1.958 -1.671 2.546 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HB2 . . . . . . . . . c19595_2mgo 1 . 9 . 1097 . 1 1 2 TYR HB3 H 3.076 -3.023 2.583 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HB3 . . . . . . . . . c19595_2mgo 1 . 9 . 1098 . 1 1 2 TYR HD1 H 5.442 -2.608 3.387 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HD1 . . . . . . . . . c19595_2mgo 1 . 9 . 1099 . 1 1 2 TYR HD2 H 2.368 0.291 3.759 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HD2 . . . . . . . . . c19595_2mgo 1 . 9 . 1100 . 1 1 2 TYR HE1 H 6.762 -1.442 5.092 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HE1 . . . . . . . . . c19595_2mgo 1 . 9 . 1101 . 1 1 2 TYR HE2 H 3.659 1.466 5.452 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HE2 . . . . . . . . . c19595_2mgo 1 . 9 . 1102 . 1 1 2 TYR HH H 6.916 0.923 6.038 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HH . . . . . . . . . c19595_2mgo 1 . 9 . 1103 . 1 1 2 TYR N N 3.474 -0.300 0.693 . . . 1.0 . . . . . . . . . . . . A . 2 TYR N . . . . . . . . . c19595_2mgo 1 . 9 . 1104 . 1 1 2 TYR O O 1.230 -1.456 0.112 . . . 1.0 . . . . . . . . . . . . A . 2 TYR O . . . . . . . . . c19595_2mgo 1 . 9 . 1105 . 1 1 2 TYR OH O 6.014 0.758 6.345 . . . 1.0 . . . . . . . . . . . . A . 2 TYR OH . . . . . . . . . c19595_2mgo 1 . 9 . 1106 . 1 1 3 ILE C C 0.104 -3.726 -1.211 . . . 1.0 . . . . . . . . . . . . A . 3 ILE C . . . . . . . . . c19595_2mgo 1 . 9 . 1107 . 1 1 3 ILE CA C 1.498 -3.512 -1.768 . . . 1.0 . . . . . . . . . . . . A . 3 ILE CA . . . . . . . . . c19595_2mgo 1 . 9 . 1108 . 1 1 3 ILE CB C 1.977 -4.768 -2.550 . . . 1.0 . . . . . . . . . . . . A . 3 ILE CB . . . . . . . . . c19595_2mgo 1 . 9 . 1109 . 1 1 3 ILE CD1 C 3.982 -5.713 -3.851 . . . 1.0 . . . . . . . . . . . . A . 3 ILE CD1 . . . . . . . . . c19595_2mgo 1 . 9 . 1110 . 1 1 3 ILE CG1 C 3.401 -4.542 -3.083 . . . 1.0 . . . . . . . . . . . . A . 3 ILE CG1 . . . . . . . . . c19595_2mgo 1 . 9 . 1111 . 1 1 3 ILE CG2 C 1.018 -5.074 -3.708 . . . 1.0 . . . . . . . . . . . . A . 3 ILE CG2 . . . . . . . . . c19595_2mgo 1 . 9 . 1112 . 1 1 3 ILE H H 3.320 -3.538 -0.602 . . . 1.0 . . . . . . . . . . . . A . 3 ILE H . . . . . . . . . c19595_2mgo 1 . 9 . 1113 . 1 1 3 ILE HA H 1.410 -2.692 -2.449 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HA . . . . . . . . . c19595_2mgo 1 . 9 . 1114 . 1 1 3 ILE HB H 1.983 -5.612 -1.877 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HB . . . . . . . . . c19595_2mgo 1 . 9 . 1115 . 1 1 3 ILE HD11 H 4.020 -6.584 -3.213 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HD11 . . . . . . . . . c19595_2mgo 1 . 9 . 1116 . 1 1 3 ILE HD12 H 4.979 -5.467 -4.185 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HD12 . . . . . . . . . c19595_2mgo 1 . 9 . 1117 . 1 1 3 ILE HD13 H 3.359 -5.923 -4.708 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HD13 . . . . . . . . . c19595_2mgo 1 . 9 . 1118 . 1 1 3 ILE HG12 H 3.390 -3.690 -3.744 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HG12 . . . . . . . . . c19595_2mgo 1 . 9 . 1119 . 1 1 3 ILE HG13 H 4.055 -4.329 -2.250 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HG13 . . . . . . . . . c19595_2mgo 1 . 9 . 1120 . 1 1 3 ILE HG21 H 0.979 -4.223 -4.373 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HG21 . . . . . . . . . c19595_2mgo 1 . 9 . 1121 . 1 1 3 ILE HG22 H 0.031 -5.275 -3.319 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HG22 . . . . . . . . . c19595_2mgo 1 . 9 . 1122 . 1 1 3 ILE HG23 H 1.373 -5.937 -4.252 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HG23 . . . . . . . . . c19595_2mgo 1 . 9 . 1123 . 1 1 3 ILE N N 2.468 -3.081 -0.730 . . . 1.0 . . . . . . . . . . . . A . 3 ILE N . . . . . . . . . c19595_2mgo 1 . 9 . 1124 . 1 1 3 ILE O O -0.896 -3.330 -1.804 . . . 1.0 . . . . . . . . . . . . A . 3 ILE O . . . . . . . . . c19595_2mgo 1 . 9 . 1125 . 1 1 4 GLN C C -1.836 -3.248 1.234 . . . 1.0 . . . . . . . . . . . . A . 4 GLN C . . . . . . . . . c19595_2mgo 1 . 9 . 1126 . 1 1 4 GLN CA C -1.180 -4.510 0.672 . . . 1.0 . . . . . . . . . . . . A . 4 GLN CA . . . . . . . . . c19595_2mgo 1 . 9 . 1127 . 1 1 4 GLN CB C -0.969 -5.551 1.773 . . . 1.0 . . . . . . . . . . . . A . 4 GLN CB . . . . . . . . . c19595_2mgo 1 . 9 . 1128 . 1 1 4 GLN CD C -1.654 -7.629 0.461 . . . 1.0 . . . . . . . . . . . . A . 4 GLN CD . . . . . . . . . c19595_2mgo 1 . 9 . 1129 . 1 1 4 GLN CG C -0.562 -6.926 1.262 . . . 1.0 . . . . . . . . . . . . A . 4 GLN CG . . . . . . . . . c19595_2mgo 1 . 9 . 1130 . 1 1 4 GLN H H 0.970 -4.387 0.314 . . . 1.0 . . . . . . . . . . . . A . 4 GLN H . . . . . . . . . c19595_2mgo 1 . 9 . 1131 . 1 1 4 GLN HA H -1.858 -4.914 -0.061 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HA . . . . . . . . . c19595_2mgo 1 . 9 . 1132 . 1 1 4 GLN HB2 H -0.198 -5.195 2.442 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HB2 . . . . . . . . . c19595_2mgo 1 . 9 . 1133 . 1 1 4 GLN HB3 H -1.888 -5.657 2.328 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HB3 . . . . . . . . . c19595_2mgo 1 . 9 . 1134 . 1 1 4 GLN HE21 H -0.922 -9.379 0.984 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HE21 . . . . . . . . . c19595_2mgo 1 . 9 . 1135 . 1 1 4 GLN HE22 H -2.337 -9.408 -0.009 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HE22 . . . . . . . . . c19595_2mgo 1 . 9 . 1136 . 1 1 4 GLN HG2 H 0.306 -6.819 0.629 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HG2 . . . . . . . . . c19595_2mgo 1 . 9 . 1137 . 1 1 4 GLN HG3 H -0.310 -7.546 2.110 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HG3 . . . . . . . . . c19595_2mgo 1 . 9 . 1138 . 1 1 4 GLN N N 0.071 -4.226 -0.039 . . . 1.0 . . . . . . . . . . . . A . 4 GLN N . . . . . . . . . c19595_2mgo 1 . 9 . 1139 . 1 1 4 GLN NE2 N -1.632 -8.928 0.473 . . . 1.0 . . . . . . . . . . . . A . 4 GLN NE2 . . . . . . . . . c19595_2mgo 1 . 9 . 1140 . 1 1 4 GLN O O -2.878 -3.315 1.889 . . . 1.0 . . . . . . . . . . . . A . 4 GLN O . . . . . . . . . c19595_2mgo 1 . 9 . 1141 . 1 1 4 GLN OE1 O -2.493 -7.005 -0.185 . . . 1.0 . . . . . . . . . . . . A . 4 GLN OE1 . . . . . . . . . c19595_2mgo 1 . 9 . 1142 . 1 1 5 ASN C C -1.593 0.219 0.324 . . . 1.0 . . . . . . . . . . . . A . 5 ASN C . . . . . . . . . c19595_2mgo 1 . 9 . 1143 . 1 1 5 ASN CA C -1.720 -0.824 1.425 . . . 1.0 . . . . . . . . . . . . A . 5 ASN CA . . . . . . . . . c19595_2mgo 1 . 9 . 1144 . 1 1 5 ASN CB C -0.977 -0.349 2.693 . . . 1.0 . . . . . . . . . . . . A . 5 ASN CB . . . . . . . . . c19595_2mgo 1 . 9 . 1145 . 1 1 5 ASN CG C -1.299 -1.164 3.937 . . . 1.0 . . . . . . . . . . . . A . 5 ASN CG . . . . . . . . . c19595_2mgo 1 . 9 . 1146 . 1 1 5 ASN H H -0.410 -2.177 0.434 . . . 1.0 . . . . . . . . . . . . A . 5 ASN H . . . . . . . . . c19595_2mgo 1 . 9 . 1147 . 1 1 5 ASN HA H -2.766 -0.943 1.649 . . . 1.0 . . . . . . . . . . . . A . 5 ASN HA . . . . . . . . . c19595_2mgo 1 . 9 . 1148 . 1 1 5 ASN HB2 H 0.086 -0.405 2.518 . . . 1.0 . . . . . . . . . . . . A . 5 ASN HB2 . . . . . . . . . c19595_2mgo 1 . 9 . 1149 . 1 1 5 ASN HB3 H -1.242 0.682 2.880 . . . 1.0 . . . . . . . . . . . . A . 5 ASN HB3 . . . . . . . . . c19595_2mgo 1 . 9 . 1150 . 1 1 5 ASN HD21 H 0.231 -2.380 3.594 . . . 1.0 . . . . . . . . . . . . A . 5 ASN HD21 . . . . . . . . . c19595_2mgo 1 . 9 . 1151 . 1 1 5 ASN HD22 H -0.706 -2.748 4.978 . . . 1.0 . . . . . . . . . . . . A . 5 ASN HD22 . . . . . . . . . c19595_2mgo 1 . 9 . 1152 . 1 1 5 ASN N N -1.233 -2.125 0.969 . . . 1.0 . . . . . . . . . . . . A . 5 ASN N . . . . . . . . . c19595_2mgo 1 . 9 . 1153 . 1 1 5 ASN ND2 N -0.519 -2.186 4.194 . . . 1.0 . . . . . . . . . . . . A . 5 ASN ND2 . . . . . . . . . c19595_2mgo 1 . 9 . 1154 . 1 1 5 ASN O O -1.764 1.424 0.558 . . . 1.0 . . . . . . . . . . . . A . 5 ASN O . . . . . . . . . c19595_2mgo 1 . 9 . 1155 . 1 1 5 ASN OD1 O -2.236 -0.855 4.681 . . . 1.0 . . . . . . . . . . . . A . 5 ASN OD1 . . . . . . . . . c19595_2mgo 1 . 9 . 1156 . 1 1 6 CYS C C -2.552 0.869 -2.664 . . . 1.0 . . . . . . . . . . . . A . 6 CYS C . . . . . . . . . c19595_2mgo 1 . 9 . 1157 . 1 1 6 CYS CA C -1.192 0.672 -1.994 . . . 1.0 . . . . . . . . . . . . A . 6 CYS CA . . . . . . . . . c19595_2mgo 1 . 9 . 1158 . 1 1 6 CYS CB C -0.169 0.156 -3.028 . . . 1.0 . . . . . . . . . . . . A . 6 CYS CB . . . . . . . . . c19595_2mgo 1 . 9 . 1159 . 1 1 6 CYS H H -1.242 -1.196 -0.995 . . . 1.0 . . . . . . . . . . . . A . 6 CYS H . . . . . . . . . c19595_2mgo 1 . 9 . 1160 . 1 1 6 CYS HA H -0.842 1.614 -1.597 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HA . . . . . . . . . c19595_2mgo 1 . 9 . 1161 . 1 1 6 CYS HB2 H -0.441 -0.851 -3.309 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HB2 . . . . . . . . . c19595_2mgo 1 . 9 . 1162 . 1 1 6 CYS HB3 H -0.219 0.786 -3.904 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HB3 . . . . . . . . . c19595_2mgo 1 . 9 . 1163 . 1 1 6 CYS N N -1.324 -0.229 -0.866 . . . 1.0 . . . . . . . . . . . . A . 6 CYS N . . . . . . . . . c19595_2mgo 1 . 9 . 1164 . 1 1 6 CYS O O -3.233 -0.119 -3.000 . . . 1.0 . . . . . . . . . . . . A . 6 CYS O . . . . . . . . . c19595_2mgo 1 . 9 . 1165 . 1 1 6 CYS SG S 1.585 0.103 -2.473 . . . 1.0 . . . . . . . . . . . . A . 6 CYS SG . . . . . . . . . c19595_2mgo 1 . 9 . 1166 . 1 1 7 PRO C C -4.067 2.169 -5.005 . . . 1.0 . . . . . . . . . . . . A . 7 PRO C . . . . . . . . . c19595_2mgo 1 . 9 . 1167 . 1 1 7 PRO CA C -4.245 2.418 -3.514 . . . 1.0 . . . . . . . . . . . . A . 7 PRO CA . . . . . . . . . c19595_2mgo 1 . 9 . 1168 . 1 1 7 PRO CB C -4.488 3.914 -3.251 . . . 1.0 . . . . . . . . . . . . A . 7 PRO CB . . . . . . . . . c19595_2mgo 1 . 9 . 1169 . 1 1 7 PRO CD C -2.381 3.346 -2.294 . . . 1.0 . . . . . . . . . . . . A . 7 PRO CD . . . . . . . . . c19595_2mgo 1 . 9 . 1170 . 1 1 7 PRO CG C -3.542 4.282 -2.163 . . . 1.0 . . . . . . . . . . . . A . 7 PRO CG . . . . . . . . . c19595_2mgo 1 . 9 . 1171 . 1 1 7 PRO HA H -5.065 1.828 -3.132 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HA . . . . . . . . . c19595_2mgo 1 . 9 . 1172 . 1 1 7 PRO HB2 H -4.289 4.472 -4.154 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HB2 . . . . . . . . . c19595_2mgo 1 . 9 . 1173 . 1 1 7 PRO HB3 H -5.514 4.066 -2.951 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HB3 . . . . . . . . . c19595_2mgo 1 . 9 . 1174 . 1 1 7 PRO HD2 H -1.650 3.739 -2.986 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HD2 . . . . . . . . . c19595_2mgo 1 . 9 . 1175 . 1 1 7 PRO HD3 H -1.945 3.178 -1.321 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HD3 . . . . . . . . . c19595_2mgo 1 . 9 . 1176 . 1 1 7 PRO HG2 H -3.218 5.305 -2.287 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HG2 . . . . . . . . . c19595_2mgo 1 . 9 . 1177 . 1 1 7 PRO HG3 H -4.019 4.155 -1.203 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HG3 . . . . . . . . . c19595_2mgo 1 . 9 . 1178 . 1 1 7 PRO N N -3.010 2.125 -2.812 . . . 1.0 . . . . . . . . . . . . A . 7 PRO N . . . . . . . . . c19595_2mgo 1 . 9 . 1179 . 1 1 7 PRO O O -3.237 2.804 -5.661 . . . 1.0 . . . . . . . . . . . . A . 7 PRO O . . . . . . . . . c19595_2mgo 1 . 9 . 1180 . 1 1 8 LEU C C -5.816 1.498 -7.735 . . . 1.0 . . . . . . . . . . . . A . 8 LEU C . . . . . . . . . c19595_2mgo 1 . 9 . 1181 . 1 1 8 LEU CA C -4.702 0.868 -6.935 . . . 1.0 . . . . . . . . . . . . A . 8 LEU CA . . . . . . . . . c19595_2mgo 1 . 9 . 1182 . 1 1 8 LEU CB C -4.708 -0.637 -7.097 . . . 1.0 . . . . . . . . . . . . A . 8 LEU CB . . . . . . . . . c19595_2mgo 1 . 9 . 1183 . 1 1 8 LEU CD1 C -3.665 -2.887 -6.702 . . . 1.0 . . . . . . . . . . . . A . 8 LEU CD1 . . . . . . . . . c19595_2mgo 1 . 9 . 1184 . 1 1 8 LEU CD2 C -2.196 -0.905 -7.078 . . . 1.0 . . . . . . . . . . . . A . 8 LEU CD2 . . . . . . . . . c19595_2mgo 1 . 9 . 1185 . 1 1 8 LEU CG C -3.516 -1.393 -6.489 . . . 1.0 . . . . . . . . . . . . A . 8 LEU CG . . . . . . . . . c19595_2mgo 1 . 9 . 1186 . 1 1 8 LEU H H -5.449 0.756 -4.956 . . . 1.0 . . . . . . . . . . . . A . 8 LEU H . . . . . . . . . c19595_2mgo 1 . 9 . 1187 . 1 1 8 LEU HA H -3.773 1.265 -7.302 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HA . . . . . . . . . c19595_2mgo 1 . 9 . 1188 . 1 1 8 LEU HB2 H -5.617 -1.005 -6.641 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HB2 . . . . . . . . . c19595_2mgo 1 . 9 . 1189 . 1 1 8 LEU HB3 H -4.756 -0.823 -8.156 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HB3 . . . . . . . . . c19595_2mgo 1 . 9 . 1190 . 1 1 8 LEU HD11 H -4.570 -3.230 -6.223 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HD11 . . . . . . . . . c19595_2mgo 1 . 9 . 1191 . 1 1 8 LEU HD12 H -2.818 -3.401 -6.276 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HD12 . . . . . . . . . c19595_2mgo 1 . 9 . 1192 . 1 1 8 LEU HD13 H -3.720 -3.096 -7.760 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HD13 . . . . . . . . . c19595_2mgo 1 . 9 . 1193 . 1 1 8 LEU HD21 H -1.381 -1.474 -6.655 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HD21 . . . . . . . . . c19595_2mgo 1 . 9 . 1194 . 1 1 8 LEU HD22 H -2.060 0.142 -6.850 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HD22 . . . . . . . . . c19595_2mgo 1 . 9 . 1195 . 1 1 8 LEU HD23 H -2.210 -1.037 -8.149 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HD23 . . . . . . . . . c19595_2mgo 1 . 9 . 1196 . 1 1 8 LEU HG H -3.501 -1.214 -5.424 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HG . . . . . . . . . c19595_2mgo 1 . 9 . 1197 . 1 1 8 LEU N N -4.807 1.230 -5.529 . . . 1.0 . . . . . . . . . . . . A . 8 LEU N . . . . . . . . . c19595_2mgo 1 . 9 . 1198 . 1 1 8 LEU O O -5.942 1.315 -8.953 . . . 1.0 . . . . . . . . . . . . A . 8 LEU O . . . . . . . . . c19595_2mgo 1 . 9 . 1199 . 1 1 9 GLY C C -8.635 3.182 -6.486 . . . 1.0 . . . . . . . . . . . . A . 9 GLY C . . . . . . . . . c19595_2mgo 1 . 9 . 1200 . 1 1 9 GLY CA C -7.677 2.914 -7.584 . . . 1.0 . . . . . . . . . . . . A . 9 GLY CA . . . . . . . . . c19595_2mgo 1 . 9 . 1201 . 1 1 9 GLY H H -6.350 2.288 -6.100 . . . 1.0 . . . . . . . . . . . . A . 9 GLY H . . . . . . . . . c19595_2mgo 1 . 9 . 1202 . 1 1 9 GLY HA2 H -7.351 3.842 -8.027 . . . 1.0 . . . . . . . . . . . . A . 9 GLY HA2 . . . . . . . . . c19595_2mgo 1 . 9 . 1203 . 1 1 9 GLY HA3 H -8.162 2.300 -8.328 . . . 1.0 . . . . . . . . . . . . A . 9 GLY HA3 . . . . . . . . . c19595_2mgo 1 . 9 . 1204 . 1 1 9 GLY N N -6.570 2.225 -7.049 . . . 1.0 . . . . . . . . . . . . A . 9 GLY N . . . . . . . . . c19595_2mgo 1 . 9 . 1205 . 1 1 9 GLY O O -8.190 3.305 -5.333 . . . 1.0 . . . . . . . . . . . . A . 9 GLY O . . . . . . . . . c19595_2mgo 1 . 9 . 1206 . 1 1 9 GLY OXT O -9.846 3.233 -6.734 . . . 1.0 . . . . . . . . . . . . A . 9 GLY OXT . . . . . . . . . c19595_2mgo 1 . 10 . 1207 . 1 1 1 CYS C C 4.734 0.437 -0.682 . . . 1.0 . . . . . . . . . . . . A . 1 CYS C . . . . . . . . . c19595_2mgo 1 . 10 . 1208 . 1 1 1 CYS CA C 4.732 1.497 0.397 . . . 1.0 . . . . . . . . . . . . A . 1 CYS CA . . . . . . . . . c19595_2mgo 1 . 10 . 1209 . 1 1 1 CYS CB C 3.304 1.730 0.894 . . . 1.0 . . . . . . . . . . . . A . 1 CYS CB . . . . . . . . . c19595_2mgo 1 . 10 . 1210 . 1 1 1 CYS H1 H 6.266 2.578 -0.438 . . . 1.0 . . . . . . . . . . . . A . 1 CYS H1 . . . . . . . . . c19595_2mgo 1 . 10 . 1211 . 1 1 1 CYS H2 H 5.251 3.503 0.546 . . . 1.0 . . . . . . . . . . . . A . 1 CYS H2 . . . . . . . . . c19595_2mgo 1 . 10 . 1212 . 1 1 1 CYS H3 H 4.739 2.995 -0.988 . . . 1.0 . . . . . . . . . . . . A . 1 CYS H3 . . . . . . . . . c19595_2mgo 1 . 10 . 1213 . 1 1 1 CYS HA H 5.351 1.167 1.217 . . . 1.0 . . . . . . . . . . . . A . 1 CYS HA . . . . . . . . . c19595_2mgo 1 . 10 . 1214 . 1 1 1 CYS HB2 H 2.908 0.796 1.262 . . . 1.0 . . . . . . . . . . . . A . 1 CYS HB2 . . . . . . . . . c19595_2mgo 1 . 10 . 1215 . 1 1 1 CYS HB3 H 3.310 2.449 1.697 . . . 1.0 . . . . . . . . . . . . A . 1 CYS HB3 . . . . . . . . . c19595_2mgo 1 . 10 . 1216 . 1 1 1 CYS N N 5.281 2.727 -0.143 . . . 1.0 . . . . . . . . . . . . A . 1 CYS N . . . . . . . . . c19595_2mgo 1 . 10 . 1217 . 1 1 1 CYS O O 4.739 0.762 -1.871 . . . 1.0 . . . . . . . . . . . . A . 1 CYS O . . . . . . . . . c19595_2mgo 1 . 10 . 1218 . 1 1 1 CYS SG S 2.153 2.332 -0.385 . . . 1.0 . . . . . . . . . . . . A . 1 CYS SG . . . . . . . . . c19595_2mgo 1 . 10 . 1219 . 1 1 2 TYR C C 3.642 -2.929 -0.829 . . . 1.0 . . . . . . . . . . . . A . 2 TYR C . . . . . . . . . c19595_2mgo 1 . 10 . 1220 . 1 1 2 TYR CA C 4.719 -1.906 -1.238 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CA . . . . . . . . . c19595_2mgo 1 . 10 . 1221 . 1 1 2 TYR CB C 6.133 -2.536 -1.377 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CB . . . . . . . . . c19595_2mgo 1 . 10 . 1222 . 1 1 2 TYR CD1 C 6.076 -3.377 -3.773 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CD1 . . . . . . . . . c19595_2mgo 1 . 10 . 1223 . 1 1 2 TYR CD2 C 6.548 -4.942 -2.045 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CD2 . . . . . . . . . c19595_2mgo 1 . 10 . 1224 . 1 1 2 TYR CE1 C 6.179 -4.384 -4.714 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CE1 . . . . . . . . . c19595_2mgo 1 . 10 . 1225 . 1 1 2 TYR CE2 C 6.651 -5.951 -2.975 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CE2 . . . . . . . . . c19595_2mgo 1 . 10 . 1226 . 1 1 2 TYR CG C 6.260 -3.638 -2.421 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CG . . . . . . . . . c19595_2mgo 1 . 10 . 1227 . 1 1 2 TYR CZ C 6.466 -5.671 -4.306 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CZ . . . . . . . . . c19595_2mgo 1 . 10 . 1228 . 1 1 2 TYR H H 4.825 -1.029 0.671 . . . 1.0 . . . . . . . . . . . . A . 2 TYR H . . . . . . . . . c19595_2mgo 1 . 10 . 1229 . 1 1 2 TYR HA H 4.424 -1.482 -2.185 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HA . . . . . . . . . c19595_2mgo 1 . 10 . 1230 . 1 1 2 TYR HB2 H 6.835 -1.760 -1.641 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HB2 . . . . . . . . . c19595_2mgo 1 . 10 . 1231 . 1 1 2 TYR HB3 H 6.415 -2.945 -0.419 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HB3 . . . . . . . . . c19595_2mgo 1 . 10 . 1232 . 1 1 2 TYR HD1 H 5.852 -2.368 -4.091 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HD1 . . . . . . . . . c19595_2mgo 1 . 10 . 1233 . 1 1 2 TYR HD2 H 6.695 -5.166 -1.000 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HD2 . . . . . . . . . c19595_2mgo 1 . 10 . 1234 . 1 1 2 TYR HE1 H 6.032 -4.155 -5.761 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HE1 . . . . . . . . . c19595_2mgo 1 . 10 . 1235 . 1 1 2 TYR HE2 H 6.876 -6.957 -2.652 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HE2 . . . . . . . . . c19595_2mgo 1 . 10 . 1236 . 1 1 2 TYR HH H 7.124 -6.359 -5.955 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HH . . . . . . . . . c19595_2mgo 1 . 10 . 1237 . 1 1 2 TYR N N 4.755 -0.818 -0.287 . . . 1.0 . . . . . . . . . . . . A . 2 TYR N . . . . . . . . . c19595_2mgo 1 . 10 . 1238 . 1 1 2 TYR O O 3.499 -3.991 -1.425 . . . 1.0 . . . . . . . . . . . . A . 2 TYR O . . . . . . . . . c19595_2mgo 1 . 10 . 1239 . 1 1 2 TYR OH O 6.565 -6.681 -5.233 . . . 1.0 . . . . . . . . . . . . A . 2 TYR OH . . . . . . . . . c19595_2mgo 1 . 10 . 1240 . 1 1 3 ILE C C 0.535 -3.051 -0.120 . . . 1.0 . . . . . . . . . . . . A . 3 ILE C . . . . . . . . . c19595_2mgo 1 . 10 . 1241 . 1 1 3 ILE CA C 1.794 -3.411 0.618 . . . 1.0 . . . . . . . . . . . . A . 3 ILE CA . . . . . . . . . c19595_2mgo 1 . 10 . 1242 . 1 1 3 ILE CB C 1.571 -3.272 2.147 . . . 1.0 . . . . . . . . . . . . A . 3 ILE CB . . . . . . . . . c19595_2mgo 1 . 10 . 1243 . 1 1 3 ILE CD1 C 1.083 -1.574 4.016 . . . 1.0 . . . . . . . . . . . . A . 3 ILE CD1 . . . . . . . . . c19595_2mgo 1 . 10 . 1244 . 1 1 3 ILE CG1 C 1.322 -1.795 2.537 . . . 1.0 . . . . . . . . . . . . A . 3 ILE CG1 . . . . . . . . . c19595_2mgo 1 . 10 . 1245 . 1 1 3 ILE CG2 C 2.748 -3.864 2.910 . . . 1.0 . . . . . . . . . . . . A . 3 ILE CG2 . . . . . . . . . c19595_2mgo 1 . 10 . 1246 . 1 1 3 ILE H H 2.915 -1.697 0.566 . . . 1.0 . . . . . . . . . . . . A . 3 ILE H . . . . . . . . . c19595_2mgo 1 . 10 . 1247 . 1 1 3 ILE HA H 2.054 -4.435 0.392 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HA . . . . . . . . . c19595_2mgo 1 . 10 . 1248 . 1 1 3 ILE HB H 0.695 -3.851 2.401 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HB . . . . . . . . . c19595_2mgo 1 . 10 . 1249 . 1 1 3 ILE HD11 H 1.943 -1.912 4.573 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HD11 . . . . . . . . . c19595_2mgo 1 . 10 . 1250 . 1 1 3 ILE HD12 H 0.211 -2.130 4.328 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HD12 . . . . . . . . . c19595_2mgo 1 . 10 . 1251 . 1 1 3 ILE HD13 H 0.924 -0.521 4.200 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HD13 . . . . . . . . . c19595_2mgo 1 . 10 . 1252 . 1 1 3 ILE HG12 H 2.176 -1.201 2.251 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HG12 . . . . . . . . . c19595_2mgo 1 . 10 . 1253 . 1 1 3 ILE HG13 H 0.454 -1.437 2.002 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HG13 . . . . . . . . . c19595_2mgo 1 . 10 . 1254 . 1 1 3 ILE HG21 H 3.657 -3.362 2.615 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HG21 . . . . . . . . . c19595_2mgo 1 . 10 . 1255 . 1 1 3 ILE HG22 H 2.830 -4.919 2.690 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HG22 . . . . . . . . . c19595_2mgo 1 . 10 . 1256 . 1 1 3 ILE HG23 H 2.591 -3.727 3.969 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HG23 . . . . . . . . . c19595_2mgo 1 . 10 . 1257 . 1 1 3 ILE N N 2.850 -2.573 0.150 . . . 1.0 . . . . . . . . . . . . A . 3 ILE N . . . . . . . . . c19595_2mgo 1 . 10 . 1258 . 1 1 3 ILE O O 0.454 -1.993 -0.739 . . . 1.0 . . . . . . . . . . . . A . 3 ILE O . . . . . . . . . c19595_2mgo 1 . 10 . 1259 . 1 1 4 GLN C C -2.701 -2.900 0.049 . . . 1.0 . . . . . . . . . . . . A . 4 GLN C . . . . . . . . . c19595_2mgo 1 . 10 . 1260 . 1 1 4 GLN CA C -1.683 -3.687 -0.763 . . . 1.0 . . . . . . . . . . . . A . 4 GLN CA . . . . . . . . . c19595_2mgo 1 . 10 . 1261 . 1 1 4 GLN CB C -2.276 -5.029 -1.231 . . . 1.0 . . . . . . . . . . . . A . 4 GLN CB . . . . . . . . . c19595_2mgo 1 . 10 . 1262 . 1 1 4 GLN CD C -3.120 -7.339 -0.653 . . . 1.0 . . . . . . . . . . . . A . 4 GLN CD . . . . . . . . . c19595_2mgo 1 . 10 . 1263 . 1 1 4 GLN CG C -2.677 -5.990 -0.119 . . . 1.0 . . . . . . . . . . . . A . 4 GLN CG . . . . . . . . . c19595_2mgo 1 . 10 . 1264 . 1 1 4 GLN H H -0.266 -4.649 0.558 . . . 1.0 . . . . . . . . . . . . A . 4 GLN H . . . . . . . . . c19595_2mgo 1 . 10 . 1265 . 1 1 4 GLN HA H -1.441 -3.099 -1.635 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HA . . . . . . . . . c19595_2mgo 1 . 10 . 1266 . 1 1 4 GLN HB2 H -3.155 -4.827 -1.825 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HB2 . . . . . . . . . c19595_2mgo 1 . 10 . 1267 . 1 1 4 GLN HB3 H -1.547 -5.521 -1.855 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HB3 . . . . . . . . . c19595_2mgo 1 . 10 . 1268 . 1 1 4 GLN HE21 H -4.314 -7.628 0.902 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HE21 . . . . . . . . . c19595_2mgo 1 . 10 . 1269 . 1 1 4 GLN HE22 H -4.261 -8.888 -0.271 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HE22 . . . . . . . . . c19595_2mgo 1 . 10 . 1270 . 1 1 4 GLN HG2 H -1.833 -6.138 0.535 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HG2 . . . . . . . . . c19595_2mgo 1 . 10 . 1271 . 1 1 4 GLN HG3 H -3.491 -5.555 0.442 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HG3 . . . . . . . . . c19595_2mgo 1 . 10 . 1272 . 1 1 4 GLN N N -0.432 -3.882 -0.029 . . . 1.0 . . . . . . . . . . . . A . 4 GLN N . . . . . . . . . c19595_2mgo 1 . 10 . 1273 . 1 1 4 GLN NE2 N -3.983 -8.008 0.060 . . . 1.0 . . . . . . . . . . . . A . 4 GLN NE2 . . . . . . . . . c19595_2mgo 1 . 10 . 1274 . 1 1 4 GLN O O -3.864 -2.821 -0.320 . . . 1.0 . . . . . . . . . . . . A . 4 GLN O . . . . . . . . . c19595_2mgo 1 . 10 . 1275 . 1 1 4 GLN OE1 O -2.664 -7.784 -1.701 . . . 1.0 . . . . . . . . . . . . A . 4 GLN OE1 . . . . . . . . . c19595_2mgo 1 . 10 . 1276 . 1 1 5 ASN C C -2.364 -0.350 2.540 . . . 1.0 . . . . . . . . . . . . A . 5 ASN C . . . . . . . . . c19595_2mgo 1 . 10 . 1277 . 1 1 5 ASN CA C -3.135 -1.510 1.959 . . . 1.0 . . . . . . . . . . . . A . 5 ASN CA . . . . . . . . . c19595_2mgo 1 . 10 . 1278 . 1 1 5 ASN CB C -3.800 -2.363 3.062 . . . 1.0 . . . . . . . . . . . . A . 5 ASN CB . . . . . . . . . c19595_2mgo 1 . 10 . 1279 . 1 1 5 ASN CG C -4.883 -1.601 3.823 . . . 1.0 . . . . . . . . . . . . A . 5 ASN CG . . . . . . . . . c19595_2mgo 1 . 10 . 1280 . 1 1 5 ASN H H -1.300 -2.304 1.315 . . . 1.0 . . . . . . . . . . . . A . 5 ASN H . . . . . . . . . c19595_2mgo 1 . 10 . 1281 . 1 1 5 ASN HA H -3.900 -1.103 1.313 . . . 1.0 . . . . . . . . . . . . A . 5 ASN HA . . . . . . . . . c19595_2mgo 1 . 10 . 1282 . 1 1 5 ASN HB2 H -4.252 -3.234 2.612 . . . 1.0 . . . . . . . . . . . . A . 5 ASN HB2 . . . . . . . . . c19595_2mgo 1 . 10 . 1283 . 1 1 5 ASN HB3 H -3.045 -2.680 3.765 . . . 1.0 . . . . . . . . . . . . A . 5 ASN HB3 . . . . . . . . . c19595_2mgo 1 . 10 . 1284 . 1 1 5 ASN HD21 H -6.255 -2.209 2.535 . . . 1.0 . . . . . . . . . . . . A . 5 ASN HD21 . . . . . . . . . c19595_2mgo 1 . 10 . 1285 . 1 1 5 ASN HD22 H -6.815 -1.194 3.804 . . . 1.0 . . . . . . . . . . . . A . 5 ASN HD22 . . . . . . . . . c19595_2mgo 1 . 10 . 1286 . 1 1 5 ASN N N -2.258 -2.288 1.116 . . . 1.0 . . . . . . . . . . . . A . 5 ASN N . . . . . . . . . c19595_2mgo 1 . 10 . 1287 . 1 1 5 ASN ND2 N -6.094 -1.675 3.344 . . . 1.0 . . . . . . . . . . . . A . 5 ASN ND2 . . . . . . . . . c19595_2mgo 1 . 10 . 1288 . 1 1 5 ASN O O -1.977 -0.343 3.710 . . . 1.0 . . . . . . . . . . . . A . 5 ASN O . . . . . . . . . c19595_2mgo 1 . 10 . 1289 . 1 1 5 ASN OD1 O -4.625 -0.963 4.836 . . . 1.0 . . . . . . . . . . . . A . 5 ASN OD1 . . . . . . . . . c19595_2mgo 1 . 10 . 1290 . 1 1 6 CYS C C -2.243 2.760 2.678 . . . 1.0 . . . . . . . . . . . . A . 6 CYS C . . . . . . . . . c19595_2mgo 1 . 10 . 1291 . 1 1 6 CYS CA C -1.298 1.745 2.031 . . . 1.0 . . . . . . . . . . . . A . 6 CYS CA . . . . . . . . . c19595_2mgo 1 . 10 . 1292 . 1 1 6 CYS CB C -0.652 2.353 0.787 . . . 1.0 . . . . . . . . . . . . A . 6 CYS CB . . . . . . . . . c19595_2mgo 1 . 10 . 1293 . 1 1 6 CYS H H -2.232 0.374 0.730 . . . 1.0 . . . . . . . . . . . . A . 6 CYS H . . . . . . . . . c19595_2mgo 1 . 10 . 1294 . 1 1 6 CYS HA H -0.520 1.473 2.728 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HA . . . . . . . . . c19595_2mgo 1 . 10 . 1295 . 1 1 6 CYS HB2 H -1.427 2.638 0.093 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HB2 . . . . . . . . . c19595_2mgo 1 . 10 . 1296 . 1 1 6 CYS HB3 H -0.088 3.230 1.072 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HB3 . . . . . . . . . c19595_2mgo 1 . 10 . 1297 . 1 1 6 CYS N N -2.016 0.544 1.672 . . . 1.0 . . . . . . . . . . . . A . 6 CYS N . . . . . . . . . c19595_2mgo 1 . 10 . 1298 . 1 1 6 CYS O O -3.262 3.138 2.077 . . . 1.0 . . . . . . . . . . . . A . 6 CYS O . . . . . . . . . c19595_2mgo 1 . 10 . 1299 . 1 1 6 CYS SG S 0.483 1.219 -0.087 . . . 1.0 . . . . . . . . . . . . A . 6 CYS SG . . . . . . . . . c19595_2mgo 1 . 10 . 1300 . 1 1 7 PRO C C -2.730 5.503 3.860 . . . 1.0 . . . . . . . . . . . . A . 7 PRO C . . . . . . . . . c19595_2mgo 1 . 10 . 1301 . 1 1 7 PRO CA C -2.737 4.182 4.628 . . . 1.0 . . . . . . . . . . . . A . 7 PRO CA . . . . . . . . . c19595_2mgo 1 . 10 . 1302 . 1 1 7 PRO CB C -1.997 4.352 5.959 . . . 1.0 . . . . . . . . . . . . A . 7 PRO CB . . . . . . . . . c19595_2mgo 1 . 10 . 1303 . 1 1 7 PRO CD C -0.870 2.641 4.776 . . . 1.0 . . . . . . . . . . . . A . 7 PRO CD . . . . . . . . . c19595_2mgo 1 . 10 . 1304 . 1 1 7 PRO CG C -1.258 3.082 6.146 . . . 1.0 . . . . . . . . . . . . A . 7 PRO CG . . . . . . . . . c19595_2mgo 1 . 10 . 1305 . 1 1 7 PRO HA H -3.753 3.863 4.804 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HA . . . . . . . . . c19595_2mgo 1 . 10 . 1306 . 1 1 7 PRO HB2 H -1.325 5.194 5.887 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HB2 . . . . . . . . . c19595_2mgo 1 . 10 . 1307 . 1 1 7 PRO HB3 H -2.706 4.517 6.754 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HB3 . . . . . . . . . c19595_2mgo 1 . 10 . 1308 . 1 1 7 PRO HD2 H 0.074 3.081 4.501 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HD2 . . . . . . . . . c19595_2mgo 1 . 10 . 1309 . 1 1 7 PRO HD3 H -0.825 1.563 4.729 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HD3 . . . . . . . . . c19595_2mgo 1 . 10 . 1310 . 1 1 7 PRO HG2 H -0.379 3.252 6.751 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HG2 . . . . . . . . . c19595_2mgo 1 . 10 . 1311 . 1 1 7 PRO HG3 H -1.896 2.347 6.612 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HG3 . . . . . . . . . c19595_2mgo 1 . 10 . 1312 . 1 1 7 PRO N N -1.958 3.164 3.930 . . . 1.0 . . . . . . . . . . . . A . 7 PRO N . . . . . . . . . c19595_2mgo 1 . 10 . 1313 . 1 1 7 PRO O O -1.671 6.052 3.544 . . . 1.0 . . . . . . . . . . . . A . 7 PRO O . . . . . . . . . c19595_2mgo 1 . 10 . 1314 . 1 1 8 LEU C C -4.296 8.386 3.758 . . . 1.0 . . . . . . . . . . . . A . 8 LEU C . . . . . . . . . c19595_2mgo 1 . 10 . 1315 . 1 1 8 LEU CA C -4.063 7.235 2.808 . . . 1.0 . . . . . . . . . . . . A . 8 LEU CA . . . . . . . . . c19595_2mgo 1 . 10 . 1316 . 1 1 8 LEU CB C -5.220 7.122 1.847 . . . 1.0 . . . . . . . . . . . . A . 8 LEU CB . . . . . . . . . c19595_2mgo 1 . 10 . 1317 . 1 1 8 LEU CD1 C -6.346 6.057 -0.132 . . . 1.0 . . . . . . . . . . . . A . 8 LEU CD1 . . . . . . . . . c19595_2mgo 1 . 10 . 1318 . 1 1 8 LEU CD2 C -3.860 6.326 -0.129 . . . 1.0 . . . . . . . . . . . . A . 8 LEU CD2 . . . . . . . . . c19595_2mgo 1 . 10 . 1319 . 1 1 8 LEU CG C -5.095 6.073 0.730 . . . 1.0 . . . . . . . . . . . . A . 8 LEU CG . . . . . . . . . c19595_2mgo 1 . 10 . 1320 . 1 1 8 LEU H H -4.712 5.501 3.815 . . . 1.0 . . . . . . . . . . . . A . 8 LEU H . . . . . . . . . c19595_2mgo 1 . 10 . 1321 . 1 1 8 LEU HA H -3.156 7.417 2.258 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HA . . . . . . . . . c19595_2mgo 1 . 10 . 1322 . 1 1 8 LEU HB2 H -6.105 6.906 2.430 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HB2 . . . . . . . . . c19595_2mgo 1 . 10 . 1323 . 1 1 8 LEU HB3 H -5.317 8.104 1.424 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HB3 . . . . . . . . . c19595_2mgo 1 . 10 . 1324 . 1 1 8 LEU HD11 H -7.203 5.815 0.478 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HD11 . . . . . . . . . c19595_2mgo 1 . 10 . 1325 . 1 1 8 LEU HD12 H -6.238 5.315 -0.910 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HD12 . . . . . . . . . c19595_2mgo 1 . 10 . 1326 . 1 1 8 LEU HD13 H -6.487 7.029 -0.581 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HD13 . . . . . . . . . c19595_2mgo 1 . 10 . 1327 . 1 1 8 LEU HD21 H -2.971 6.252 0.477 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HD21 . . . . . . . . . c19595_2mgo 1 . 10 . 1328 . 1 1 8 LEU HD22 H -3.922 7.312 -0.564 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HD22 . . . . . . . . . c19595_2mgo 1 . 10 . 1329 . 1 1 8 LEU HD23 H -3.818 5.591 -0.919 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HD23 . . . . . . . . . c19595_2mgo 1 . 10 . 1330 . 1 1 8 LEU HG H -5.000 5.095 1.182 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HG . . . . . . . . . c19595_2mgo 1 . 10 . 1331 . 1 1 8 LEU N N -3.904 5.990 3.550 . . . 1.0 . . . . . . . . . . . . A . 8 LEU N . . . . . . . . . c19595_2mgo 1 . 10 . 1332 . 1 1 8 LEU O O -4.623 9.510 3.364 . . . 1.0 . . . . . . . . . . . . A . 8 LEU O . . . . . . . . . c19595_2mgo 1 . 10 . 1333 . 1 1 9 GLY C C -3.972 8.285 7.321 . . . 1.0 . . . . . . . . . . . . A . 9 GLY C . . . . . . . . . c19595_2mgo 1 . 10 . 1334 . 1 1 9 GLY CA C -4.272 9.000 6.048 . . . 1.0 . . . . . . . . . . . . A . 9 GLY CA . . . . . . . . . c19595_2mgo 1 . 10 . 1335 . 1 1 9 GLY H H -3.876 7.154 5.140 . . . 1.0 . . . . . . . . . . . . A . 9 GLY H . . . . . . . . . c19595_2mgo 1 . 10 . 1336 . 1 1 9 GLY HA2 H -3.589 9.824 5.914 . . . 1.0 . . . . . . . . . . . . A . 9 GLY HA2 . . . . . . . . . c19595_2mgo 1 . 10 . 1337 . 1 1 9 GLY HA3 H -5.288 9.362 6.082 . . . 1.0 . . . . . . . . . . . . A . 9 GLY HA3 . . . . . . . . . c19595_2mgo 1 . 10 . 1338 . 1 1 9 GLY N N -4.127 8.083 4.974 . . . 1.0 . . . . . . . . . . . . A . 9 GLY N . . . . . . . . . c19595_2mgo 1 . 10 . 1339 . 1 1 9 GLY O O -4.515 8.641 8.383 . . . 1.0 . . . . . . . . . . . . A . 9 GLY O . . . . . . . . . c19595_2mgo 1 . 10 . 1340 . 1 1 9 GLY OXT O -3.213 7.303 7.271 . . . 1.0 . . . . . . . . . . . . A . 9 GLY OXT . . . . . . . . . c19595_2mgo 1 . 11 . 1341 . 1 1 1 CYS C C 4.502 -0.066 -0.686 . . . 1.0 . . . . . . . . . . . . A . 1 CYS C . . . . . . . . . c19595_2mgo 1 . 11 . 1342 . 1 1 1 CYS CA C 3.955 1.118 0.091 . . . 1.0 . . . . . . . . . . . . A . 1 CYS CA . . . . . . . . . c19595_2mgo 1 . 11 . 1343 . 1 1 1 CYS CB C 2.572 0.731 0.606 . . . 1.0 . . . . . . . . . . . . A . 1 CYS CB . . . . . . . . . c19595_2mgo 1 . 11 . 1344 . 1 1 1 CYS H1 H 4.755 2.499 -1.218 . . . 1.0 . . . . . . . . . . . . A . 1 CYS H1 . . . . . . . . . c19595_2mgo 1 . 11 . 1345 . 1 1 1 CYS H2 H 3.427 3.073 -0.332 . . . 1.0 . . . . . . . . . . . . A . 1 CYS H2 . . . . . . . . . c19595_2mgo 1 . 11 . 1346 . 1 1 1 CYS H3 H 3.204 1.988 -1.602 . . . 1.0 . . . . . . . . . . . . A . 1 CYS H3 . . . . . . . . . c19595_2mgo 1 . 11 . 1347 . 1 1 1 CYS HA H 4.599 1.363 0.921 . . . 1.0 . . . . . . . . . . . . A . 1 CYS HA . . . . . . . . . c19595_2mgo 1 . 11 . 1348 . 1 1 1 CYS HB2 H 2.011 0.294 -0.207 . . . 1.0 . . . . . . . . . . . . A . 1 CYS HB2 . . . . . . . . . c19595_2mgo 1 . 11 . 1349 . 1 1 1 CYS HB3 H 2.678 -0.016 1.375 . . . 1.0 . . . . . . . . . . . . A . 1 CYS HB3 . . . . . . . . . c19595_2mgo 1 . 11 . 1350 . 1 1 1 CYS N N 3.833 2.247 -0.815 . . . 1.0 . . . . . . . . . . . . A . 1 CYS N . . . . . . . . . c19595_2mgo 1 . 11 . 1351 . 1 1 1 CYS O O 4.563 -0.019 -1.914 . . . 1.0 . . . . . . . . . . . . A . 1 CYS O . . . . . . . . . c19595_2mgo 1 . 11 . 1352 . 1 1 1 CYS SG S 1.559 2.077 1.276 . . . 1.0 . . . . . . . . . . . . A . 1 CYS SG . . . . . . . . . c19595_2mgo 1 . 11 . 1353 . 1 1 2 TYR C C 4.117 -3.320 -0.574 . . . 1.0 . . . . . . . . . . . . A . 2 TYR C . . . . . . . . . c19595_2mgo 1 . 11 . 1354 . 1 1 2 TYR CA C 5.293 -2.357 -0.660 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CA . . . . . . . . . c19595_2mgo 1 . 11 . 1355 . 1 1 2 TYR CB C 6.589 -2.968 -0.097 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CB . . . . . . . . . c19595_2mgo 1 . 11 . 1356 . 1 1 2 TYR CD1 C 6.934 -2.353 2.327 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CD1 . . . . . . . . . c19595_2mgo 1 . 11 . 1357 . 1 1 2 TYR CD2 C 6.197 -4.553 1.832 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CD2 . . . . . . . . . c19595_2mgo 1 . 11 . 1358 . 1 1 2 TYR CE1 C 6.931 -2.647 3.669 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CE1 . . . . . . . . . c19595_2mgo 1 . 11 . 1359 . 1 1 2 TYR CE2 C 6.186 -4.854 3.174 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CE2 . . . . . . . . . c19595_2mgo 1 . 11 . 1360 . 1 1 2 TYR CG C 6.567 -3.296 1.384 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CG . . . . . . . . . c19595_2mgo 1 . 11 . 1361 . 1 1 2 TYR CZ C 6.553 -3.896 4.086 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CZ . . . . . . . . . c19595_2mgo 1 . 11 . 1362 . 1 1 2 TYR H H 5.035 -1.055 0.985 . . . 1.0 . . . . . . . . . . . . A . 2 TYR H . . . . . . . . . c19595_2mgo 1 . 11 . 1363 . 1 1 2 TYR HA H 5.417 -2.107 -1.701 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HA . . . . . . . . . c19595_2mgo 1 . 11 . 1364 . 1 1 2 TYR HB2 H 6.786 -3.889 -0.622 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HB2 . . . . . . . . . c19595_2mgo 1 . 11 . 1365 . 1 1 2 TYR HB3 H 7.405 -2.284 -0.277 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HB3 . . . . . . . . . c19595_2mgo 1 . 11 . 1366 . 1 1 2 TYR HD1 H 7.229 -1.367 1.998 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HD1 . . . . . . . . . c19595_2mgo 1 . 11 . 1367 . 1 1 2 TYR HD2 H 5.909 -5.305 1.112 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HD2 . . . . . . . . . c19595_2mgo 1 . 11 . 1368 . 1 1 2 TYR HE1 H 7.221 -1.889 4.380 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HE1 . . . . . . . . . c19595_2mgo 1 . 11 . 1369 . 1 1 2 TYR HE2 H 5.884 -5.838 3.502 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HE2 . . . . . . . . . c19595_2mgo 1 . 11 . 1370 . 1 1 2 TYR HH H 5.902 -3.669 5.864 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HH . . . . . . . . . c19595_2mgo 1 . 11 . 1371 . 1 1 2 TYR N N 4.928 -1.113 0.011 . . . 1.0 . . . . . . . . . . . . A . 2 TYR N . . . . . . . . . c19595_2mgo 1 . 11 . 1372 . 1 1 2 TYR O O 4.090 -4.392 -1.181 . . . 1.0 . . . . . . . . . . . . A . 2 TYR O . . . . . . . . . c19595_2mgo 1 . 11 . 1373 . 1 1 2 TYR OH O 6.573 -4.206 5.421 . . . 1.0 . . . . . . . . . . . . A . 2 TYR OH . . . . . . . . . c19595_2mgo 1 . 11 . 1374 . 1 1 3 ILE C C 0.894 -2.713 -0.354 . . . 1.0 . . . . . . . . . . . . A . 3 ILE C . . . . . . . . . c19595_2mgo 1 . 11 . 1375 . 1 1 3 ILE CA C 1.916 -3.564 0.362 . . . 1.0 . . . . . . . . . . . . A . 3 ILE CA . . . . . . . . . c19595_2mgo 1 . 11 . 1376 . 1 1 3 ILE CB C 1.516 -3.677 1.858 . . . 1.0 . . . . . . . . . . . . A . 3 ILE CB . . . . . . . . . c19595_2mgo 1 . 11 . 1377 . 1 1 3 ILE CD1 C 0.999 -2.274 3.944 . . . 1.0 . . . . . . . . . . . . A . 3 ILE CD1 . . . . . . . . . c19595_2mgo 1 . 11 . 1378 . 1 1 3 ILE CG1 C 1.506 -2.284 2.525 . . . 1.0 . . . . . . . . . . . . A . 3 ILE CG1 . . . . . . . . . c19595_2mgo 1 . 11 . 1379 . 1 1 3 ILE CG2 C 2.442 -4.639 2.593 . . . 1.0 . . . . . . . . . . . . A . 3 ILE CG2 . . . . . . . . . c19595_2mgo 1 . 11 . 1380 . 1 1 3 ILE H H 3.292 -2.068 0.677 . . . 1.0 . . . . . . . . . . . . A . 3 ILE H . . . . . . . . . c19595_2mgo 1 . 11 . 1381 . 1 1 3 ILE HA H 1.967 -4.548 -0.080 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HA . . . . . . . . . c19595_2mgo 1 . 11 . 1382 . 1 1 3 ILE HB H 0.519 -4.085 1.897 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HB . . . . . . . . . c19595_2mgo 1 . 11 . 1383 . 1 1 3 ILE HD11 H 1.614 -2.922 4.549 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HD11 . . . . . . . . . c19595_2mgo 1 . 11 . 1384 . 1 1 3 ILE HD12 H -0.021 -2.632 3.959 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HD12 . . . . . . . . . c19595_2mgo 1 . 11 . 1385 . 1 1 3 ILE HD13 H 1.036 -1.268 4.334 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HD13 . . . . . . . . . c19595_2mgo 1 . 11 . 1386 . 1 1 3 ILE HG12 H 2.515 -1.904 2.542 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HG12 . . . . . . . . . c19595_2mgo 1 . 11 . 1387 . 1 1 3 ILE HG13 H 0.887 -1.620 1.939 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HG13 . . . . . . . . . c19595_2mgo 1 . 11 . 1388 . 1 1 3 ILE HG21 H 2.145 -4.700 3.629 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HG21 . . . . . . . . . c19595_2mgo 1 . 11 . 1389 . 1 1 3 ILE HG22 H 3.458 -4.278 2.529 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HG22 . . . . . . . . . c19595_2mgo 1 . 11 . 1390 . 1 1 3 ILE HG23 H 2.377 -5.618 2.141 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HG23 . . . . . . . . . c19595_2mgo 1 . 11 . 1391 . 1 1 3 ILE N N 3.162 -2.906 0.200 . . . 1.0 . . . . . . . . . . . . A . 3 ILE N . . . . . . . . . c19595_2mgo 1 . 11 . 1392 . 1 1 3 ILE O O 1.240 -1.671 -0.912 . . . 1.0 . . . . . . . . . . . . A . 3 ILE O . . . . . . . . . c19595_2mgo 1 . 11 . 1393 . 1 1 4 GLN C C -2.460 -1.970 -0.034 . . . 1.0 . . . . . . . . . . . . A . 4 GLN C . . . . . . . . . c19595_2mgo 1 . 11 . 1394 . 1 1 4 GLN CA C -1.343 -2.342 -1.012 . . . 1.0 . . . . . . . . . . . . A . 4 GLN CA . . . . . . . . . c19595_2mgo 1 . 11 . 1395 . 1 1 4 GLN CB C -1.876 -3.154 -2.187 . . . 1.0 . . . . . . . . . . . . A . 4 GLN CB . . . . . . . . . c19595_2mgo 1 . 11 . 1396 . 1 1 4 GLN CD C -3.061 -3.149 -4.390 . . . 1.0 . . . . . . . . . . . . A . 4 GLN CD . . . . . . . . . c19595_2mgo 1 . 11 . 1397 . 1 1 4 GLN CG C -2.572 -2.322 -3.240 . . . 1.0 . . . . . . . . . . . . A . 4 GLN CG . . . . . . . . . c19595_2mgo 1 . 11 . 1398 . 1 1 4 GLN H H -0.511 -3.934 0.156 . . . 1.0 . . . . . . . . . . . . A . 4 GLN H . . . . . . . . . c19595_2mgo 1 . 11 . 1399 . 1 1 4 GLN HA H -0.888 -1.436 -1.383 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HA . . . . . . . . . c19595_2mgo 1 . 11 . 1400 . 1 1 4 GLN HB2 H -1.051 -3.672 -2.652 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HB2 . . . . . . . . . c19595_2mgo 1 . 11 . 1401 . 1 1 4 GLN HB3 H -2.578 -3.884 -1.813 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HB3 . . . . . . . . . c19595_2mgo 1 . 11 . 1402 . 1 1 4 GLN HE21 H -4.818 -3.375 -3.528 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HE21 . . . . . . . . . c19595_2mgo 1 . 11 . 1403 . 1 1 4 GLN HE22 H -4.626 -4.134 -5.068 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HE22 . . . . . . . . . c19595_2mgo 1 . 11 . 1404 . 1 1 4 GLN HG2 H -3.416 -1.830 -2.781 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HG2 . . . . . . . . . c19595_2mgo 1 . 11 . 1405 . 1 1 4 GLN HG3 H -1.881 -1.580 -3.610 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HG3 . . . . . . . . . c19595_2mgo 1 . 11 . 1406 . 1 1 4 GLN N N -0.319 -3.101 -0.325 . . . 1.0 . . . . . . . . . . . . A . 4 GLN N . . . . . . . . . c19595_2mgo 1 . 11 . 1407 . 1 1 4 GLN NE2 N -4.282 -3.599 -4.319 . . . 1.0 . . . . . . . . . . . . A . 4 GLN NE2 . . . . . . . . . c19595_2mgo 1 . 11 . 1408 . 1 1 4 GLN O O -3.527 -1.503 -0.414 . . . 1.0 . . . . . . . . . . . . A . 4 GLN O . . . . . . . . . c19595_2mgo 1 . 11 . 1409 . 1 1 4 GLN OE1 O -2.343 -3.376 -5.358 . . . 1.0 . . . . . . . . . . . . A . 4 GLN OE1 . . . . . . . . . c19595_2mgo 1 . 11 . 1410 . 1 1 5 ASN C C -2.686 -0.592 3.015 . . . 1.0 . . . . . . . . . . . . A . 5 ASN C . . . . . . . . . c19595_2mgo 1 . 11 . 1411 . 1 1 5 ASN CA C -3.150 -1.845 2.284 . . . 1.0 . . . . . . . . . . . . A . 5 ASN CA . . . . . . . . . c19595_2mgo 1 . 11 . 1412 . 1 1 5 ASN CB C -3.250 -3.052 3.242 . . . 1.0 . . . . . . . . . . . . A . 5 ASN CB . . . . . . . . . c19595_2mgo 1 . 11 . 1413 . 1 1 5 ASN CG C -4.475 -2.996 4.156 . . . 1.0 . . . . . . . . . . . . A . 5 ASN CG . . . . . . . . . c19595_2mgo 1 . 11 . 1414 . 1 1 5 ASN H H -1.271 -2.391 1.486 . . . 1.0 . . . . . . . . . . . . A . 5 ASN H . . . . . . . . . c19595_2mgo 1 . 11 . 1415 . 1 1 5 ASN HA H -4.106 -1.656 1.818 . . . 1.0 . . . . . . . . . . . . A . 5 ASN HA . . . . . . . . . c19595_2mgo 1 . 11 . 1416 . 1 1 5 ASN HB2 H -3.304 -3.958 2.659 . . . 1.0 . . . . . . . . . . . . A . 5 ASN HB2 . . . . . . . . . c19595_2mgo 1 . 11 . 1417 . 1 1 5 ASN HB3 H -2.364 -3.083 3.858 . . . 1.0 . . . . . . . . . . . . A . 5 ASN HB3 . . . . . . . . . c19595_2mgo 1 . 11 . 1418 . 1 1 5 ASN HD21 H -5.541 -4.007 2.826 . . . 1.0 . . . . . . . . . . . . A . 5 ASN HD21 . . . . . . . . . c19595_2mgo 1 . 11 . 1419 . 1 1 5 ASN HD22 H -6.370 -3.558 4.256 . . . 1.0 . . . . . . . . . . . . A . 5 ASN HD22 . . . . . . . . . c19595_2mgo 1 . 11 . 1420 . 1 1 5 ASN N N -2.176 -2.123 1.235 . . . 1.0 . . . . . . . . . . . . A . 5 ASN N . . . . . . . . . c19595_2mgo 1 . 11 . 1421 . 1 1 5 ASN ND2 N -5.559 -3.573 3.707 . . . 1.0 . . . . . . . . . . . . A . 5 ASN ND2 . . . . . . . . . c19595_2mgo 1 . 11 . 1422 . 1 1 5 ASN O O -2.601 -0.536 4.239 . . . 1.0 . . . . . . . . . . . . A . 5 ASN O . . . . . . . . . c19595_2mgo 1 . 11 . 1423 . 1 1 5 ASN OD1 O -4.438 -2.447 5.263 . . . 1.0 . . . . . . . . . . . . A . 5 ASN OD1 . . . . . . . . . c19595_2mgo 1 . 11 . 1424 . 1 1 6 CYS C C -2.932 2.410 3.497 . . . 1.0 . . . . . . . . . . . . A . 6 CYS C . . . . . . . . . c19595_2mgo 1 . 11 . 1425 . 1 1 6 CYS CA C -1.851 1.679 2.702 . . . 1.0 . . . . . . . . . . . . A . 6 CYS CA . . . . . . . . . c19595_2mgo 1 . 11 . 1426 . 1 1 6 CYS CB C -1.432 2.540 1.516 . . . 1.0 . . . . . . . . . . . . A . 6 CYS CB . . . . . . . . . c19595_2mgo 1 . 11 . 1427 . 1 1 6 CYS H H -2.418 0.239 1.257 . . . 1.0 . . . . . . . . . . . . A . 6 CYS H . . . . . . . . . c19595_2mgo 1 . 11 . 1428 . 1 1 6 CYS HA H -0.987 1.501 3.324 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HA . . . . . . . . . c19595_2mgo 1 . 11 . 1429 . 1 1 6 CYS HB2 H -2.306 2.796 0.934 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HB2 . . . . . . . . . c19595_2mgo 1 . 11 . 1430 . 1 1 6 CYS HB3 H -0.974 3.446 1.885 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HB3 . . . . . . . . . c19595_2mgo 1 . 11 . 1431 . 1 1 6 CYS N N -2.339 0.394 2.222 . . . 1.0 . . . . . . . . . . . . A . 6 CYS N . . . . . . . . . c19595_2mgo 1 . 11 . 1432 . 1 1 6 CYS O O -4.001 2.716 2.956 . . . 1.0 . . . . . . . . . . . . A . 6 CYS O . . . . . . . . . c19595_2mgo 1 . 11 . 1433 . 1 1 6 CYS SG S -0.243 1.734 0.405 . . . 1.0 . . . . . . . . . . . . A . 6 CYS SG . . . . . . . . . c19595_2mgo 1 . 11 . 1434 . 1 1 7 PRO C C -3.683 4.875 5.205 . . . 1.0 . . . . . . . . . . . . A . 7 PRO C . . . . . . . . . c19595_2mgo 1 . 11 . 1435 . 1 1 7 PRO CA C -3.636 3.407 5.618 . . . 1.0 . . . . . . . . . . . . A . 7 PRO CA . . . . . . . . . c19595_2mgo 1 . 11 . 1436 . 1 1 7 PRO CB C -3.066 3.255 7.031 . . . 1.0 . . . . . . . . . . . . A . 7 PRO CB . . . . . . . . . c19595_2mgo 1 . 11 . 1437 . 1 1 7 PRO CD C -1.462 2.304 5.531 . . . 1.0 . . . . . . . . . . . . A . 7 PRO CD . . . . . . . . . c19595_2mgo 1 . 11 . 1438 . 1 1 7 PRO CG C -1.605 3.023 6.841 . . . 1.0 . . . . . . . . . . . . A . 7 PRO CG . . . . . . . . . c19595_2mgo 1 . 11 . 1439 . 1 1 7 PRO HA H -4.626 2.977 5.558 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HA . . . . . . . . . c19595_2mgo 1 . 11 . 1440 . 1 1 7 PRO HB2 H -3.258 4.158 7.590 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HB2 . . . . . . . . . c19595_2mgo 1 . 11 . 1441 . 1 1 7 PRO HB3 H -3.535 2.416 7.521 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HB3 . . . . . . . . . c19595_2mgo 1 . 11 . 1442 . 1 1 7 PRO HD2 H -0.575 2.646 5.019 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HD2 . . . . . . . . . c19595_2mgo 1 . 11 . 1443 . 1 1 7 PRO HD3 H -1.421 1.236 5.686 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HD3 . . . . . . . . . c19595_2mgo 1 . 11 . 1444 . 1 1 7 PRO HG2 H -1.087 3.970 6.807 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HG2 . . . . . . . . . c19595_2mgo 1 . 11 . 1445 . 1 1 7 PRO HG3 H -1.219 2.418 7.648 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HG3 . . . . . . . . . c19595_2mgo 1 . 11 . 1446 . 1 1 7 PRO N N -2.686 2.682 4.787 . . . 1.0 . . . . . . . . . . . . A . 7 PRO N . . . . . . . . . c19595_2mgo 1 . 11 . 1447 . 1 1 7 PRO O O -2.678 5.593 5.309 . . . 1.0 . . . . . . . . . . . . A . 7 PRO O . . . . . . . . . c19595_2mgo 1 . 11 . 1448 . 1 1 8 LEU C C -5.190 7.712 5.261 . . . 1.0 . . . . . . . . . . . . A . 8 LEU C . . . . . . . . . c19595_2mgo 1 . 11 . 1449 . 1 1 8 LEU CA C -4.950 6.679 4.186 . . . 1.0 . . . . . . . . . . . . A . 8 LEU CA . . . . . . . . . c19595_2mgo 1 . 11 . 1450 . 1 1 8 LEU CB C -6.029 6.758 3.128 . . . 1.0 . . . . . . . . . . . . A . 8 LEU CB . . . . . . . . . c19595_2mgo 1 . 11 . 1451 . 1 1 8 LEU CD1 C -6.973 6.131 0.895 . . . 1.0 . . . . . . . . . . . . A . 8 LEU CD1 . . . . . . . . . c19595_2mgo 1 . 11 . 1452 . 1 1 8 LEU CD2 C -4.500 6.287 1.183 . . . 1.0 . . . . . . . . . . . . A . 8 LEU CD2 . . . . . . . . . c19595_2mgo 1 . 11 . 1453 . 1 1 8 LEU CG C -5.816 5.930 1.856 . . . 1.0 . . . . . . . . . . . . A . 8 LEU CG . . . . . . . . . c19595_2mgo 1 . 11 . 1454 . 1 1 8 LEU H H -5.609 4.727 4.694 . . . 1.0 . . . . . . . . . . . . A . 8 LEU H . . . . . . . . . c19595_2mgo 1 . 11 . 1455 . 1 1 8 LEU HA H -4.005 6.919 3.734 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HA . . . . . . . . . c19595_2mgo 1 . 11 . 1456 . 1 1 8 LEU HB2 H -6.954 6.442 3.588 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HB2 . . . . . . . . . c19595_2mgo 1 . 11 . 1457 . 1 1 8 LEU HB3 H -6.108 7.800 2.873 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HB3 . . . . . . . . . c19595_2mgo 1 . 11 . 1458 . 1 1 8 LEU HD11 H -7.036 7.173 0.622 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HD11 . . . . . . . . . c19595_2mgo 1 . 11 . 1459 . 1 1 8 LEU HD12 H -7.894 5.828 1.374 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HD12 . . . . . . . . . c19595_2mgo 1 . 11 . 1460 . 1 1 8 LEU HD13 H -6.814 5.535 0.009 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HD13 . . . . . . . . . c19595_2mgo 1 . 11 . 1461 . 1 1 8 LEU HD21 H -4.397 5.713 0.274 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HD21 . . . . . . . . . c19595_2mgo 1 . 11 . 1462 . 1 1 8 LEU HD22 H -3.679 6.061 1.845 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HD22 . . . . . . . . . c19595_2mgo 1 . 11 . 1463 . 1 1 8 LEU HD23 H -4.493 7.341 0.948 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HD23 . . . . . . . . . c19595_2mgo 1 . 11 . 1464 . 1 1 8 LEU HG H -5.789 4.883 2.124 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HG . . . . . . . . . c19595_2mgo 1 . 11 . 1465 . 1 1 8 LEU N N -4.822 5.319 4.717 . . . 1.0 . . . . . . . . . . . . A . 8 LEU N . . . . . . . . . c19595_2mgo 1 . 11 . 1466 . 1 1 8 LEU O O -5.329 8.907 4.990 . . . 1.0 . . . . . . . . . . . . A . 8 LEU O . . . . . . . . . c19595_2mgo 1 . 11 . 1467 . 1 1 9 GLY C C -5.947 7.320 8.710 . . . 1.0 . . . . . . . . . . . . A . 9 GLY C . . . . . . . . . c19595_2mgo 1 . 11 . 1468 . 1 1 9 GLY CA C -5.418 8.101 7.563 . . . 1.0 . . . . . . . . . . . . A . 9 GLY CA . . . . . . . . . c19595_2mgo 1 . 11 . 1469 . 1 1 9 GLY H H -5.115 6.289 6.492 . . . 1.0 . . . . . . . . . . . . A . 9 GLY H . . . . . . . . . c19595_2mgo 1 . 11 . 1470 . 1 1 9 GLY HA2 H -4.470 8.543 7.837 . . . 1.0 . . . . . . . . . . . . A . 9 GLY HA2 . . . . . . . . . c19595_2mgo 1 . 11 . 1471 . 1 1 9 GLY HA3 H -6.121 8.883 7.312 . . . 1.0 . . . . . . . . . . . . A . 9 GLY HA3 . . . . . . . . . c19595_2mgo 1 . 11 . 1472 . 1 1 9 GLY N N -5.223 7.256 6.432 . . . 1.0 . . . . . . . . . . . . A . 9 GLY N . . . . . . . . . c19595_2mgo 1 . 11 . 1473 . 1 1 9 GLY O O -7.176 7.197 8.826 . . . 1.0 . . . . . . . . . . . . A . 9 GLY O . . . . . . . . . c19595_2mgo 1 . 11 . 1474 . 1 1 9 GLY OXT O -5.141 6.776 9.496 . . . 1.0 . . . . . . . . . . . . A . 9 GLY OXT . . . . . . . . . c19595_2mgo 1 . 12 . 1475 . 1 1 1 CYS C C 4.142 0.207 0.116 . . . 1.0 . . . . . . . . . . . . A . 1 CYS C . . . . . . . . . c19595_2mgo 1 . 12 . 1476 . 1 1 1 CYS CA C 3.962 1.700 0.265 . . . 1.0 . . . . . . . . . . . . A . 1 CYS CA . . . . . . . . . c19595_2mgo 1 . 12 . 1477 . 1 1 1 CYS CB C 2.517 2.123 -0.106 . . . 1.0 . . . . . . . . . . . . A . 1 CYS CB . . . . . . . . . c19595_2mgo 1 . 12 . 1478 . 1 1 1 CYS H1 H 4.832 3.438 -0.468 . . . 1.0 . . . . . . . . . . . . A . 1 CYS H1 . . . . . . . . . c19595_2mgo 1 . 12 . 1479 . 1 1 1 CYS H2 H 4.802 2.139 -1.551 . . . 1.0 . . . . . . . . . . . . A . 1 CYS H2 . . . . . . . . . c19595_2mgo 1 . 12 . 1480 . 1 1 1 CYS H3 H 5.890 2.131 -0.268 . . . 1.0 . . . . . . . . . . . . A . 1 CYS H3 . . . . . . . . . c19595_2mgo 1 . 12 . 1481 . 1 1 1 CYS HA H 4.149 1.967 1.294 . . . 1.0 . . . . . . . . . . . . A . 1 CYS HA . . . . . . . . . c19595_2mgo 1 . 12 . 1482 . 1 1 1 CYS HB2 H 1.835 1.426 0.358 . . . 1.0 . . . . . . . . . . . . A . 1 CYS HB2 . . . . . . . . . c19595_2mgo 1 . 12 . 1483 . 1 1 1 CYS HB3 H 2.312 3.106 0.284 . . . 1.0 . . . . . . . . . . . . A . 1 CYS HB3 . . . . . . . . . c19595_2mgo 1 . 12 . 1484 . 1 1 1 CYS N N 4.932 2.407 -0.554 . . . 1.0 . . . . . . . . . . . . A . 1 CYS N . . . . . . . . . c19595_2mgo 1 . 12 . 1485 . 1 1 1 CYS O O 4.795 -0.251 -0.823 . . . 1.0 . . . . . . . . . . . . A . 1 CYS O . . . . . . . . . c19595_2mgo 1 . 12 . 1486 . 1 1 1 CYS SG S 2.124 2.126 -1.901 . . . 1.0 . . . . . . . . . . . . A . 1 CYS SG . . . . . . . . . c19595_2mgo 1 . 12 . 1487 . 1 1 2 TYR C C 2.449 -2.255 0.072 . . . 1.0 . . . . . . . . . . . . A . 2 TYR C . . . . . . . . . c19595_2mgo 1 . 12 . 1488 . 1 1 2 TYR CA C 3.596 -1.925 0.957 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CA . . . . . . . . . c19595_2mgo 1 . 12 . 1489 . 1 1 2 TYR CB C 3.436 -2.585 2.337 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CB . . . . . . . . . c19595_2mgo 1 . 12 . 1490 . 1 1 2 TYR CD1 C 4.495 -4.780 1.736 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CD1 . . . . . . . . . c19595_2mgo 1 . 12 . 1491 . 1 1 2 TYR CD2 C 2.313 -4.828 2.681 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CD2 . . . . . . . . . c19595_2mgo 1 . 12 . 1492 . 1 1 2 TYR CE1 C 4.488 -6.142 1.632 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CE1 . . . . . . . . . c19595_2mgo 1 . 12 . 1493 . 1 1 2 TYR CE2 C 2.299 -6.205 2.573 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CE2 . . . . . . . . . c19595_2mgo 1 . 12 . 1494 . 1 1 2 TYR CG C 3.417 -4.094 2.265 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CG . . . . . . . . . c19595_2mgo 1 . 12 . 1495 . 1 1 2 TYR CZ C 3.396 -6.854 2.050 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CZ . . . . . . . . . c19595_2mgo 1 . 12 . 1496 . 1 1 2 TYR H H 3.168 -0.208 1.840 . . . 1.0 . . . . . . . . . . . . A . 2 TYR H . . . . . . . . . c19595_2mgo 1 . 12 . 1497 . 1 1 2 TYR HA H 4.517 -2.255 0.505 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HA . . . . . . . . . c19595_2mgo 1 . 12 . 1498 . 1 1 2 TYR HB2 H 4.258 -2.291 2.972 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HB2 . . . . . . . . . c19595_2mgo 1 . 12 . 1499 . 1 1 2 TYR HB3 H 2.507 -2.258 2.779 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HB3 . . . . . . . . . c19595_2mgo 1 . 12 . 1500 . 1 1 2 TYR HD1 H 5.362 -4.227 1.406 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HD1 . . . . . . . . . c19595_2mgo 1 . 12 . 1501 . 1 1 2 TYR HD2 H 1.461 -4.309 3.098 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HD2 . . . . . . . . . c19595_2mgo 1 . 12 . 1502 . 1 1 2 TYR HE1 H 5.353 -6.641 1.220 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HE1 . . . . . . . . . c19595_2mgo 1 . 12 . 1503 . 1 1 2 TYR HE2 H 1.436 -6.766 2.901 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HE2 . . . . . . . . . c19595_2mgo 1 . 12 . 1504 . 1 1 2 TYR HH H 4.286 -8.547 2.116 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HH . . . . . . . . . c19595_2mgo 1 . 12 . 1505 . 1 1 2 TYR N N 3.610 -0.553 1.048 . . . 1.0 . . . . . . . . . . . . A . 2 TYR N . . . . . . . . . c19595_2mgo 1 . 12 . 1506 . 1 1 2 TYR O O 1.459 -1.570 0.082 . . . 1.0 . . . . . . . . . . . . A . 2 TYR O . . . . . . . . . c19595_2mgo 1 . 12 . 1507 . 1 1 2 TYR OH O 3.393 -8.217 1.933 . . . 1.0 . . . . . . . . . . . . A . 2 TYR OH . . . . . . . . . c19595_2mgo 1 . 12 . 1508 . 1 1 3 ILE C C 0.213 -3.661 -1.309 . . . 1.0 . . . . . . . . . . . . A . 3 ILE C . . . . . . . . . c19595_2mgo 1 . 12 . 1509 . 1 1 3 ILE CA C 1.689 -3.781 -1.693 . . . 1.0 . . . . . . . . . . . . A . 3 ILE CA . . . . . . . . . c19595_2mgo 1 . 12 . 1510 . 1 1 3 ILE CB C 2.009 -5.256 -2.060 . . . 1.0 . . . . . . . . . . . . A . 3 ILE CB . . . . . . . . . c19595_2mgo 1 . 12 . 1511 . 1 1 3 ILE CD1 C 3.937 -6.843 -2.644 . . . 1.0 . . . . . . . . . . . . A . 3 ILE CD1 . . . . . . . . . c19595_2mgo 1 . 12 . 1512 . 1 1 3 ILE CG1 C 3.499 -5.409 -2.408 . . . 1.0 . . . . . . . . . . . . A . 3 ILE CG1 . . . . . . . . . c19595_2mgo 1 . 12 . 1513 . 1 1 3 ILE CG2 C 1.143 -5.710 -3.240 . . . 1.0 . . . . . . . . . . . . A . 3 ILE CG2 . . . . . . . . . c19595_2mgo 1 . 12 . 1514 . 1 1 3 ILE H H 3.495 -3.651 -0.438 . . . 1.0 . . . . . . . . . . . . A . 3 ILE H . . . . . . . . . c19595_2mgo 1 . 12 . 1515 . 1 1 3 ILE HA H 1.815 -3.182 -2.567 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HA . . . . . . . . . c19595_2mgo 1 . 12 . 1516 . 1 1 3 ILE HB H 1.781 -5.877 -1.207 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HB . . . . . . . . . c19595_2mgo 1 . 12 . 1517 . 1 1 3 ILE HD11 H 3.368 -7.261 -3.459 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HD11 . . . . . . . . . c19595_2mgo 1 . 12 . 1518 . 1 1 3 ILE HD12 H 3.765 -7.422 -1.749 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HD12 . . . . . . . . . c19595_2mgo 1 . 12 . 1519 . 1 1 3 ILE HD13 H 4.988 -6.861 -2.888 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HD13 . . . . . . . . . c19595_2mgo 1 . 12 . 1520 . 1 1 3 ILE HG12 H 3.707 -4.853 -3.310 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HG12 . . . . . . . . . c19595_2mgo 1 . 12 . 1521 . 1 1 3 ILE HG13 H 4.094 -5.006 -1.602 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HG13 . . . . . . . . . c19595_2mgo 1 . 12 . 1522 . 1 1 3 ILE HG21 H 1.337 -5.077 -4.093 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HG21 . . . . . . . . . c19595_2mgo 1 . 12 . 1523 . 1 1 3 ILE HG22 H 0.100 -5.642 -2.968 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HG22 . . . . . . . . . c19595_2mgo 1 . 12 . 1524 . 1 1 3 ILE HG23 H 1.387 -6.733 -3.487 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HG23 . . . . . . . . . c19595_2mgo 1 . 12 . 1525 . 1 1 3 ILE N N 2.621 -3.272 -0.650 . . . 1.0 . . . . . . . . . . . . A . 3 ILE N . . . . . . . . . c19595_2mgo 1 . 12 . 1526 . 1 1 3 ILE O O -0.602 -3.075 -2.022 . . . 1.0 . . . . . . . . . . . . A . 3 ILE O . . . . . . . . . c19595_2mgo 1 . 12 . 1527 . 1 1 4 GLN C C -1.888 -2.868 0.960 . . . 1.0 . . . . . . . . . . . . A . 4 GLN C . . . . . . . . . c19595_2mgo 1 . 12 . 1528 . 1 1 4 GLN CA C -1.451 -4.193 0.357 . . . 1.0 . . . . . . . . . . . . A . 4 GLN CA . . . . . . . . . c19595_2mgo 1 . 12 . 1529 . 1 1 4 GLN CB C -1.599 -5.309 1.377 . . . 1.0 . . . . . . . . . . . . A . 4 GLN CB . . . . . . . . . c19595_2mgo 1 . 12 . 1530 . 1 1 4 GLN CD C -1.382 -7.759 1.893 . . . 1.0 . . . . . . . . . . . . A . 4 GLN CD . . . . . . . . . c19595_2mgo 1 . 12 . 1531 . 1 1 4 GLN CG C -1.247 -6.683 0.844 . . . 1.0 . . . . . . . . . . . . A . 4 GLN CG . . . . . . . . . c19595_2mgo 1 . 12 . 1532 . 1 1 4 GLN H H 0.732 -4.435 0.298 . . . 1.0 . . . . . . . . . . . . A . 4 GLN H . . . . . . . . . c19595_2mgo 1 . 12 . 1533 . 1 1 4 GLN HA H -2.092 -4.390 -0.482 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HA . . . . . . . . . c19595_2mgo 1 . 12 . 1534 . 1 1 4 GLN HB2 H -0.953 -5.100 2.217 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HB2 . . . . . . . . . c19595_2mgo 1 . 12 . 1535 . 1 1 4 GLN HB3 H -2.624 -5.333 1.722 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HB3 . . . . . . . . . c19595_2mgo 1 . 12 . 1536 . 1 1 4 GLN HE21 H 0.070 -8.786 1.057 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HE21 . . . . . . . . . c19595_2mgo 1 . 12 . 1537 . 1 1 4 GLN HE22 H -0.645 -9.485 2.460 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HE22 . . . . . . . . . c19595_2mgo 1 . 12 . 1538 . 1 1 4 GLN HG2 H -1.907 -6.917 0.020 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HG2 . . . . . . . . . c19595_2mgo 1 . 12 . 1539 . 1 1 4 GLN HG3 H -0.227 -6.666 0.491 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HG3 . . . . . . . . . c19595_2mgo 1 . 12 . 1540 . 1 1 4 GLN N N -0.075 -4.134 -0.165 . . . 1.0 . . . . . . . . . . . . A . 4 GLN N . . . . . . . . . c19595_2mgo 1 . 12 . 1541 . 1 1 4 GLN NE2 N -0.578 -8.767 1.795 . . . 1.0 . . . . . . . . . . . . A . 4 GLN NE2 . . . . . . . . . c19595_2mgo 1 . 12 . 1542 . 1 1 4 GLN O O -3.061 -2.651 1.262 . . . 1.0 . . . . . . . . . . . . A . 4 GLN O . . . . . . . . . c19595_2mgo 1 . 12 . 1543 . 1 1 4 GLN OE1 O -2.213 -7.667 2.799 . . . 1.0 . . . . . . . . . . . . A . 4 GLN OE1 . . . . . . . . . c19595_2mgo 1 . 12 . 1544 . 1 1 5 ASN C C -1.205 0.359 0.580 . . . 1.0 . . . . . . . . . . . . A . 5 ASN C . . . . . . . . . c19595_2mgo 1 . 12 . 1545 . 1 1 5 ASN CA C -1.166 -0.680 1.680 . . . 1.0 . . . . . . . . . . . . A . 5 ASN CA . . . . . . . . . c19595_2mgo 1 . 12 . 1546 . 1 1 5 ASN CB C -0.046 -0.331 2.680 . . . 1.0 . . . . . . . . . . . . A . 5 ASN CB . . . . . . . . . c19595_2mgo 1 . 12 . 1547 . 1 1 5 ASN CG C 0.135 -1.311 3.847 . . . 1.0 . . . . . . . . . . . . A . 5 ASN CG . . . . . . . . . c19595_2mgo 1 . 12 . 1548 . 1 1 5 ASN H H -0.085 -2.243 0.709 . . . 1.0 . . . . . . . . . . . . A . 5 ASN H . . . . . . . . . c19595_2mgo 1 . 12 . 1549 . 1 1 5 ASN HA H -2.121 -0.692 2.176 . . . 1.0 . . . . . . . . . . . . A . 5 ASN HA . . . . . . . . . c19595_2mgo 1 . 12 . 1550 . 1 1 5 ASN HB2 H 0.888 -0.296 2.139 . . . 1.0 . . . . . . . . . . . . A . 5 ASN HB2 . . . . . . . . . c19595_2mgo 1 . 12 . 1551 . 1 1 5 ASN HB3 H -0.250 0.651 3.079 . . . 1.0 . . . . . . . . . . . . A . 5 ASN HB3 . . . . . . . . . c19595_2mgo 1 . 12 . 1552 . 1 1 5 ASN HD21 H 0.743 0.164 4.996 . . . 1.0 . . . . . . . . . . . . A . 5 ASN HD21 . . . . . . . . . c19595_2mgo 1 . 12 . 1553 . 1 1 5 ASN HD22 H 0.723 -1.391 5.745 . . . 1.0 . . . . . . . . . . . . A . 5 ASN HD22 . . . . . . . . . c19595_2mgo 1 . 12 . 1554 . 1 1 5 ASN N N -0.962 -1.996 1.075 . . . 1.0 . . . . . . . . . . . . A . 5 ASN N . . . . . . . . . c19595_2mgo 1 . 12 . 1555 . 1 1 5 ASN ND2 N 0.572 -0.804 4.974 . . . 1.0 . . . . . . . . . . . . A . 5 ASN ND2 . . . . . . . . . c19595_2mgo 1 . 12 . 1556 . 1 1 5 ASN O O -1.339 1.560 0.814 . . . 1.0 . . . . . . . . . . . . A . 5 ASN O . . . . . . . . . c19595_2mgo 1 . 12 . 1557 . 1 1 5 ASN OD1 O -0.107 -2.518 3.730 . . . 1.0 . . . . . . . . . . . . A . 5 ASN OD1 . . . . . . . . . c19595_2mgo 1 . 12 . 1558 . 1 1 6 CYS C C -2.481 0.498 -2.387 . . . 1.0 . . . . . . . . . . . . A . 6 CYS C . . . . . . . . . c19595_2mgo 1 . 12 . 1559 . 1 1 6 CYS CA C -1.120 0.682 -1.784 . . . 1.0 . . . . . . . . . . . . A . 6 CYS CA . . . . . . . . . c19595_2mgo 1 . 12 . 1560 . 1 1 6 CYS CB C -0.091 0.217 -2.831 . . . 1.0 . . . . . . . . . . . . A . 6 CYS CB . . . . . . . . . c19595_2mgo 1 . 12 . 1561 . 1 1 6 CYS H H -0.945 -1.093 -0.664 . . . 1.0 . . . . . . . . . . . . A . 6 CYS H . . . . . . . . . c19595_2mgo 1 . 12 . 1562 . 1 1 6 CYS HA H -0.936 1.715 -1.529 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HA . . . . . . . . . c19595_2mgo 1 . 12 . 1563 . 1 1 6 CYS HB2 H -0.337 -0.791 -3.128 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HB2 . . . . . . . . . c19595_2mgo 1 . 12 . 1564 . 1 1 6 CYS HB3 H -0.177 0.859 -3.696 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HB3 . . . . . . . . . c19595_2mgo 1 . 12 . 1565 . 1 1 6 CYS N N -1.066 -0.123 -0.602 . . . 1.0 . . . . . . . . . . . . A . 6 CYS N . . . . . . . . . c19595_2mgo 1 . 12 . 1566 . 1 1 6 CYS O O -2.969 -0.639 -2.445 . . . 1.0 . . . . . . . . . . . . A . 6 CYS O . . . . . . . . . c19595_2mgo 1 . 12 . 1567 . 1 1 6 CYS SG S 1.662 0.201 -2.314 . . . 1.0 . . . . . . . . . . . . A . 6 CYS SG . . . . . . . . . c19595_2mgo 1 . 12 . 1568 . 1 1 7 PRO C C -4.067 0.834 -4.880 . . . 1.0 . . . . . . . . . . . . A . 7 PRO C . . . . . . . . . c19595_2mgo 1 . 12 . 1569 . 1 1 7 PRO CA C -4.393 1.446 -3.526 . . . 1.0 . . . . . . . . . . . . A . 7 PRO CA . . . . . . . . . c19595_2mgo 1 . 12 . 1570 . 1 1 7 PRO CB C -4.888 2.887 -3.682 . . . 1.0 . . . . . . . . . . . . A . 7 PRO CB . . . . . . . . . c19595_2mgo 1 . 12 . 1571 . 1 1 7 PRO CD C -2.815 2.963 -2.507 . . . 1.0 . . . . . . . . . . . . A . 7 PRO CD . . . . . . . . . c19595_2mgo 1 . 12 . 1572 . 1 1 7 PRO CG C -4.127 3.671 -2.671 . . . 1.0 . . . . . . . . . . . . A . 7 PRO CG . . . . . . . . . c19595_2mgo 1 . 12 . 1573 . 1 1 7 PRO HA H -5.116 0.833 -3.007 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HA . . . . . . . . . c19595_2mgo 1 . 12 . 1574 . 1 1 7 PRO HB2 H -4.676 3.220 -4.685 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HB2 . . . . . . . . . c19595_2mgo 1 . 12 . 1575 . 1 1 7 PRO HB3 H -5.951 2.929 -3.498 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HB3 . . . . . . . . . c19595_2mgo 1 . 12 . 1576 . 1 1 7 PRO HD2 H -2.088 3.319 -3.220 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HD2 . . . . . . . . . c19595_2mgo 1 . 12 . 1577 . 1 1 7 PRO HD3 H -2.450 3.079 -1.498 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HD3 . . . . . . . . . c19595_2mgo 1 . 12 . 1578 . 1 1 7 PRO HG2 H -3.970 4.679 -3.025 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HG2 . . . . . . . . . c19595_2mgo 1 . 12 . 1579 . 1 1 7 PRO HG3 H -4.666 3.684 -1.735 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HG3 . . . . . . . . . c19595_2mgo 1 . 12 . 1580 . 1 1 7 PRO N N -3.163 1.569 -2.777 . . . 1.0 . . . . . . . . . . . . A . 7 PRO N . . . . . . . . . c19595_2mgo 1 . 12 . 1581 . 1 1 7 PRO O O -3.449 1.477 -5.736 . . . 1.0 . . . . . . . . . . . . A . 7 PRO O . . . . . . . . . c19595_2mgo 1 . 12 . 1582 . 1 1 8 LEU C C -5.233 -2.038 -6.513 . . . 1.0 . . . . . . . . . . . . A . 8 LEU C . . . . . . . . . c19595_2mgo 1 . 12 . 1583 . 1 1 8 LEU CA C -4.087 -1.157 -6.198 . . . 1.0 . . . . . . . . . . . . A . 8 LEU CA . . . . . . . . . c19595_2mgo 1 . 12 . 1584 . 1 1 8 LEU CB C -2.836 -1.940 -5.981 . . . 1.0 . . . . . . . . . . . . A . 8 LEU CB . . . . . . . . . c19595_2mgo 1 . 12 . 1585 . 1 1 8 LEU CD1 C -1.926 -1.826 -8.324 . . . 1.0 . . . . . . . . . . . . A . 8 LEU CD1 . . . . . . . . . c19595_2mgo 1 . 12 . 1586 . 1 1 8 LEU CD2 C -1.078 -3.551 -6.732 . . . 1.0 . . . . . . . . . . . . A . 8 LEU CD2 . . . . . . . . . c19595_2mgo 1 . 12 . 1587 . 1 1 8 LEU CG C -2.286 -2.741 -7.164 . . . 1.0 . . . . . . . . . . . . A . 8 LEU CG . . . . . . . . . c19595_2mgo 1 . 12 . 1588 . 1 1 8 LEU H H -4.969 -0.852 -4.366 . . . 1.0 . . . . . . . . . . . . A . 8 LEU H . . . . . . . . . c19595_2mgo 1 . 12 . 1589 . 1 1 8 LEU HA H -3.942 -0.460 -7.011 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HA . . . . . . . . . c19595_2mgo 1 . 12 . 1590 . 1 1 8 LEU HB2 H -2.119 -1.195 -5.686 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HB2 . . . . . . . . . c19595_2mgo 1 . 12 . 1591 . 1 1 8 LEU HB3 H -3.069 -2.601 -5.164 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HB3 . . . . . . . . . c19595_2mgo 1 . 12 . 1592 . 1 1 8 LEU HD11 H -1.522 -2.414 -9.133 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HD11 . . . . . . . . . c19595_2mgo 1 . 12 . 1593 . 1 1 8 LEU HD12 H -1.196 -1.101 -8.000 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HD12 . . . . . . . . . c19595_2mgo 1 . 12 . 1594 . 1 1 8 LEU HD13 H -2.814 -1.313 -8.665 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HD13 . . . . . . . . . c19595_2mgo 1 . 12 . 1595 . 1 1 8 LEU HD21 H -0.313 -2.887 -6.360 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HD21 . . . . . . . . . c19595_2mgo 1 . 12 . 1596 . 1 1 8 LEU HD22 H -0.697 -4.102 -7.578 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HD22 . . . . . . . . . c19595_2mgo 1 . 12 . 1597 . 1 1 8 LEU HD23 H -1.365 -4.242 -5.954 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HD23 . . . . . . . . . c19595_2mgo 1 . 12 . 1598 . 1 1 8 LEU HG H -3.046 -3.427 -7.507 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HG . . . . . . . . . c19595_2mgo 1 . 12 . 1599 . 1 1 8 LEU N N -4.417 -0.409 -5.041 . . . 1.0 . . . . . . . . . . . . A . 8 LEU N . . . . . . . . . c19595_2mgo 1 . 12 . 1600 . 1 1 8 LEU O O -5.394 -3.166 -6.012 . . . 1.0 . . . . . . . . . . . . A . 8 LEU O . . . . . . . . . c19595_2mgo 1 . 12 . 1601 . 1 1 9 GLY C C -8.276 -0.933 -7.771 . . . 1.0 . . . . . . . . . . . . A . 9 GLY C . . . . . . . . . c19595_2mgo 1 . 12 . 1602 . 1 1 9 GLY CA C -7.277 -2.021 -7.638 . . . 1.0 . . . . . . . . . . . . A . 9 GLY CA . . . . . . . . . c19595_2mgo 1 . 12 . 1603 . 1 1 9 GLY H H -5.801 -0.515 -7.324 . . . 1.0 . . . . . . . . . . . . A . 9 GLY H . . . . . . . . . c19595_2mgo 1 . 12 . 1604 . 1 1 9 GLY HA2 H -7.116 -2.502 -8.591 . . . 1.0 . . . . . . . . . . . . A . 9 GLY HA2 . . . . . . . . . c19595_2mgo 1 . 12 . 1605 . 1 1 9 GLY HA3 H -7.634 -2.743 -6.918 . . . 1.0 . . . . . . . . . . . . A . 9 GLY HA3 . . . . . . . . . c19595_2mgo 1 . 12 . 1606 . 1 1 9 GLY N N -6.064 -1.446 -7.181 . . . 1.0 . . . . . . . . . . . . A . 9 GLY N . . . . . . . . . c19595_2mgo 1 . 12 . 1607 . 1 1 9 GLY O O -7.853 0.207 -8.065 . . . 1.0 . . . . . . . . . . . . A . 9 GLY O . . . . . . . . . c19595_2mgo 1 . 12 . 1608 . 1 1 9 GLY OXT O -9.465 -1.152 -7.519 . . . 1.0 . . . . . . . . . . . . A . 9 GLY OXT . . . . . . . . . c19595_2mgo 1 . 13 . 1609 . 1 1 1 CYS C C 4.673 0.132 -0.695 . . . 1.0 . . . . . . . . . . . . A . 1 CYS C . . . . . . . . . c19595_2mgo 1 . 13 . 1610 . 1 1 1 CYS CA C 4.514 1.265 0.303 . . . 1.0 . . . . . . . . . . . . A . 1 CYS CA . . . . . . . . . c19595_2mgo 1 . 13 . 1611 . 1 1 1 CYS CB C 3.309 0.985 1.186 . . . 1.0 . . . . . . . . . . . . A . 1 CYS CB . . . . . . . . . c19595_2mgo 1 . 13 . 1612 . 1 1 1 CYS H1 H 5.129 2.725 -1.010 . . . 1.0 . . . . . . . . . . . . A . 1 CYS H1 . . . . . . . . . c19595_2mgo 1 . 13 . 1613 . 1 1 1 CYS H2 H 4.142 3.297 0.240 . . . 1.0 . . . . . . . . . . . . A . 1 CYS H2 . . . . . . . . . c19595_2mgo 1 . 13 . 1614 . 1 1 1 CYS H3 H 3.476 2.405 -1.044 . . . 1.0 . . . . . . . . . . . . A . 1 CYS H3 . . . . . . . . . c19595_2mgo 1 . 13 . 1615 . 1 1 1 CYS HA H 5.401 1.350 0.913 . . . 1.0 . . . . . . . . . . . . A . 1 CYS HA . . . . . . . . . c19595_2mgo 1 . 13 . 1616 . 1 1 1 CYS HB2 H 2.444 0.874 0.550 . . . 1.0 . . . . . . . . . . . . A . 1 CYS HB2 . . . . . . . . . c19595_2mgo 1 . 13 . 1617 . 1 1 1 CYS HB3 H 3.454 0.060 1.724 . . . 1.0 . . . . . . . . . . . . A . 1 CYS HB3 . . . . . . . . . c19595_2mgo 1 . 13 . 1618 . 1 1 1 CYS N N 4.300 2.511 -0.420 . . . 1.0 . . . . . . . . . . . . A . 1 CYS N . . . . . . . . . c19595_2mgo 1 . 13 . 1619 . 1 1 1 CYS O O 4.483 0.337 -1.888 . . . 1.0 . . . . . . . . . . . . A . 1 CYS O . . . . . . . . . c19595_2mgo 1 . 13 . 1620 . 1 1 1 CYS SG S 2.927 2.286 2.395 . . . 1.0 . . . . . . . . . . . . A . 1 CYS SG . . . . . . . . . c19595_2mgo 1 . 13 . 1621 . 1 1 2 TYR C C 3.942 -3.175 -0.769 . . . 1.0 . . . . . . . . . . . . A . 2 TYR C . . . . . . . . . c19595_2mgo 1 . 13 . 1622 . 1 1 2 TYR CA C 5.106 -2.231 -1.073 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CA . . . . . . . . . c19595_2mgo 1 . 13 . 1623 . 1 1 2 TYR CB C 6.464 -2.954 -0.925 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CB . . . . . . . . . c19595_2mgo 1 . 13 . 1624 . 1 1 2 TYR CD1 C 6.320 -4.600 1.007 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CD1 . . . . . . . . . c19595_2mgo 1 . 13 . 1625 . 1 1 2 TYR CD2 C 7.694 -2.678 1.272 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CD2 . . . . . . . . . c19595_2mgo 1 . 13 . 1626 . 1 1 2 TYR CE1 C 6.661 -5.026 2.270 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CE1 . . . . . . . . . c19595_2mgo 1 . 13 . 1627 . 1 1 2 TYR CE2 C 8.040 -3.097 2.537 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CE2 . . . . . . . . . c19595_2mgo 1 . 13 . 1628 . 1 1 2 TYR CG C 6.826 -3.417 0.482 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CG . . . . . . . . . c19595_2mgo 1 . 13 . 1629 . 1 1 2 TYR CZ C 7.521 -4.273 3.031 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CZ . . . . . . . . . c19595_2mgo 1 . 13 . 1630 . 1 1 2 TYR H H 5.288 -1.159 0.728 . . . 1.0 . . . . . . . . . . . . A . 2 TYR H . . . . . . . . . c19595_2mgo 1 . 13 . 1631 . 1 1 2 TYR HA H 4.994 -1.885 -2.090 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HA . . . . . . . . . c19595_2mgo 1 . 13 . 1632 . 1 1 2 TYR HB2 H 6.447 -3.833 -1.550 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HB2 . . . . . . . . . c19595_2mgo 1 . 13 . 1633 . 1 1 2 TYR HB3 H 7.248 -2.298 -1.272 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HB3 . . . . . . . . . c19595_2mgo 1 . 13 . 1634 . 1 1 2 TYR HD1 H 5.641 -5.191 0.409 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HD1 . . . . . . . . . c19595_2mgo 1 . 13 . 1635 . 1 1 2 TYR HD2 H 8.103 -1.755 0.888 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HD2 . . . . . . . . . c19595_2mgo 1 . 13 . 1636 . 1 1 2 TYR HE1 H 6.250 -5.951 2.649 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HE1 . . . . . . . . . c19595_2mgo 1 . 13 . 1637 . 1 1 2 TYR HE2 H 8.716 -2.499 3.128 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HE2 . . . . . . . . . c19595_2mgo 1 . 13 . 1638 . 1 1 2 TYR HH H 8.145 -5.617 4.217 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HH . . . . . . . . . c19595_2mgo 1 . 13 . 1639 . 1 1 2 TYR N N 5.030 -1.056 -0.215 . . . 1.0 . . . . . . . . . . . . A . 2 TYR N . . . . . . . . . c19595_2mgo 1 . 13 . 1640 . 1 1 2 TYR O O 3.838 -4.281 -1.319 . . . 1.0 . . . . . . . . . . . . A . 2 TYR O . . . . . . . . . c19595_2mgo 1 . 13 . 1641 . 1 1 2 TYR OH O 7.863 -4.695 4.288 . . . 1.0 . . . . . . . . . . . . A . 2 TYR OH . . . . . . . . . c19595_2mgo 1 . 13 . 1642 . 1 1 3 ILE C C 0.736 -2.838 -0.181 . . . 1.0 . . . . . . . . . . . . A . 3 ILE C . . . . . . . . . c19595_2mgo 1 . 13 . 1643 . 1 1 3 ILE CA C 1.933 -3.453 0.531 . . . 1.0 . . . . . . . . . . . . A . 3 ILE CA . . . . . . . . . c19595_2mgo 1 . 13 . 1644 . 1 1 3 ILE CB C 1.745 -3.313 2.076 . . . 1.0 . . . . . . . . . . . . A . 3 ILE CB . . . . . . . . . c19595_2mgo 1 . 13 . 1645 . 1 1 3 ILE CD1 C 3.009 -3.024 4.278 . . . 1.0 . . . . . . . . . . . . A . 3 ILE CD1 . . . . . . . . . c19595_2mgo 1 . 13 . 1646 . 1 1 3 ILE CG1 C 3.103 -3.256 2.788 . . . 1.0 . . . . . . . . . . . . A . 3 ILE CG1 . . . . . . . . . c19595_2mgo 1 . 13 . 1647 . 1 1 3 ILE CG2 C 0.945 -4.495 2.621 . . . 1.0 . . . . . . . . . . . . A . 3 ILE CG2 . . . . . . . . . c19595_2mgo 1 . 13 . 1648 . 1 1 3 ILE H H 3.139 -1.800 0.425 . . . 1.0 . . . . . . . . . . . . A . 3 ILE H . . . . . . . . . c19595_2mgo 1 . 13 . 1649 . 1 1 3 ILE HA H 2.049 -4.491 0.260 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HA . . . . . . . . . c19595_2mgo 1 . 13 . 1650 . 1 1 3 ILE HB H 1.195 -2.406 2.271 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HB . . . . . . . . . c19595_2mgo 1 . 13 . 1651 . 1 1 3 ILE HD11 H 2.499 -2.091 4.465 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HD11 . . . . . . . . . c19595_2mgo 1 . 13 . 1652 . 1 1 3 ILE HD12 H 4.002 -2.982 4.698 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HD12 . . . . . . . . . c19595_2mgo 1 . 13 . 1653 . 1 1 3 ILE HD13 H 2.457 -3.835 4.733 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HD13 . . . . . . . . . c19595_2mgo 1 . 13 . 1654 . 1 1 3 ILE HG12 H 3.624 -4.189 2.633 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HG12 . . . . . . . . . c19595_2mgo 1 . 13 . 1655 . 1 1 3 ILE HG13 H 3.686 -2.454 2.361 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HG13 . . . . . . . . . c19595_2mgo 1 . 13 . 1656 . 1 1 3 ILE HG21 H 0.925 -4.439 3.699 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HG21 . . . . . . . . . c19595_2mgo 1 . 13 . 1657 . 1 1 3 ILE HG22 H 1.385 -5.429 2.310 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HG22 . . . . . . . . . c19595_2mgo 1 . 13 . 1658 . 1 1 3 ILE HG23 H -0.070 -4.436 2.258 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HG23 . . . . . . . . . c19595_2mgo 1 . 13 . 1659 . 1 1 3 ILE N N 3.065 -2.711 0.092 . . . 1.0 . . . . . . . . . . . . A . 3 ILE N . . . . . . . . . c19595_2mgo 1 . 13 . 1660 . 1 1 3 ILE O O 0.849 -1.746 -0.754 . . . 1.0 . . . . . . . . . . . . A . 3 ILE O . . . . . . . . . c19595_2mgo 1 . 13 . 1661 . 1 1 4 GLN C C -2.645 -2.463 0.006 . . . 1.0 . . . . . . . . . . . . A . 4 GLN C . . . . . . . . . c19595_2mgo 1 . 13 . 1662 . 1 1 4 GLN CA C -1.557 -3.065 -0.868 . . . 1.0 . . . . . . . . . . . . A . 4 GLN CA . . . . . . . . . c19595_2mgo 1 . 13 . 1663 . 1 1 4 GLN CB C -2.095 -4.237 -1.672 . . . 1.0 . . . . . . . . . . . . A . 4 GLN CB . . . . . . . . . c19595_2mgo 1 . 13 . 1664 . 1 1 4 GLN CD C -1.600 -5.993 -3.426 . . . 1.0 . . . . . . . . . . . . A . 4 GLN CD . . . . . . . . . c19595_2mgo 1 . 13 . 1665 . 1 1 4 GLN CG C -1.119 -4.751 -2.710 . . . 1.0 . . . . . . . . . . . . A . 4 GLN CG . . . . . . . . . c19595_2mgo 1 . 13 . 1666 . 1 1 4 GLN H H -0.401 -4.246 0.492 . . . 1.0 . . . . . . . . . . . . A . 4 GLN H . . . . . . . . . c19595_2mgo 1 . 13 . 1667 . 1 1 4 GLN HA H -1.232 -2.304 -1.559 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HA . . . . . . . . . c19595_2mgo 1 . 13 . 1668 . 1 1 4 GLN HB2 H -2.336 -5.048 -1.003 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HB2 . . . . . . . . . c19595_2mgo 1 . 13 . 1669 . 1 1 4 GLN HB3 H -2.995 -3.922 -2.179 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HB3 . . . . . . . . . c19595_2mgo 1 . 13 . 1670 . 1 1 4 GLN HE21 H -3.504 -5.501 -3.149 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HE21 . . . . . . . . . c19595_2mgo 1 . 13 . 1671 . 1 1 4 GLN HE22 H -3.220 -6.962 -4.001 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HE22 . . . . . . . . . c19595_2mgo 1 . 13 . 1672 . 1 1 4 GLN HG2 H -0.958 -3.973 -3.441 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HG2 . . . . . . . . . c19595_2mgo 1 . 13 . 1673 . 1 1 4 GLN HG3 H -0.183 -4.974 -2.219 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HG3 . . . . . . . . . c19595_2mgo 1 . 13 . 1674 . 1 1 4 GLN N N -0.379 -3.474 -0.109 . . . 1.0 . . . . . . . . . . . . A . 4 GLN N . . . . . . . . . c19595_2mgo 1 . 13 . 1675 . 1 1 4 GLN NE2 N -2.891 -6.168 -3.533 . . . 1.0 . . . . . . . . . . . . A . 4 GLN NE2 . . . . . . . . . c19595_2mgo 1 . 13 . 1676 . 1 1 4 GLN O O -3.747 -2.212 -0.454 . . . 1.0 . . . . . . . . . . . . A . 4 GLN O . . . . . . . . . c19595_2mgo 1 . 13 . 1677 . 1 1 4 GLN OE1 O -0.798 -6.816 -3.854 . . . 1.0 . . . . . . . . . . . . A . 4 GLN OE1 . . . . . . . . . c19595_2mgo 1 . 13 . 1678 . 1 1 5 ASN C C -2.665 -0.307 2.728 . . . 1.0 . . . . . . . . . . . . A . 5 ASN C . . . . . . . . . c19595_2mgo 1 . 13 . 1679 . 1 1 5 ASN CA C -3.266 -1.582 2.174 . . . 1.0 . . . . . . . . . . . . A . 5 ASN CA . . . . . . . . . c19595_2mgo 1 . 13 . 1680 . 1 1 5 ASN CB C -3.666 -2.565 3.308 . . . 1.0 . . . . . . . . . . . . A . 5 ASN CB . . . . . . . . . c19595_2mgo 1 . 13 . 1681 . 1 1 5 ASN CG C -2.497 -3.120 4.105 . . . 1.0 . . . . . . . . . . . . A . 5 ASN CG . . . . . . . . . c19595_2mgo 1 . 13 . 1682 . 1 1 5 ASN H H -1.415 -2.428 1.523 . . . 1.0 . . . . . . . . . . . . A . 5 ASN H . . . . . . . . . c19595_2mgo 1 . 13 . 1683 . 1 1 5 ASN HA H -4.143 -1.317 1.603 . . . 1.0 . . . . . . . . . . . . A . 5 ASN HA . . . . . . . . . c19595_2mgo 1 . 13 . 1684 . 1 1 5 ASN HB2 H -4.315 -2.050 3.999 . . . 1.0 . . . . . . . . . . . . A . 5 ASN HB2 . . . . . . . . . c19595_2mgo 1 . 13 . 1685 . 1 1 5 ASN HB3 H -4.208 -3.393 2.874 . . . 1.0 . . . . . . . . . . . . A . 5 ASN HB3 . . . . . . . . . c19595_2mgo 1 . 13 . 1686 . 1 1 5 ASN HD21 H -2.662 -1.695 5.454 . . . 1.0 . . . . . . . . . . . . A . 5 ASN HD21 . . . . . . . . . c19595_2mgo 1 . 13 . 1687 . 1 1 5 ASN HD22 H -1.411 -2.854 5.720 . . . 1.0 . . . . . . . . . . . . A . 5 ASN HD22 . . . . . . . . . c19595_2mgo 1 . 13 . 1688 . 1 1 5 ASN N N -2.320 -2.199 1.235 . . . 1.0 . . . . . . . . . . . . A . 5 ASN N . . . . . . . . . c19595_2mgo 1 . 13 . 1689 . 1 1 5 ASN ND2 N -2.155 -2.495 5.192 . . . 1.0 . . . . . . . . . . . . A . 5 ASN ND2 . . . . . . . . . c19595_2mgo 1 . 13 . 1690 . 1 1 5 ASN O O -2.945 0.111 3.849 . . . 1.0 . . . . . . . . . . . . A . 5 ASN O . . . . . . . . . c19595_2mgo 1 . 13 . 1691 . 1 1 5 ASN OD1 O -1.929 -4.134 3.741 . . . 1.0 . . . . . . . . . . . . A . 5 ASN OD1 . . . . . . . . . c19595_2mgo 1 . 13 . 1692 . 1 1 6 CYS C C -2.037 2.779 1.963 . . . 1.0 . . . . . . . . . . . . A . 6 CYS C . . . . . . . . . c19595_2mgo 1 . 13 . 1693 . 1 1 6 CYS CA C -1.166 1.549 2.248 . . . 1.0 . . . . . . . . . . . . A . 6 CYS CA . . . . . . . . . c19595_2mgo 1 . 13 . 1694 . 1 1 6 CYS CB C 0.127 1.607 1.419 . . . 1.0 . . . . . . . . . . . . A . 6 CYS CB . . . . . . . . . c19595_2mgo 1 . 13 . 1695 . 1 1 6 CYS H H -1.810 0.011 0.975 . . . 1.0 . . . . . . . . . . . . A . 6 CYS H . . . . . . . . . c19595_2mgo 1 . 13 . 1696 . 1 1 6 CYS HA H -0.909 1.512 3.293 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HA . . . . . . . . . c19595_2mgo 1 . 13 . 1697 . 1 1 6 CYS HB2 H 0.716 0.732 1.652 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HB2 . . . . . . . . . c19595_2mgo 1 . 13 . 1698 . 1 1 6 CYS HB3 H -0.134 1.580 0.372 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HB3 . . . . . . . . . c19595_2mgo 1 . 13 . 1699 . 1 1 6 CYS N N -1.884 0.334 1.898 . . . 1.0 . . . . . . . . . . . . A . 6 CYS N . . . . . . . . . c19595_2mgo 1 . 13 . 1700 . 1 1 6 CYS O O -2.912 2.726 1.088 . . . 1.0 . . . . . . . . . . . . A . 6 CYS O . . . . . . . . . c19595_2mgo 1 . 13 . 1701 . 1 1 6 CYS SG S 1.199 3.068 1.697 . . . 1.0 . . . . . . . . . . . . A . 6 CYS SG . . . . . . . . . c19595_2mgo 1 . 13 . 1702 . 1 1 7 PRO C C -2.210 5.681 1.102 . . . 1.0 . . . . . . . . . . . . A . 7 PRO C . . . . . . . . . c19595_2mgo 1 . 13 . 1703 . 1 1 7 PRO CA C -2.564 5.139 2.497 . . . 1.0 . . . . . . . . . . . . A . 7 PRO CA . . . . . . . . . c19595_2mgo 1 . 13 . 1704 . 1 1 7 PRO CB C -2.007 6.074 3.581 . . . 1.0 . . . . . . . . . . . . A . 7 PRO CB . . . . . . . . . c19595_2mgo 1 . 13 . 1705 . 1 1 7 PRO CD C -1.082 3.926 4.002 . . . 1.0 . . . . . . . . . . . . A . 7 PRO CD . . . . . . . . . c19595_2mgo 1 . 13 . 1706 . 1 1 7 PRO CG C -1.576 5.169 4.674 . . . 1.0 . . . . . . . . . . . . A . 7 PRO CG . . . . . . . . . c19595_2mgo 1 . 13 . 1707 . 1 1 7 PRO HA H -3.636 5.046 2.595 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HA . . . . . . . . . c19595_2mgo 1 . 13 . 1708 . 1 1 7 PRO HB2 H -1.175 6.633 3.179 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HB2 . . . . . . . . . c19595_2mgo 1 . 13 . 1709 . 1 1 7 PRO HB3 H -2.774 6.756 3.915 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HB3 . . . . . . . . . c19595_2mgo 1 . 13 . 1710 . 1 1 7 PRO HD2 H -0.028 4.003 3.780 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HD2 . . . . . . . . . c19595_2mgo 1 . 13 . 1711 . 1 1 7 PRO HD3 H -1.281 3.070 4.628 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HD3 . . . . . . . . . c19595_2mgo 1 . 13 . 1712 . 1 1 7 PRO HG2 H -0.785 5.632 5.244 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HG2 . . . . . . . . . c19595_2mgo 1 . 13 . 1713 . 1 1 7 PRO HG3 H -2.416 4.942 5.314 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HG3 . . . . . . . . . c19595_2mgo 1 . 13 . 1714 . 1 1 7 PRO N N -1.885 3.865 2.759 . . . 1.0 . . . . . . . . . . . . A . 7 PRO N . . . . . . . . . c19595_2mgo 1 . 13 . 1715 . 1 1 7 PRO O O -1.053 6.038 0.830 . . . 1.0 . . . . . . . . . . . . A . 7 PRO O . . . . . . . . . c19595_2mgo 1 . 13 . 1716 . 1 1 8 LEU C C -3.674 7.463 -1.431 . . . 1.0 . . . . . . . . . . . . A . 8 LEU C . . . . . . . . . c19595_2mgo 1 . 13 . 1717 . 1 1 8 LEU CA C -2.964 6.165 -1.157 . . . 1.0 . . . . . . . . . . . . A . 8 LEU CA . . . . . . . . . c19595_2mgo 1 . 13 . 1718 . 1 1 8 LEU CB C -3.401 5.125 -2.168 . . . 1.0 . . . . . . . . . . . . A . 8 LEU CB . . . . . . . . . c19595_2mgo 1 . 13 . 1719 . 1 1 8 LEU CD1 C -3.178 2.895 -3.285 . . . 1.0 . . . . . . . . . . . . A . 8 LEU CD1 . . . . . . . . . c19595_2mgo 1 . 13 . 1720 . 1 1 8 LEU CD2 C -1.125 4.098 -2.517 . . . 1.0 . . . . . . . . . . . . A . 8 LEU CD2 . . . . . . . . . c19595_2mgo 1 . 13 . 1721 . 1 1 8 LEU CG C -2.598 3.820 -2.228 . . . 1.0 . . . . . . . . . . . . A . 8 LEU CG . . . . . . . . . c19595_2mgo 1 . 13 . 1722 . 1 1 8 LEU H H -4.075 5.374 0.475 . . . 1.0 . . . . . . . . . . . . A . 8 LEU H . . . . . . . . . c19595_2mgo 1 . 13 . 1723 . 1 1 8 LEU HA H -1.909 6.340 -1.267 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HA . . . . . . . . . c19595_2mgo 1 . 13 . 1724 . 1 1 8 LEU HB2 H -4.432 4.880 -1.954 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HB2 . . . . . . . . . c19595_2mgo 1 . 13 . 1725 . 1 1 8 LEU HB3 H -3.362 5.622 -3.123 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HB3 . . . . . . . . . c19595_2mgo 1 . 13 . 1726 . 1 1 8 LEU HD11 H -3.150 3.386 -4.247 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HD11 . . . . . . . . . c19595_2mgo 1 . 13 . 1727 . 1 1 8 LEU HD12 H -4.199 2.653 -3.032 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HD12 . . . . . . . . . c19595_2mgo 1 . 13 . 1728 . 1 1 8 LEU HD13 H -2.593 1.989 -3.329 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HD13 . . . . . . . . . c19595_2mgo 1 . 13 . 1729 . 1 1 8 LEU HD21 H -0.694 4.677 -1.715 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HD21 . . . . . . . . . c19595_2mgo 1 . 13 . 1730 . 1 1 8 LEU HD22 H -1.035 4.638 -3.448 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HD22 . . . . . . . . . c19595_2mgo 1 . 13 . 1731 . 1 1 8 LEU HD23 H -0.600 3.157 -2.602 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HD23 . . . . . . . . . c19595_2mgo 1 . 13 . 1732 . 1 1 8 LEU HG H -2.671 3.321 -1.273 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HG . . . . . . . . . c19595_2mgo 1 . 13 . 1733 . 1 1 8 LEU N N -3.186 5.701 0.213 . . . 1.0 . . . . . . . . . . . . A . 8 LEU N . . . . . . . . . c19595_2mgo 1 . 13 . 1734 . 1 1 8 LEU O O -3.679 7.981 -2.555 . . . 1.0 . . . . . . . . . . . . A . 8 LEU O . . . . . . . . . c19595_2mgo 1 . 13 . 1735 . 1 1 9 GLY C C -6.299 9.068 0.135 . . . 1.0 . . . . . . . . . . . . A . 9 GLY C . . . . . . . . . c19595_2mgo 1 . 13 . 1736 . 1 1 9 GLY CA C -4.969 9.204 -0.522 . . . 1.0 . . . . . . . . . . . . A . 9 GLY CA . . . . . . . . . c19595_2mgo 1 . 13 . 1737 . 1 1 9 GLY H H -4.144 7.468 0.401 . . . 1.0 . . . . . . . . . . . . A . 9 GLY H . . . . . . . . . c19595_2mgo 1 . 13 . 1738 . 1 1 9 GLY HA2 H -4.408 9.991 -0.039 . . . 1.0 . . . . . . . . . . . . A . 9 GLY HA2 . . . . . . . . . c19595_2mgo 1 . 13 . 1739 . 1 1 9 GLY HA3 H -5.114 9.455 -1.562 . . . 1.0 . . . . . . . . . . . . A . 9 GLY HA3 . . . . . . . . . c19595_2mgo 1 . 13 . 1740 . 1 1 9 GLY N N -4.240 7.978 -0.426 . . . 1.0 . . . . . . . . . . . . A . 9 GLY N . . . . . . . . . c19595_2mgo 1 . 13 . 1741 . 1 1 9 GLY O O -7.270 8.689 -0.532 . . . 1.0 . . . . . . . . . . . . A . 9 GLY O . . . . . . . . . c19595_2mgo 1 . 13 . 1742 . 1 1 9 GLY OXT O -6.383 9.273 1.359 . . . 1.0 . . . . . . . . . . . . A . 9 GLY OXT . . . . . . . . . c19595_2mgo 1 . 14 . 1743 . 1 1 1 CYS C C 4.413 0.053 -0.640 . . . 1.0 . . . . . . . . . . . . A . 1 CYS C . . . . . . . . . c19595_2mgo 1 . 14 . 1744 . 1 1 1 CYS CA C 4.254 1.347 0.134 . . . 1.0 . . . . . . . . . . . . A . 1 CYS CA . . . . . . . . . c19595_2mgo 1 . 14 . 1745 . 1 1 1 CYS CB C 2.836 1.445 0.679 . . . 1.0 . . . . . . . . . . . . A . 1 CYS CB . . . . . . . . . c19595_2mgo 1 . 14 . 1746 . 1 1 1 CYS H1 H 5.495 2.402 -1.107 . . . 1.0 . . . . . . . . . . . . A . 1 CYS H1 . . . . . . . . . c19595_2mgo 1 . 14 . 1747 . 1 1 1 CYS H2 H 4.349 3.371 -0.300 . . . 1.0 . . . . . . . . . . . . A . 1 CYS H2 . . . . . . . . . c19595_2mgo 1 . 14 . 1748 . 1 1 1 CYS H3 H 3.893 2.367 -1.581 . . . 1.0 . . . . . . . . . . . . A . 1 CYS H3 . . . . . . . . . c19595_2mgo 1 . 14 . 1749 . 1 1 1 CYS HA H 4.961 1.369 0.945 . . . 1.0 . . . . . . . . . . . . A . 1 CYS HA . . . . . . . . . c19595_2mgo 1 . 14 . 1750 . 1 1 1 CYS HB2 H 2.130 1.266 -0.114 . . . 1.0 . . . . . . . . . . . . A . 1 CYS HB2 . . . . . . . . . c19595_2mgo 1 . 14 . 1751 . 1 1 1 CYS HB3 H 2.702 0.680 1.427 . . . 1.0 . . . . . . . . . . . . A . 1 CYS HB3 . . . . . . . . . c19595_2mgo 1 . 14 . 1752 . 1 1 1 CYS N N 4.518 2.456 -0.755 . . . 1.0 . . . . . . . . . . . . A . 1 CYS N . . . . . . . . . c19595_2mgo 1 . 14 . 1753 . 1 1 1 CYS O O 4.054 -0.009 -1.816 . . . 1.0 . . . . . . . . . . . . A . 1 CYS O . . . . . . . . . c19595_2mgo 1 . 14 . 1754 . 1 1 1 CYS SG S 2.412 3.049 1.453 . . . 1.0 . . . . . . . . . . . . A . 1 CYS SG . . . . . . . . . c19595_2mgo 1 . 14 . 1755 . 1 1 2 TYR C C 3.953 -3.152 -0.517 . . . 1.0 . . . . . . . . . . . . A . 2 TYR C . . . . . . . . . c19595_2mgo 1 . 14 . 1756 . 1 1 2 TYR CA C 5.153 -2.245 -0.696 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CA . . . . . . . . . c19595_2mgo 1 . 14 . 1757 . 1 1 2 TYR CB C 6.454 -2.948 -0.246 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CB . . . . . . . . . c19595_2mgo 1 . 14 . 1758 . 1 1 2 TYR CD1 C 6.682 -2.740 2.269 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CD1 . . . . . . . . . c19595_2mgo 1 . 14 . 1759 . 1 1 2 TYR CD2 C 6.171 -4.879 1.373 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CD2 . . . . . . . . . c19595_2mgo 1 . 14 . 1760 . 1 1 2 TYR CE1 C 6.668 -3.269 3.538 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CE1 . . . . . . . . . c19595_2mgo 1 . 14 . 1761 . 1 1 2 TYR CE2 C 6.157 -5.414 2.641 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CE2 . . . . . . . . . c19595_2mgo 1 . 14 . 1762 . 1 1 2 TYR CG C 6.435 -3.528 1.162 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CG . . . . . . . . . c19595_2mgo 1 . 14 . 1763 . 1 1 2 TYR CZ C 6.405 -4.603 3.719 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CZ . . . . . . . . . c19595_2mgo 1 . 14 . 1764 . 1 1 2 TYR H H 5.211 -0.913 0.939 . . . 1.0 . . . . . . . . . . . . A . 2 TYR H . . . . . . . . . c19595_2mgo 1 . 14 . 1765 . 1 1 2 TYR HA H 5.221 -2.006 -1.744 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HA . . . . . . . . . c19595_2mgo 1 . 14 . 1766 . 1 1 2 TYR HB2 H 6.652 -3.764 -0.924 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HB2 . . . . . . . . . c19595_2mgo 1 . 14 . 1767 . 1 1 2 TYR HB3 H 7.269 -2.242 -0.306 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HB3 . . . . . . . . . c19595_2mgo 1 . 14 . 1768 . 1 1 2 TYR HD1 H 6.890 -1.688 2.136 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HD1 . . . . . . . . . c19595_2mgo 1 . 14 . 1769 . 1 1 2 TYR HD2 H 5.973 -5.517 0.523 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HD2 . . . . . . . . . c19595_2mgo 1 . 14 . 1770 . 1 1 2 TYR HE1 H 6.862 -2.623 4.380 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HE1 . . . . . . . . . c19595_2mgo 1 . 14 . 1771 . 1 1 2 TYR HE2 H 5.948 -6.464 2.776 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HE2 . . . . . . . . . c19595_2mgo 1 . 14 . 1772 . 1 1 2 TYR HH H 5.867 -4.554 5.547 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HH . . . . . . . . . c19595_2mgo 1 . 14 . 1773 . 1 1 2 TYR N N 4.944 -0.983 -0.004 . . . 1.0 . . . . . . . . . . . . A . 2 TYR N . . . . . . . . . c19595_2mgo 1 . 14 . 1774 . 1 1 2 TYR O O 3.893 -4.247 -1.049 . . . 1.0 . . . . . . . . . . . . A . 2 TYR O . . . . . . . . . c19595_2mgo 1 . 14 . 1775 . 1 1 2 TYR OH O 6.397 -5.132 4.983 . . . 1.0 . . . . . . . . . . . . A . 2 TYR OH . . . . . . . . . c19595_2mgo 1 . 14 . 1776 . 1 1 3 ILE C C 0.633 -2.646 -0.081 . . . 1.0 . . . . . . . . . . . . A . 3 ILE C . . . . . . . . . c19595_2mgo 1 . 14 . 1777 . 1 1 3 ILE CA C 1.821 -3.393 0.475 . . . 1.0 . . . . . . . . . . . . A . 3 ILE CA . . . . . . . . . c19595_2mgo 1 . 14 . 1778 . 1 1 3 ILE CB C 1.644 -3.776 1.989 . . . 1.0 . . . . . . . . . . . . A . 3 ILE CB . . . . . . . . . c19595_2mgo 1 . 14 . 1779 . 1 1 3 ILE CD1 C 1.150 -1.421 2.970 . . . 1.0 . . . . . . . . . . . . A . 3 ILE CD1 . . . . . . . . . c19595_2mgo 1 . 14 . 1780 . 1 1 3 ILE CG1 C 2.047 -2.639 2.970 . . . 1.0 . . . . . . . . . . . . A . 3 ILE CG1 . . . . . . . . . c19595_2mgo 1 . 14 . 1781 . 1 1 3 ILE CG2 C 2.404 -5.050 2.317 . . . 1.0 . . . . . . . . . . . . A . 3 ILE CG2 . . . . . . . . . c19595_2mgo 1 . 14 . 1782 . 1 1 3 ILE H H 3.084 -1.788 0.598 . . . 1.0 . . . . . . . . . . . . A . 3 ILE H . . . . . . . . . c19595_2mgo 1 . 14 . 1783 . 1 1 3 ILE HA H 1.904 -4.308 -0.093 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HA . . . . . . . . . c19595_2mgo 1 . 14 . 1784 . 1 1 3 ILE HB H 0.595 -3.989 2.115 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HB . . . . . . . . . c19595_2mgo 1 . 14 . 1785 . 1 1 3 ILE HD11 H 1.146 -0.986 1.983 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HD11 . . . . . . . . . c19595_2mgo 1 . 14 . 1786 . 1 1 3 ILE HD12 H 1.520 -0.698 3.681 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HD12 . . . . . . . . . c19595_2mgo 1 . 14 . 1787 . 1 1 3 ILE HD13 H 0.147 -1.711 3.240 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HD13 . . . . . . . . . c19595_2mgo 1 . 14 . 1788 . 1 1 3 ILE HG12 H 2.051 -3.033 3.975 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HG12 . . . . . . . . . c19595_2mgo 1 . 14 . 1789 . 1 1 3 ILE HG13 H 3.048 -2.320 2.724 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HG13 . . . . . . . . . c19595_2mgo 1 . 14 . 1790 . 1 1 3 ILE HG21 H 3.455 -4.904 2.111 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HG21 . . . . . . . . . c19595_2mgo 1 . 14 . 1791 . 1 1 3 ILE HG22 H 2.028 -5.864 1.713 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HG22 . . . . . . . . . c19595_2mgo 1 . 14 . 1792 . 1 1 3 ILE HG23 H 2.274 -5.288 3.363 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HG23 . . . . . . . . . c19595_2mgo 1 . 14 . 1793 . 1 1 3 ILE N N 3.006 -2.683 0.223 . . . 1.0 . . . . . . . . . . . . A . 3 ILE N . . . . . . . . . c19595_2mgo 1 . 14 . 1794 . 1 1 3 ILE O O 0.627 -1.411 -0.150 . . . 1.0 . . . . . . . . . . . . A . 3 ILE O . . . . . . . . . c19595_2mgo 1 . 14 . 1795 . 1 1 4 GLN C C -2.538 -2.353 -0.005 . . . 1.0 . . . . . . . . . . . . A . 4 GLN C . . . . . . . . . c19595_2mgo 1 . 14 . 1796 . 1 1 4 GLN CA C -1.578 -2.842 -1.060 . . . 1.0 . . . . . . . . . . . . A . 4 GLN CA . . . . . . . . . c19595_2mgo 1 . 14 . 1797 . 1 1 4 GLN CB C -2.274 -3.873 -1.926 . . . 1.0 . . . . . . . . . . . . A . 4 GLN CB . . . . . . . . . c19595_2mgo 1 . 14 . 1798 . 1 1 4 GLN CD C -2.183 -5.436 -3.869 . . . 1.0 . . . . . . . . . . . . A . 4 GLN CD . . . . . . . . . c19595_2mgo 1 . 14 . 1799 . 1 1 4 GLN CG C -1.427 -4.434 -3.040 . . . 1.0 . . . . . . . . . . . . A . 4 GLN CG . . . . . . . . . c19595_2mgo 1 . 14 . 1800 . 1 1 4 GLN H H -0.245 -4.345 -0.315 . . . 1.0 . . . . . . . . . . . . A . 4 GLN H . . . . . . . . . c19595_2mgo 1 . 14 . 1801 . 1 1 4 GLN HA H -1.292 -2.002 -1.668 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HA . . . . . . . . . c19595_2mgo 1 . 14 . 1802 . 1 1 4 GLN HB2 H -2.589 -4.694 -1.300 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HB2 . . . . . . . . . c19595_2mgo 1 . 14 . 1803 . 1 1 4 GLN HB3 H -3.151 -3.418 -2.365 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HB3 . . . . . . . . . c19595_2mgo 1 . 14 . 1804 . 1 1 4 GLN HE21 H -1.082 -5.023 -5.456 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HE21 . . . . . . . . . c19595_2mgo 1 . 14 . 1805 . 1 1 4 GLN HE22 H -2.303 -6.229 -5.654 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HE22 . . . . . . . . . c19595_2mgo 1 . 14 . 1806 . 1 1 4 GLN HG2 H -1.117 -3.620 -3.678 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HG2 . . . . . . . . . c19595_2mgo 1 . 14 . 1807 . 1 1 4 GLN HG3 H -0.559 -4.915 -2.614 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HG3 . . . . . . . . . c19595_2mgo 1 . 14 . 1808 . 1 1 4 GLN N N -0.359 -3.383 -0.456 . . . 1.0 . . . . . . . . . . . . A . 4 GLN N . . . . . . . . . c19595_2mgo 1 . 14 . 1809 . 1 1 4 GLN NE2 N -1.820 -5.569 -5.109 . . . 1.0 . . . . . . . . . . . . A . 4 GLN NE2 . . . . . . . . . c19595_2mgo 1 . 14 . 1810 . 1 1 4 GLN O O -3.621 -1.895 -0.307 . . . 1.0 . . . . . . . . . . . . A . 4 GLN O . . . . . . . . . c19595_2mgo 1 . 14 . 1811 . 1 1 4 GLN OE1 O -3.091 -6.105 -3.373 . . . 1.0 . . . . . . . . . . . . A . 4 GLN OE1 . . . . . . . . . c19595_2mgo 1 . 14 . 1812 . 1 1 5 ASN C C -2.704 -0.465 2.549 . . . 1.0 . . . . . . . . . . . . A . 5 ASN C . . . . . . . . . c19595_2mgo 1 . 14 . 1813 . 1 1 5 ASN CA C -2.935 -1.947 2.348 . . . 1.0 . . . . . . . . . . . . A . 5 ASN CA . . . . . . . . . c19595_2mgo 1 . 14 . 1814 . 1 1 5 ASN CB C -2.634 -2.723 3.645 . . . 1.0 . . . . . . . . . . . . A . 5 ASN CB . . . . . . . . . c19595_2mgo 1 . 14 . 1815 . 1 1 5 ASN CG C -2.953 -4.209 3.567 . . . 1.0 . . . . . . . . . . . . A . 5 ASN CG . . . . . . . . . c19595_2mgo 1 . 14 . 1816 . 1 1 5 ASN H H -1.221 -2.787 1.353 . . . 1.0 . . . . . . . . . . . . A . 5 ASN H . . . . . . . . . c19595_2mgo 1 . 14 . 1817 . 1 1 5 ASN HA H -3.966 -2.088 2.066 . . . 1.0 . . . . . . . . . . . . A . 5 ASN HA . . . . . . . . . c19595_2mgo 1 . 14 . 1818 . 1 1 5 ASN HB2 H -1.587 -2.622 3.891 . . . 1.0 . . . . . . . . . . . . A . 5 ASN HB2 . . . . . . . . . c19595_2mgo 1 . 14 . 1819 . 1 1 5 ASN HB3 H -3.222 -2.292 4.440 . . . 1.0 . . . . . . . . . . . . A . 5 ASN HB3 . . . . . . . . . c19595_2mgo 1 . 14 . 1820 . 1 1 5 ASN HD21 H -3.380 -4.265 5.502 . . . 1.0 . . . . . . . . . . . . A . 5 ASN HD21 . . . . . . . . . c19595_2mgo 1 . 14 . 1821 . 1 1 5 ASN HD22 H -3.517 -5.751 4.641 . . . 1.0 . . . . . . . . . . . . A . 5 ASN HD22 . . . . . . . . . c19595_2mgo 1 . 14 . 1822 . 1 1 5 ASN N N -2.113 -2.411 1.222 . . . 1.0 . . . . . . . . . . . . A . 5 ASN N . . . . . . . . . c19595_2mgo 1 . 14 . 1823 . 1 1 5 ASN ND2 N -3.319 -4.790 4.675 . . . 1.0 . . . . . . . . . . . . A . 5 ASN ND2 . . . . . . . . . c19595_2mgo 1 . 14 . 1824 . 1 1 5 ASN O O -3.183 0.152 3.506 . . . 1.0 . . . . . . . . . . . . A . 5 ASN O . . . . . . . . . c19595_2mgo 1 . 14 . 1825 . 1 1 5 ASN OD1 O -2.868 -4.832 2.506 . . . 1.0 . . . . . . . . . . . . A . 5 ASN OD1 . . . . . . . . . c19595_2mgo 1 . 14 . 1826 . 1 1 6 CYS C C -2.618 2.100 0.581 . . . 1.0 . . . . . . . . . . . . A . 6 CYS C . . . . . . . . . c19595_2mgo 1 . 14 . 1827 . 1 1 6 CYS CA C -1.643 1.468 1.564 . . . 1.0 . . . . . . . . . . . . A . 6 CYS CA . . . . . . . . . c19595_2mgo 1 . 14 . 1828 . 1 1 6 CYS CB C -0.210 1.604 1.050 . . . 1.0 . . . . . . . . . . . . A . 6 CYS CB . . . . . . . . . c19595_2mgo 1 . 14 . 1829 . 1 1 6 CYS H H -1.645 -0.515 0.922 . . . 1.0 . . . . . . . . . . . . A . 6 CYS H . . . . . . . . . c19595_2mgo 1 . 14 . 1830 . 1 1 6 CYS HA H -1.725 1.911 2.544 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HA . . . . . . . . . c19595_2mgo 1 . 14 . 1831 . 1 1 6 CYS HB2 H 0.444 1.048 1.705 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HB2 . . . . . . . . . c19595_2mgo 1 . 14 . 1832 . 1 1 6 CYS HB3 H -0.160 1.171 0.061 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HB3 . . . . . . . . . c19595_2mgo 1 . 14 . 1833 . 1 1 6 CYS N N -1.967 0.080 1.631 . . . 1.0 . . . . . . . . . . . . A . 6 CYS N . . . . . . . . . c19595_2mgo 1 . 14 . 1834 . 1 1 6 CYS O O -2.579 1.786 -0.614 . . . 1.0 . . . . . . . . . . . . A . 6 CYS O . . . . . . . . . c19595_2mgo 1 . 14 . 1835 . 1 1 6 CYS SG S 0.457 3.297 0.950 . . . 1.0 . . . . . . . . . . . . A . 6 CYS SG . . . . . . . . . c19595_2mgo 1 . 14 . 1836 . 1 1 7 PRO C C -3.989 4.560 -0.739 . . . 1.0 . . . . . . . . . . . . A . 7 PRO C . . . . . . . . . c19595_2mgo 1 . 14 . 1837 . 1 1 7 PRO CA C -4.575 3.534 0.227 . . . 1.0 . . . . . . . . . . . . A . 7 PRO CA . . . . . . . . . c19595_2mgo 1 . 14 . 1838 . 1 1 7 PRO CB C -5.513 4.223 1.228 . . . 1.0 . . . . . . . . . . . . A . 7 PRO CB . . . . . . . . . c19595_2mgo 1 . 14 . 1839 . 1 1 7 PRO CD C -3.729 3.280 2.470 . . . 1.0 . . . . . . . . . . . . A . 7 PRO CD . . . . . . . . . c19595_2mgo 1 . 14 . 1840 . 1 1 7 PRO CG C -5.181 3.623 2.541 . . . 1.0 . . . . . . . . . . . . A . 7 PRO CG . . . . . . . . . c19595_2mgo 1 . 14 . 1841 . 1 1 7 PRO HA H -5.126 2.792 -0.328 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HA . . . . . . . . . c19595_2mgo 1 . 14 . 1842 . 1 1 7 PRO HB2 H -5.326 5.285 1.219 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HB2 . . . . . . . . . c19595_2mgo 1 . 14 . 1843 . 1 1 7 PRO HB3 H -6.540 4.030 0.954 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HB3 . . . . . . . . . c19595_2mgo 1 . 14 . 1844 . 1 1 7 PRO HD2 H -3.120 4.137 2.715 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HD2 . . . . . . . . . c19595_2mgo 1 . 14 . 1845 . 1 1 7 PRO HD3 H -3.519 2.445 3.122 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HD3 . . . . . . . . . c19595_2mgo 1 . 14 . 1846 . 1 1 7 PRO HG2 H -5.368 4.334 3.333 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HG2 . . . . . . . . . c19595_2mgo 1 . 14 . 1847 . 1 1 7 PRO HG3 H -5.770 2.730 2.693 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HG3 . . . . . . . . . c19595_2mgo 1 . 14 . 1848 . 1 1 7 PRO N N -3.560 2.909 1.066 . . . 1.0 . . . . . . . . . . . . A . 7 PRO N . . . . . . . . . c19595_2mgo 1 . 14 . 1849 . 1 1 7 PRO O O -3.379 5.554 -0.329 . . . 1.0 . . . . . . . . . . . . A . 7 PRO O . . . . . . . . . c19595_2mgo 1 . 14 . 1850 . 1 1 8 LEU C C -4.940 5.724 -3.763 . . . 1.0 . . . . . . . . . . . . A . 8 LEU C . . . . . . . . . c19595_2mgo 1 . 14 . 1851 . 1 1 8 LEU CA C -3.713 5.193 -3.060 . . . 1.0 . . . . . . . . . . . . A . 8 LEU CA . . . . . . . . . c19595_2mgo 1 . 14 . 1852 . 1 1 8 LEU CB C -2.811 4.482 -4.056 . . . 1.0 . . . . . . . . . . . . A . 8 LEU CB . . . . . . . . . c19595_2mgo 1 . 14 . 1853 . 1 1 8 LEU CD1 C -0.773 3.144 -4.610 . . . 1.0 . . . . . . . . . . . . A . 8 LEU CD1 . . . . . . . . . c19595_2mgo 1 . 14 . 1854 . 1 1 8 LEU CD2 C -0.661 4.887 -2.819 . . . 1.0 . . . . . . . . . . . . A . 8 LEU CD2 . . . . . . . . . c19595_2mgo 1 . 14 . 1855 . 1 1 8 LEU CG C -1.537 3.845 -3.500 . . . 1.0 . . . . . . . . . . . . A . 8 LEU CG . . . . . . . . . c19595_2mgo 1 . 14 . 1856 . 1 1 8 LEU H H -4.492 3.403 -2.260 . . . 1.0 . . . . . . . . . . . . A . 8 LEU H . . . . . . . . . c19595_2mgo 1 . 14 . 1857 . 1 1 8 LEU HA H -3.197 6.013 -2.603 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HA . . . . . . . . . c19595_2mgo 1 . 14 . 1858 . 1 1 8 LEU HB2 H -3.396 3.711 -4.534 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HB2 . . . . . . . . . c19595_2mgo 1 . 14 . 1859 . 1 1 8 LEU HB3 H -2.535 5.207 -4.804 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HB3 . . . . . . . . . c19595_2mgo 1 . 14 . 1860 . 1 1 8 LEU HD11 H -1.396 2.379 -5.049 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HD11 . . . . . . . . . c19595_2mgo 1 . 14 . 1861 . 1 1 8 LEU HD12 H 0.118 2.690 -4.204 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HD12 . . . . . . . . . c19595_2mgo 1 . 14 . 1862 . 1 1 8 LEU HD13 H -0.498 3.862 -5.368 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HD13 . . . . . . . . . c19595_2mgo 1 . 14 . 1863 . 1 1 8 LEU HD21 H 0.249 4.426 -2.466 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HD21 . . . . . . . . . c19595_2mgo 1 . 14 . 1864 . 1 1 8 LEU HD22 H -1.197 5.319 -1.986 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HD22 . . . . . . . . . c19595_2mgo 1 . 14 . 1865 . 1 1 8 LEU HD23 H -0.424 5.666 -3.528 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HD23 . . . . . . . . . c19595_2mgo 1 . 14 . 1866 . 1 1 8 LEU HG H -1.813 3.098 -2.769 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HG . . . . . . . . . c19595_2mgo 1 . 14 . 1867 . 1 1 8 LEU N N -4.127 4.278 -2.009 . . . 1.0 . . . . . . . . . . . . A . 8 LEU N . . . . . . . . . c19595_2mgo 1 . 14 . 1868 . 1 1 8 LEU O O -4.897 6.673 -4.558 . . . 1.0 . . . . . . . . . . . . A . 8 LEU O . . . . . . . . . c19595_2mgo 1 . 14 . 1869 . 1 1 9 GLY C C -8.343 4.748 -3.153 . . . 1.0 . . . . . . . . . . . . A . 9 GLY C . . . . . . . . . c19595_2mgo 1 . 14 . 1870 . 1 1 9 GLY CA C -7.277 5.384 -3.993 . . . 1.0 . . . . . . . . . . . . A . 9 GLY CA . . . . . . . . . c19595_2mgo 1 . 14 . 1871 . 1 1 9 GLY H H -5.866 4.445 -2.738 . . . 1.0 . . . . . . . . . . . . A . 9 GLY H . . . . . . . . . c19595_2mgo 1 . 14 . 1872 . 1 1 9 GLY HA2 H -7.431 6.451 -4.031 . . . 1.0 . . . . . . . . . . . . A . 9 GLY HA2 . . . . . . . . . c19595_2mgo 1 . 14 . 1873 . 1 1 9 GLY HA3 H -7.328 4.970 -4.990 . . . 1.0 . . . . . . . . . . . . A . 9 GLY HA3 . . . . . . . . . c19595_2mgo 1 . 14 . 1874 . 1 1 9 GLY N N -5.999 5.117 -3.435 . . . 1.0 . . . . . . . . . . . . A . 9 GLY N . . . . . . . . . c19595_2mgo 1 . 14 . 1875 . 1 1 9 GLY O O -8.883 5.426 -2.250 . . . 1.0 . . . . . . . . . . . . A . 9 GLY O . . . . . . . . . c19595_2mgo 1 . 14 . 1876 . 1 1 9 GLY OXT O -8.607 3.547 -3.329 . . . 1.0 . . . . . . . . . . . . A . 9 GLY OXT . . . . . . . . . c19595_2mgo 1 . 15 . 1877 . 1 1 1 CYS C C 4.719 0.557 -0.659 . . . 1.0 . . . . . . . . . . . . A . 1 CYS C . . . . . . . . . c19595_2mgo 1 . 15 . 1878 . 1 1 1 CYS CA C 4.967 1.510 0.503 . . . 1.0 . . . . . . . . . . . . A . 1 CYS CA . . . . . . . . . c19595_2mgo 1 . 15 . 1879 . 1 1 1 CYS CB C 3.657 1.932 1.162 . . . 1.0 . . . . . . . . . . . . A . 1 CYS CB . . . . . . . . . c19595_2mgo 1 . 15 . 1880 . 1 1 1 CYS H1 H 6.611 2.368 -0.326 . . . 1.0 . . . . . . . . . . . . A . 1 CYS H1 . . . . . . . . . c19595_2mgo 1 . 15 . 1881 . 1 1 1 CYS H2 H 5.839 3.346 0.830 . . . 1.0 . . . . . . . . . . . . A . 1 CYS H2 . . . . . . . . . c19595_2mgo 1 . 15 . 1882 . 1 1 1 CYS H3 H 5.163 3.140 -0.713 . . . 1.0 . . . . . . . . . . . . A . 1 CYS H3 . . . . . . . . . c19595_2mgo 1 . 15 . 1883 . 1 1 1 CYS HA H 5.583 1.008 1.232 . . . 1.0 . . . . . . . . . . . . A . 1 CYS HA . . . . . . . . . c19595_2mgo 1 . 15 . 1884 . 1 1 1 CYS HB2 H 3.076 1.048 1.372 . . . 1.0 . . . . . . . . . . . . A . 1 CYS HB2 . . . . . . . . . c19595_2mgo 1 . 15 . 1885 . 1 1 1 CYS HB3 H 3.859 2.445 2.091 . . . 1.0 . . . . . . . . . . . . A . 1 CYS HB3 . . . . . . . . . c19595_2mgo 1 . 15 . 1886 . 1 1 1 CYS N N 5.694 2.675 0.051 . . . 1.0 . . . . . . . . . . . . A . 1 CYS N . . . . . . . . . c19595_2mgo 1 . 15 . 1887 . 1 1 1 CYS O O 4.562 0.991 -1.801 . . . 1.0 . . . . . . . . . . . . A . 1 CYS O . . . . . . . . . c19595_2mgo 1 . 15 . 1888 . 1 1 1 CYS SG S 2.612 3.018 0.153 . . . 1.0 . . . . . . . . . . . . A . 1 CYS SG . . . . . . . . . c19595_2mgo 1 . 15 . 1889 . 1 1 2 TYR C C 3.459 -2.760 -0.963 . . . 1.0 . . . . . . . . . . . . A . 2 TYR C . . . . . . . . . c19595_2mgo 1 . 15 . 1890 . 1 1 2 TYR CA C 4.494 -1.741 -1.408 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CA . . . . . . . . . c19595_2mgo 1 . 15 . 1891 . 1 1 2 TYR CB C 5.806 -2.432 -1.807 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CB . . . . . . . . . c19595_2mgo 1 . 15 . 1892 . 1 1 2 TYR CD1 C 6.342 -4.123 0.006 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CD1 . . . . . . . . . c19595_2mgo 1 . 15 . 1893 . 1 1 2 TYR CD2 C 7.692 -2.181 -0.174 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CD2 . . . . . . . . . c19595_2mgo 1 . 15 . 1894 . 1 1 2 TYR CE1 C 7.093 -4.550 1.074 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CE1 . . . . . . . . . c19595_2mgo 1 . 15 . 1895 . 1 1 2 TYR CE2 C 8.441 -2.596 0.889 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CE2 . . . . . . . . . c19595_2mgo 1 . 15 . 1896 . 1 1 2 TYR CG C 6.631 -2.927 -0.638 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CG . . . . . . . . . c19595_2mgo 1 . 15 . 1897 . 1 1 2 TYR CZ C 8.144 -3.778 1.514 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CZ . . . . . . . . . c19595_2mgo 1 . 15 . 1898 . 1 1 2 TYR H H 4.929 -1.067 0.517 . . . 1.0 . . . . . . . . . . . . A . 2 TYR H . . . . . . . . . c19595_2mgo 1 . 15 . 1899 . 1 1 2 TYR HA H 4.103 -1.225 -2.269 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HA . . . . . . . . . c19595_2mgo 1 . 15 . 1900 . 1 1 2 TYR HB2 H 5.553 -3.294 -2.402 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HB2 . . . . . . . . . c19595_2mgo 1 . 15 . 1901 . 1 1 2 TYR HB3 H 6.411 -1.752 -2.389 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HB3 . . . . . . . . . c19595_2mgo 1 . 15 . 1902 . 1 1 2 TYR HD1 H 5.518 -4.730 -0.342 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HD1 . . . . . . . . . c19595_2mgo 1 . 15 . 1903 . 1 1 2 TYR HD2 H 7.932 -1.250 -0.665 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HD2 . . . . . . . . . c19595_2mgo 1 . 15 . 1904 . 1 1 2 TYR HE1 H 6.849 -5.485 1.556 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HE1 . . . . . . . . . c19595_2mgo 1 . 15 . 1905 . 1 1 2 TYR HE2 H 9.265 -1.982 1.219 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HE2 . . . . . . . . . c19595_2mgo 1 . 15 . 1906 . 1 1 2 TYR HH H 9.126 -5.113 2.448 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HH . . . . . . . . . c19595_2mgo 1 . 15 . 1907 . 1 1 2 TYR N N 4.729 -0.739 -0.386 . . . 1.0 . . . . . . . . . . . . A . 2 TYR N . . . . . . . . . c19595_2mgo 1 . 15 . 1908 . 1 1 2 TYR O O 3.253 -3.779 -1.619 . . . 1.0 . . . . . . . . . . . . A . 2 TYR O . . . . . . . . . c19595_2mgo 1 . 15 . 1909 . 1 1 2 TYR OH O 8.891 -4.187 2.585 . . . 1.0 . . . . . . . . . . . . A . 2 TYR OH . . . . . . . . . c19595_2mgo 1 . 15 . 1910 . 1 1 3 ILE C C 0.503 -3.100 -0.089 . . . 1.0 . . . . . . . . . . . . A . 3 ILE C . . . . . . . . . c19595_2mgo 1 . 15 . 1911 . 1 1 3 ILE CA C 1.797 -3.344 0.639 . . . 1.0 . . . . . . . . . . . . A . 3 ILE CA . . . . . . . . . c19595_2mgo 1 . 15 . 1912 . 1 1 3 ILE CB C 1.583 -3.201 2.167 . . . 1.0 . . . . . . . . . . . . A . 3 ILE CB . . . . . . . . . c19595_2mgo 1 . 15 . 1913 . 1 1 3 ILE CD1 C 1.004 -1.543 4.037 . . . 1.0 . . . . . . . . . . . . A . 3 ILE CD1 . . . . . . . . . c19595_2mgo 1 . 15 . 1914 . 1 1 3 ILE CG1 C 1.247 -1.747 2.556 . . . 1.0 . . . . . . . . . . . . A . 3 ILE CG1 . . . . . . . . . c19595_2mgo 1 . 15 . 1915 . 1 1 3 ILE CG2 C 2.794 -3.720 2.927 . . . 1.0 . . . . . . . . . . . . A . 3 ILE CG2 . . . . . . . . . c19595_2mgo 1 . 15 . 1916 . 1 1 3 ILE H H 2.963 -1.652 0.623 . . . 1.0 . . . . . . . . . . . . A . 3 ILE H . . . . . . . . . c19595_2mgo 1 . 15 . 1917 . 1 1 3 ILE HA H 2.117 -4.354 0.431 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HA . . . . . . . . . c19595_2mgo 1 . 15 . 1918 . 1 1 3 ILE HB H 0.749 -3.833 2.429 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HB . . . . . . . . . c19595_2mgo 1 . 15 . 1919 . 1 1 3 ILE HD11 H 0.784 -0.503 4.227 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HD11 . . . . . . . . . c19595_2mgo 1 . 15 . 1920 . 1 1 3 ILE HD12 H 1.886 -1.831 4.589 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HD12 . . . . . . . . . c19595_2mgo 1 . 15 . 1921 . 1 1 3 ILE HD13 H 0.169 -2.150 4.353 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HD13 . . . . . . . . . c19595_2mgo 1 . 15 . 1922 . 1 1 3 ILE HG12 H 2.060 -1.099 2.262 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HG12 . . . . . . . . . c19595_2mgo 1 . 15 . 1923 . 1 1 3 ILE HG13 H 0.354 -1.444 2.028 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HG13 . . . . . . . . . c19595_2mgo 1 . 15 . 1924 . 1 1 3 ILE HG21 H 2.652 -3.549 3.984 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HG21 . . . . . . . . . c19595_2mgo 1 . 15 . 1925 . 1 1 3 ILE HG22 H 3.686 -3.216 2.586 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HG22 . . . . . . . . . c19595_2mgo 1 . 15 . 1926 . 1 1 3 ILE HG23 H 2.893 -4.779 2.750 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HG23 . . . . . . . . . c19595_2mgo 1 . 15 . 1927 . 1 1 3 ILE N N 2.802 -2.479 0.136 . . . 1.0 . . . . . . . . . . . . A . 3 ILE N . . . . . . . . . c19595_2mgo 1 . 15 . 1928 . 1 1 3 ILE O O 0.333 -2.091 -0.778 . . . 1.0 . . . . . . . . . . . . A . 3 ILE O . . . . . . . . . c19595_2mgo 1 . 15 . 1929 . 1 1 4 GLN C C -2.740 -3.143 0.137 . . . 1.0 . . . . . . . . . . . . A . 4 GLN C . . . . . . . . . c19595_2mgo 1 . 15 . 1930 . 1 1 4 GLN CA C -1.679 -3.983 -0.582 . . . 1.0 . . . . . . . . . . . . A . 4 GLN CA . . . . . . . . . c19595_2mgo 1 . 15 . 1931 . 1 1 4 GLN CB C -2.153 -5.416 -0.754 . . . 1.0 . . . . . . . . . . . . A . 4 GLN CB . . . . . . . . . c19595_2mgo 1 . 15 . 1932 . 1 1 4 GLN CD C -2.687 -7.595 0.344 . . . 1.0 . . . . . . . . . . . . A . 4 GLN CD . . . . . . . . . c19595_2mgo 1 . 15 . 1933 . 1 1 4 GLN CG C -2.440 -6.133 0.552 . . . 1.0 . . . . . . . . . . . . A . 4 GLN CG . . . . . . . . . c19595_2mgo 1 . 15 . 1934 . 1 1 4 GLN H H -0.146 -4.668 0.764 . . . 1.0 . . . . . . . . . . . . A . 4 GLN H . . . . . . . . . c19595_2mgo 1 . 15 . 1935 . 1 1 4 GLN HA H -1.515 -3.557 -1.559 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HA . . . . . . . . . c19595_2mgo 1 . 15 . 1936 . 1 1 4 GLN HB2 H -3.062 -5.412 -1.336 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HB2 . . . . . . . . . c19595_2mgo 1 . 15 . 1937 . 1 1 4 GLN HB3 H -1.398 -5.974 -1.287 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HB3 . . . . . . . . . c19595_2mgo 1 . 15 . 1938 . 1 1 4 GLN HE21 H -0.782 -7.967 0.641 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HE21 . . . . . . . . . c19595_2mgo 1 . 15 . 1939 . 1 1 4 GLN HE22 H -1.782 -9.337 0.297 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HE22 . . . . . . . . . c19595_2mgo 1 . 15 . 1940 . 1 1 4 GLN HG2 H -1.601 -6.008 1.221 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HG2 . . . . . . . . . c19595_2mgo 1 . 15 . 1941 . 1 1 4 GLN HG3 H -3.320 -5.694 1.001 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HG3 . . . . . . . . . c19595_2mgo 1 . 15 . 1942 . 1 1 4 GLN N N -0.396 -3.978 0.114 . . . 1.0 . . . . . . . . . . . . A . 4 GLN N . . . . . . . . . c19595_2mgo 1 . 15 . 1943 . 1 1 4 GLN NE2 N -1.652 -8.376 0.439 . . . 1.0 . . . . . . . . . . . . A . 4 GLN NE2 . . . . . . . . . c19595_2mgo 1 . 15 . 1944 . 1 1 4 GLN O O -3.938 -3.216 -0.189 . . . 1.0 . . . . . . . . . . . . A . 4 GLN O . . . . . . . . . c19595_2mgo 1 . 15 . 1945 . 1 1 4 GLN OE1 O -3.819 -8.017 0.112 . . . 1.0 . . . . . . . . . . . . A . 4 GLN OE1 . . . . . . . . . c19595_2mgo 1 . 15 . 1946 . 1 1 5 ASN C C -2.394 -0.297 2.340 . . . 1.0 . . . . . . . . . . . . A . 5 ASN C . . . . . . . . . c19595_2mgo 1 . 15 . 1947 . 1 1 5 ASN CA C -3.182 -1.489 1.837 . . . 1.0 . . . . . . . . . . . . A . 5 ASN CA . . . . . . . . . c19595_2mgo 1 . 15 . 1948 . 1 1 5 ASN CB C -3.825 -2.239 3.013 . . . 1.0 . . . . . . . . . . . . A . 5 ASN CB . . . . . . . . . c19595_2mgo 1 . 15 . 1949 . 1 1 5 ASN CG C -4.872 -1.408 3.739 . . . 1.0 . . . . . . . . . . . . A . 5 ASN CG . . . . . . . . . c19595_2mgo 1 . 15 . 1950 . 1 1 5 ASN H H -1.341 -2.266 1.221 . . . 1.0 . . . . . . . . . . . . A . 5 ASN H . . . . . . . . . c19595_2mgo 1 . 15 . 1951 . 1 1 5 ASN HA H -3.957 -1.135 1.171 . . . 1.0 . . . . . . . . . . . . A . 5 ASN HA . . . . . . . . . c19595_2mgo 1 . 15 . 1952 . 1 1 5 ASN HB2 H -4.296 -3.141 2.651 . . . 1.0 . . . . . . . . . . . . A . 5 ASN HB2 . . . . . . . . . c19595_2mgo 1 . 15 . 1953 . 1 1 5 ASN HB3 H -3.049 -2.498 3.716 . . . 1.0 . . . . . . . . . . . . A . 5 ASN HB3 . . . . . . . . . c19595_2mgo 1 . 15 . 1954 . 1 1 5 ASN HD21 H -4.367 -2.229 5.454 . . . 1.0 . . . . . . . . . . . . A . 5 ASN HD21 . . . . . . . . . c19595_2mgo 1 . 15 . 1955 . 1 1 5 ASN HD22 H -5.633 -1.058 5.528 . . . 1.0 . . . . . . . . . . . . A . 5 ASN HD22 . . . . . . . . . c19595_2mgo 1 . 15 . 1956 . 1 1 5 ASN N N -2.305 -2.335 1.067 . . . 1.0 . . . . . . . . . . . . A . 5 ASN N . . . . . . . . . c19595_2mgo 1 . 15 . 1957 . 1 1 5 ASN ND2 N -4.971 -1.579 5.030 . . . 1.0 . . . . . . . . . . . . A . 5 ASN ND2 . . . . . . . . . c19595_2mgo 1 . 15 . 1958 . 1 1 5 ASN O O -1.988 -0.223 3.502 . . . 1.0 . . . . . . . . . . . . A . 5 ASN O . . . . . . . . . c19595_2mgo 1 . 15 . 1959 . 1 1 5 ASN OD1 O -5.575 -0.599 3.129 . . . 1.0 . . . . . . . . . . . . A . 5 ASN OD1 . . . . . . . . . c19595_2mgo 1 . 15 . 1960 . 1 1 6 CYS C C -2.167 2.973 1.321 . . . 1.0 . . . . . . . . . . . . A . 6 CYS C . . . . . . . . . c19595_2mgo 1 . 15 . 1961 . 1 1 6 CYS CA C -1.348 1.763 1.735 . . . 1.0 . . . . . . . . . . . . A . 6 CYS CA . . . . . . . . . c19595_2mgo 1 . 15 . 1962 . 1 1 6 CYS CB C -0.008 1.773 1.007 . . . 1.0 . . . . . . . . . . . . A . 6 CYS CB . . . . . . . . . c19595_2mgo 1 . 15 . 1963 . 1 1 6 CYS H H -2.342 0.373 0.508 . . . 1.0 . . . . . . . . . . . . A . 6 CYS H . . . . . . . . . c19595_2mgo 1 . 15 . 1964 . 1 1 6 CYS HA H -1.167 1.793 2.799 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HA . . . . . . . . . c19595_2mgo 1 . 15 . 1965 . 1 1 6 CYS HB2 H 0.579 0.925 1.330 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HB2 . . . . . . . . . c19595_2mgo 1 . 15 . 1966 . 1 1 6 CYS HB3 H -0.183 1.700 -0.057 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HB3 . . . . . . . . . c19595_2mgo 1 . 15 . 1967 . 1 1 6 CYS N N -2.074 0.558 1.435 . . . 1.0 . . . . . . . . . . . . A . 6 CYS N . . . . . . . . . c19595_2mgo 1 . 15 . 1968 . 1 1 6 CYS O O -2.466 3.144 0.135 . . . 1.0 . . . . . . . . . . . . A . 6 CYS O . . . . . . . . . c19595_2mgo 1 . 15 . 1969 . 1 1 6 CYS SG S 0.976 3.274 1.306 . . . 1.0 . . . . . . . . . . . . A . 6 CYS SG . . . . . . . . . c19595_2mgo 1 . 15 . 1970 . 1 1 7 PRO C C -2.452 6.175 1.543 . . . 1.0 . . . . . . . . . . . . A . 7 PRO C . . . . . . . . . c19595_2mgo 1 . 15 . 1971 . 1 1 7 PRO CA C -3.347 4.994 1.965 . . . 1.0 . . . . . . . . . . . . A . 7 PRO CA . . . . . . . . . c19595_2mgo 1 . 15 . 1972 . 1 1 7 PRO CB C -4.104 5.295 3.260 . . . 1.0 . . . . . . . . . . . . A . 7 PRO CB . . . . . . . . . c19595_2mgo 1 . 15 . 1973 . 1 1 7 PRO CD C -2.360 3.659 3.728 . . . 1.0 . . . . . . . . . . . . A . 7 PRO CD . . . . . . . . . c19595_2mgo 1 . 15 . 1974 . 1 1 7 PRO CG C -3.275 4.689 4.359 . . . 1.0 . . . . . . . . . . . . A . 7 PRO CG . . . . . . . . . c19595_2mgo 1 . 15 . 1975 . 1 1 7 PRO HA H -4.048 4.786 1.172 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HA . . . . . . . . . c19595_2mgo 1 . 15 . 1976 . 1 1 7 PRO HB2 H -4.199 6.363 3.377 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HB2 . . . . . . . . . c19595_2mgo 1 . 15 . 1977 . 1 1 7 PRO HB3 H -5.085 4.845 3.217 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HB3 . . . . . . . . . c19595_2mgo 1 . 15 . 1978 . 1 1 7 PRO HD2 H -1.329 3.863 3.979 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HD2 . . . . . . . . . c19595_2mgo 1 . 15 . 1979 . 1 1 7 PRO HD3 H -2.638 2.668 4.058 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HD3 . . . . . . . . . c19595_2mgo 1 . 15 . 1980 . 1 1 7 PRO HG2 H -2.687 5.461 4.835 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HG2 . . . . . . . . . c19595_2mgo 1 . 15 . 1981 . 1 1 7 PRO HG3 H -3.921 4.221 5.086 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HG3 . . . . . . . . . c19595_2mgo 1 . 15 . 1982 . 1 1 7 PRO N N -2.583 3.811 2.274 . . . 1.0 . . . . . . . . . . . . A . 7 PRO N . . . . . . . . . c19595_2mgo 1 . 15 . 1983 . 1 1 7 PRO O O -1.910 6.899 2.379 . . . 1.0 . . . . . . . . . . . . A . 7 PRO O . . . . . . . . . c19595_2mgo 1 . 15 . 1984 . 1 1 8 LEU C C -2.328 8.595 -0.637 . . . 1.0 . . . . . . . . . . . . A . 8 LEU C . . . . . . . . . c19595_2mgo 1 . 15 . 1985 . 1 1 8 LEU CA C -1.444 7.427 -0.296 . . . 1.0 . . . . . . . . . . . . A . 8 LEU CA . . . . . . . . . c19595_2mgo 1 . 15 . 1986 . 1 1 8 LEU CB C -0.637 6.990 -1.525 . . . 1.0 . . . . . . . . . . . . A . 8 LEU CB . . . . . . . . . c19595_2mgo 1 . 15 . 1987 . 1 1 8 LEU CD1 C 1.018 5.467 -2.617 . . . 1.0 . . . . . . . . . . . . A . 8 LEU CD1 . . . . . . . . . c19595_2mgo 1 . 15 . 1988 . 1 1 8 LEU CD2 C 1.559 6.528 -0.434 . . . 1.0 . . . . . . . . . . . . A . 8 LEU CD2 . . . . . . . . . c19595_2mgo 1 . 15 . 1989 . 1 1 8 LEU CG C 0.449 5.942 -1.290 . . . 1.0 . . . . . . . . . . . . A . 8 LEU CG . . . . . . . . . c19595_2mgo 1 . 15 . 1990 . 1 1 8 LEU H H -2.626 5.647 -0.366 . . . 1.0 . . . . . . . . . . . . A . 8 LEU H . . . . . . . . . c19595_2mgo 1 . 15 . 1991 . 1 1 8 LEU HA H -0.787 7.743 0.486 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HA . . . . . . . . . c19595_2mgo 1 . 15 . 1992 . 1 1 8 LEU HB2 H -1.322 6.602 -2.261 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HB2 . . . . . . . . . c19595_2mgo 1 . 15 . 1993 . 1 1 8 LEU HB3 H -0.165 7.870 -1.937 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HB3 . . . . . . . . . c19595_2mgo 1 . 15 . 1994 . 1 1 8 LEU HD11 H 1.453 6.304 -3.144 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HD11 . . . . . . . . . c19595_2mgo 1 . 15 . 1995 . 1 1 8 LEU HD12 H 0.227 5.037 -3.215 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HD12 . . . . . . . . . c19595_2mgo 1 . 15 . 1996 . 1 1 8 LEU HD13 H 1.777 4.721 -2.436 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HD13 . . . . . . . . . c19595_2mgo 1 . 15 . 1997 . 1 1 8 LEU HD21 H 1.154 6.846 0.515 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HD21 . . . . . . . . . c19595_2mgo 1 . 15 . 1998 . 1 1 8 LEU HD22 H 1.993 7.377 -0.941 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HD22 . . . . . . . . . c19595_2mgo 1 . 15 . 1999 . 1 1 8 LEU HD23 H 2.320 5.779 -0.270 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HD23 . . . . . . . . . c19595_2mgo 1 . 15 . 2000 . 1 1 8 LEU HG H 0.031 5.093 -0.770 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HG . . . . . . . . . c19595_2mgo 1 . 15 . 2001 . 1 1 8 LEU N N -2.248 6.318 0.246 . . . 1.0 . . . . . . . . . . . . A . 8 LEU N . . . . . . . . . c19595_2mgo 1 . 15 . 2002 . 1 1 8 LEU O O -1.884 9.742 -0.795 . . . 1.0 . . . . . . . . . . . . A . 8 LEU O . . . . . . . . . c19595_2mgo 1 . 15 . 2003 . 1 1 9 GLY C C -5.761 8.528 -1.528 . . . 1.0 . . . . . . . . . . . . A . 9 GLY C . . . . . . . . . c19595_2mgo 1 . 15 . 2004 . 1 1 9 GLY CA C -4.555 9.242 -1.038 . . . 1.0 . . . . . . . . . . . . A . 9 GLY CA . . . . . . . . . c19595_2mgo 1 . 15 . 2005 . 1 1 9 GLY H H -3.742 7.368 -0.460 . . . 1.0 . . . . . . . . . . . . A . 9 GLY H . . . . . . . . . c19595_2mgo 1 . 15 . 2006 . 1 1 9 GLY HA2 H -4.809 9.829 -0.168 . . . 1.0 . . . . . . . . . . . . A . 9 GLY HA2 . . . . . . . . . c19595_2mgo 1 . 15 . 2007 . 1 1 9 GLY HA3 H -4.187 9.891 -1.820 . . . 1.0 . . . . . . . . . . . . A . 9 GLY HA3 . . . . . . . . . c19595_2mgo 1 . 15 . 2008 . 1 1 9 GLY N N -3.551 8.300 -0.688 . . . 1.0 . . . . . . . . . . . . A . 9 GLY N . . . . . . . . . c19595_2mgo 1 . 15 . 2009 . 1 1 9 GLY O O -6.879 9.031 -1.358 . . . 1.0 . . . . . . . . . . . . A . 9 GLY O . . . . . . . . . c19595_2mgo 1 . 15 . 2010 . 1 1 9 GLY OXT O -5.606 7.409 -2.074 . . . 1.0 . . . . . . . . . . . . A . 9 GLY OXT . . . . . . . . . c19595_2mgo 1 . 16 . 2011 . 1 1 1 CYS C C 4.449 0.603 0.263 . . . 1.0 . . . . . . . . . . . . A . 1 CYS C . . . . . . . . . c19595_2mgo 1 . 16 . 2012 . 1 1 1 CYS CA C 4.294 2.096 0.057 . . . 1.0 . . . . . . . . . . . . A . 1 CYS CA . . . . . . . . . c19595_2mgo 1 . 16 . 2013 . 1 1 1 CYS CB C 3.079 2.432 -0.826 . . . 1.0 . . . . . . . . . . . . A . 1 CYS CB . . . . . . . . . c19595_2mgo 1 . 16 . 2014 . 1 1 1 CYS H1 H 5.448 3.642 -0.669 . . . 1.0 . . . . . . . . . . . . A . 1 CYS H1 . . . . . . . . . c19595_2mgo 1 . 16 . 2015 . 1 1 1 CYS H2 H 5.602 2.166 -1.493 . . . 1.0 . . . . . . . . . . . . A . 1 CYS H2 . . . . . . . . . c19595_2mgo 1 . 16 . 2016 . 1 1 1 CYS H3 H 6.324 2.348 0.019 . . . 1.0 . . . . . . . . . . . . A . 1 CYS H3 . . . . . . . . . c19595_2mgo 1 . 16 . 2017 . 1 1 1 CYS HA H 4.188 2.567 1.020 . . . 1.0 . . . . . . . . . . . . A . 1 CYS HA . . . . . . . . . c19595_2mgo 1 . 16 . 2018 . 1 1 1 CYS HB2 H 2.194 1.997 -0.385 . . . 1.0 . . . . . . . . . . . . A . 1 CYS HB2 . . . . . . . . . c19595_2mgo 1 . 16 . 2019 . 1 1 1 CYS HB3 H 2.963 3.505 -0.861 . . . 1.0 . . . . . . . . . . . . A . 1 CYS HB3 . . . . . . . . . c19595_2mgo 1 . 16 . 2020 . 1 1 1 CYS N N 5.503 2.610 -0.557 . . . 1.0 . . . . . . . . . . . . A . 1 CYS N . . . . . . . . . c19595_2mgo 1 . 16 . 2021 . 1 1 1 CYS O O 5.544 0.070 0.070 . . . 1.0 . . . . . . . . . . . . A . 1 CYS O . . . . . . . . . c19595_2mgo 1 . 16 . 2022 . 1 1 1 CYS SG S 3.180 1.822 -2.547 . . . 1.0 . . . . . . . . . . . . A . 1 CYS SG . . . . . . . . . c19595_2mgo 1 . 16 . 2023 . 1 1 2 TYR C C 2.820 -2.138 -0.330 . . . 1.0 . . . . . . . . . . . . A . 2 TYR C . . . . . . . . . c19595_2mgo 1 . 16 . 2024 . 1 1 2 TYR CA C 3.444 -1.478 0.899 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CA . . . . . . . . . c19595_2mgo 1 . 16 . 2025 . 1 1 2 TYR CB C 2.625 -1.804 2.162 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CB . . . . . . . . . c19595_2mgo 1 . 16 . 2026 . 1 1 2 TYR CD1 C 4.059 -1.493 4.231 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CD1 . . . . . . . . . c19595_2mgo 1 . 16 . 2027 . 1 1 2 TYR CD2 C 2.385 0.131 3.783 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CD2 . . . . . . . . . c19595_2mgo 1 . 16 . 2028 . 1 1 2 TYR CE1 C 4.417 -0.801 5.372 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CE1 . . . . . . . . . c19595_2mgo 1 . 16 . 2029 . 1 1 2 TYR CE2 C 2.736 0.824 4.915 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CE2 . . . . . . . . . c19595_2mgo 1 . 16 . 2030 . 1 1 2 TYR CG C 3.038 -1.040 3.416 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CG . . . . . . . . . c19595_2mgo 1 . 16 . 2031 . 1 1 2 TYR CZ C 3.752 0.357 5.708 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CZ . . . . . . . . . c19595_2mgo 1 . 16 . 2032 . 1 1 2 TYR H H 2.518 0.323 0.842 . . . 1.0 . . . . . . . . . . . . A . 2 TYR H . . . . . . . . . c19595_2mgo 1 . 16 . 2033 . 1 1 2 TYR HA H 4.468 -1.795 1.031 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HA . . . . . . . . . c19595_2mgo 1 . 16 . 2034 . 1 1 2 TYR HB2 H 1.592 -1.569 1.961 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HB2 . . . . . . . . . c19595_2mgo 1 . 16 . 2035 . 1 1 2 TYR HB3 H 2.707 -2.857 2.375 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HB3 . . . . . . . . . c19595_2mgo 1 . 16 . 2036 . 1 1 2 TYR HD1 H 4.582 -2.401 3.968 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HD1 . . . . . . . . . c19595_2mgo 1 . 16 . 2037 . 1 1 2 TYR HD2 H 1.583 0.500 3.160 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HD2 . . . . . . . . . c19595_2mgo 1 . 16 . 2038 . 1 1 2 TYR HE1 H 5.219 -1.173 5.994 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HE1 . . . . . . . . . c19595_2mgo 1 . 16 . 2039 . 1 1 2 TYR HE2 H 2.207 1.731 5.169 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HE2 . . . . . . . . . c19595_2mgo 1 . 16 . 2040 . 1 1 2 TYR HH H 3.309 1.354 7.287 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HH . . . . . . . . . c19595_2mgo 1 . 16 . 2041 . 1 1 2 TYR N N 3.398 -0.075 0.679 . . . 1.0 . . . . . . . . . . . . A . 2 TYR N . . . . . . . . . c19595_2mgo 1 . 16 . 2042 . 1 1 2 TYR O O 2.820 -1.553 -1.415 . . . 1.0 . . . . . . . . . . . . A . 2 TYR O . . . . . . . . . c19595_2mgo 1 . 16 . 2043 . 1 1 2 TYR OH O 4.107 1.049 6.836 . . . 1.0 . . . . . . . . . . . . A . 2 TYR OH . . . . . . . . . c19595_2mgo 1 . 16 . 2044 . 1 1 3 ILE C C 0.161 -3.769 -1.240 . . . 1.0 . . . . . . . . . . . . A . 3 ILE C . . . . . . . . . c19595_2mgo 1 . 16 . 2045 . 1 1 3 ILE CA C 1.642 -4.004 -1.282 . . . 1.0 . . . . . . . . . . . . A . 3 ILE CA . . . . . . . . . c19595_2mgo 1 . 16 . 2046 . 1 1 3 ILE CB C 1.959 -5.538 -1.322 . . . 1.0 . . . . . . . . . . . . A . 3 ILE CB . . . . . . . . . c19595_2mgo 1 . 16 . 2047 . 1 1 3 ILE CD1 C 3.860 -7.224 -1.635 . . . 1.0 . . . . . . . . . . . . A . 3 ILE CD1 . . . . . . . . . c19595_2mgo 1 . 16 . 2048 . 1 1 3 ILE CG1 C 3.458 -5.766 -1.550 . . . 1.0 . . . . . . . . . . . . A . 3 ILE CG1 . . . . . . . . . c19595_2mgo 1 . 16 . 2049 . 1 1 3 ILE CG2 C 1.143 -6.244 -2.415 . . . 1.0 . . . . . . . . . . . . A . 3 ILE CG2 . . . . . . . . . c19595_2mgo 1 . 16 . 2050 . 1 1 3 ILE H H 2.348 -3.671 0.736 . . . 1.0 . . . . . . . . . . . . A . 3 ILE H . . . . . . . . . c19595_2mgo 1 . 16 . 2051 . 1 1 3 ILE HA H 1.966 -3.555 -2.196 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HA . . . . . . . . . c19595_2mgo 1 . 16 . 2052 . 1 1 3 ILE HB H 1.682 -5.965 -0.369 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HB . . . . . . . . . c19595_2mgo 1 . 16 . 2053 . 1 1 3 ILE HD11 H 3.620 -7.721 -0.708 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HD11 . . . . . . . . . c19595_2mgo 1 . 16 . 2054 . 1 1 3 ILE HD12 H 4.920 -7.296 -1.819 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HD12 . . . . . . . . . c19595_2mgo 1 . 16 . 2055 . 1 1 3 ILE HD13 H 3.323 -7.698 -2.444 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HD13 . . . . . . . . . c19595_2mgo 1 . 16 . 2056 . 1 1 3 ILE HG12 H 3.746 -5.295 -2.478 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HG12 . . . . . . . . . c19595_2mgo 1 . 16 . 2057 . 1 1 3 ILE HG13 H 4.009 -5.314 -0.738 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HG13 . . . . . . . . . c19595_2mgo 1 . 16 . 2058 . 1 1 3 ILE HG21 H 1.384 -5.812 -3.376 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HG21 . . . . . . . . . c19595_2mgo 1 . 16 . 2059 . 1 1 3 ILE HG22 H 0.089 -6.118 -2.217 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HG22 . . . . . . . . . c19595_2mgo 1 . 16 . 2060 . 1 1 3 ILE HG23 H 1.384 -7.297 -2.422 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HG23 . . . . . . . . . c19595_2mgo 1 . 16 . 2061 . 1 1 3 ILE N N 2.296 -3.304 -0.172 . . . 1.0 . . . . . . . . . . . . A . 3 ILE N . . . . . . . . . c19595_2mgo 1 . 16 . 2062 . 1 1 3 ILE O O -0.413 -3.024 -2.052 . . . 1.0 . . . . . . . . . . . . A . 3 ILE O . . . . . . . . . c19595_2mgo 1 . 16 . 2063 . 1 1 4 GLN C C -2.183 -2.941 0.616 . . . 1.0 . . . . . . . . . . . . A . 4 GLN C . . . . . . . . . c19595_2mgo 1 . 16 . 2064 . 1 1 4 GLN CA C -1.851 -4.284 0.015 . . . 1.0 . . . . . . . . . . . . A . 4 GLN CA . . . . . . . . . c19595_2mgo 1 . 16 . 2065 . 1 1 4 GLN CB C -2.281 -5.448 0.932 . . . 1.0 . . . . . . . . . . . . A . 4 GLN CB . . . . . . . . . c19595_2mgo 1 . 16 . 2066 . 1 1 4 GLN CD C -4.700 -5.506 0.153 . . . 1.0 . . . . . . . . . . . . A . 4 GLN CD . . . . . . . . . c19595_2mgo 1 . 16 . 2067 . 1 1 4 GLN CG C -3.754 -5.447 1.336 . . . 1.0 . . . . . . . . . . . . A . 4 GLN CG . . . . . . . . . c19595_2mgo 1 . 16 . 2068 . 1 1 4 GLN H H 0.224 -4.855 0.282 . . . 1.0 . . . . . . . . . . . . A . 4 GLN H . . . . . . . . . c19595_2mgo 1 . 16 . 2069 . 1 1 4 GLN HA H -2.356 -4.349 -0.928 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HA . . . . . . . . . c19595_2mgo 1 . 16 . 2070 . 1 1 4 GLN HB2 H -2.078 -6.378 0.422 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HB2 . . . . . . . . . c19595_2mgo 1 . 16 . 2071 . 1 1 4 GLN HB3 H -1.684 -5.409 1.830 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HB3 . . . . . . . . . c19595_2mgo 1 . 16 . 2072 . 1 1 4 GLN HE21 H -6.021 -4.446 1.152 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HE21 . . . . . . . . . c19595_2mgo 1 . 16 . 2073 . 1 1 4 GLN HE22 H -6.491 -4.896 -0.436 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HE22 . . . . . . . . . c19595_2mgo 1 . 16 . 2074 . 1 1 4 GLN HG2 H -3.942 -6.305 1.966 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HG2 . . . . . . . . . c19595_2mgo 1 . 16 . 2075 . 1 1 4 GLN HG3 H -3.955 -4.545 1.896 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HG3 . . . . . . . . . c19595_2mgo 1 . 16 . 2076 . 1 1 4 GLN N N -0.415 -4.350 -0.261 . . . 1.0 . . . . . . . . . . . . A . 4 GLN N . . . . . . . . . c19595_2mgo 1 . 16 . 2077 . 1 1 4 GLN NE2 N -5.843 -4.899 0.297 . . . 1.0 . . . . . . . . . . . . A . 4 GLN NE2 . . . . . . . . . c19595_2mgo 1 . 16 . 2078 . 1 1 4 GLN O O -3.267 -2.390 0.437 . . . 1.0 . . . . . . . . . . . . A . 4 GLN O . . . . . . . . . c19595_2mgo 1 . 16 . 2079 . 1 1 4 GLN OE1 O -4.390 -6.080 -0.892 . . . 1.0 . . . . . . . . . . . . A . 4 GLN OE1 . . . . . . . . . c19595_2mgo 1 . 16 . 2080 . 1 1 5 ASN C C -0.605 -0.109 0.980 . . . 1.0 . . . . . . . . . . . . A . 5 ASN C . . . . . . . . . c19595_2mgo 1 . 16 . 2081 . 1 1 5 ASN CA C -1.282 -1.106 1.844 . . . 1.0 . . . . . . . . . . . . A . 5 ASN CA . . . . . . . . . c19595_2mgo 1 . 16 . 2082 . 1 1 5 ASN CB C -0.780 -1.057 3.292 . . . 1.0 . . . . . . . . . . . . A . 5 ASN CB . . . . . . . . . c19595_2mgo 1 . 16 . 2083 . 1 1 5 ASN CG C -1.737 -1.687 4.264 . . . 1.0 . . . . . . . . . . . . A . 5 ASN CG . . . . . . . . . c19595_2mgo 1 . 16 . 2084 . 1 1 5 ASN H H -0.385 -2.923 1.170 . . . 1.0 . . . . . . . . . . . . A . 5 ASN H . . . . . . . . . c19595_2mgo 1 . 16 . 2085 . 1 1 5 ASN HA H -2.333 -0.863 1.831 . . . 1.0 . . . . . . . . . . . . A . 5 ASN HA . . . . . . . . . c19595_2mgo 1 . 16 . 2086 . 1 1 5 ASN HB2 H 0.158 -1.586 3.370 . . . 1.0 . . . . . . . . . . . . A . 5 ASN HB2 . . . . . . . . . c19595_2mgo 1 . 16 . 2087 . 1 1 5 ASN HB3 H -0.631 -0.026 3.579 . . . 1.0 . . . . . . . . . . . . A . 5 ASN HB3 . . . . . . . . . c19595_2mgo 1 . 16 . 2088 . 1 1 5 ASN HD21 H -2.678 0.032 4.471 . . . 1.0 . . . . . . . . . . . . A . 5 ASN HD21 . . . . . . . . . c19595_2mgo 1 . 16 . 2089 . 1 1 5 ASN HD22 H -3.334 -1.281 5.364 . . . 1.0 . . . . . . . . . . . . A . 5 ASN HD22 . . . . . . . . . c19595_2mgo 1 . 16 . 2090 . 1 1 5 ASN N N -1.203 -2.398 1.227 . . . 1.0 . . . . . . . . . . . . A . 5 ASN N . . . . . . . . . c19595_2mgo 1 . 16 . 2091 . 1 1 5 ASN ND2 N -2.661 -0.907 4.754 . . . 1.0 . . . . . . . . . . . . A . 5 ASN ND2 . . . . . . . . . c19595_2mgo 1 . 16 . 2092 . 1 1 5 ASN O O 0.418 0.480 1.314 . . . 1.0 . . . . . . . . . . . . A . 5 ASN O . . . . . . . . . c19595_2mgo 1 . 16 . 2093 . 1 1 5 ASN OD1 O -1.651 -2.872 4.568 . . . 1.0 . . . . . . . . . . . . A . 5 ASN OD1 . . . . . . . . . c19595_2mgo 1 . 16 . 2094 . 1 1 6 CYS C C -1.854 1.073 -2.124 . . . 1.0 . . . . . . . . . . . . A . 6 CYS C . . . . . . . . . c19595_2mgo 1 . 16 . 2095 . 1 1 6 CYS CA C -0.690 0.877 -1.183 . . . 1.0 . . . . . . . . . . . . A . 6 CYS CA . . . . . . . . . c19595_2mgo 1 . 16 . 2096 . 1 1 6 CYS CB C 0.548 0.412 -1.951 . . . 1.0 . . . . . . . . . . . . A . 6 CYS CB . . . . . . . . . c19595_2mgo 1 . 16 . 2097 . 1 1 6 CYS H H -1.724 -0.795 -0.412 . . . 1.0 . . . . . . . . . . . . A . 6 CYS H . . . . . . . . . c19595_2mgo 1 . 16 . 2098 . 1 1 6 CYS HA H -0.476 1.806 -0.677 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HA . . . . . . . . . c19595_2mgo 1 . 16 . 2099 . 1 1 6 CYS HB2 H 1.325 0.154 -1.248 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HB2 . . . . . . . . . c19595_2mgo 1 . 16 . 2100 . 1 1 6 CYS HB3 H 0.289 -0.468 -2.521 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HB3 . . . . . . . . . c19595_2mgo 1 . 16 . 2101 . 1 1 6 CYS N N -1.082 -0.083 -0.203 . . . 1.0 . . . . . . . . . . . . A . 6 CYS N . . . . . . . . . c19595_2mgo 1 . 16 . 2102 . 1 1 6 CYS O O -2.072 0.258 -3.026 . . . 1.0 . . . . . . . . . . . . A . 6 CYS O . . . . . . . . . c19595_2mgo 1 . 16 . 2103 . 1 1 6 CYS SG S 1.237 1.641 -3.110 . . . 1.0 . . . . . . . . . . . . A . 6 CYS SG . . . . . . . . . c19595_2mgo 1 . 16 . 2104 . 1 1 7 PRO C C -3.429 3.120 -3.974 . . . 1.0 . . . . . . . . . . . . A . 7 PRO C . . . . . . . . . c19595_2mgo 1 . 16 . 2105 . 1 1 7 PRO CA C -3.829 2.362 -2.701 . . . 1.0 . . . . . . . . . . . . A . 7 PRO CA . . . . . . . . . c19595_2mgo 1 . 16 . 2106 . 1 1 7 PRO CB C -4.722 3.215 -1.802 . . . 1.0 . . . . . . . . . . . . A . 7 PRO CB . . . . . . . . . c19595_2mgo 1 . 16 . 2107 . 1 1 7 PRO CD C -2.582 3.018 -0.722 . . . 1.0 . . . . . . . . . . . . A . 7 PRO CD . . . . . . . . . c19595_2mgo 1 . 16 . 2108 . 1 1 7 PRO CG C -3.781 3.914 -0.882 . . . 1.0 . . . . . . . . . . . . A . 7 PRO CG . . . . . . . . . c19595_2mgo 1 . 16 . 2109 . 1 1 7 PRO HA H -4.340 1.450 -2.971 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HA . . . . . . . . . c19595_2mgo 1 . 16 . 2110 . 1 1 7 PRO HB2 H -5.279 3.916 -2.406 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HB2 . . . . . . . . . c19595_2mgo 1 . 16 . 2111 . 1 1 7 PRO HB3 H -5.405 2.581 -1.258 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HB3 . . . . . . . . . c19595_2mgo 1 . 16 . 2112 . 1 1 7 PRO HD2 H -1.673 3.598 -0.781 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HD2 . . . . . . . . . c19595_2mgo 1 . 16 . 2113 . 1 1 7 PRO HD3 H -2.629 2.487 0.217 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HD3 . . . . . . . . . c19595_2mgo 1 . 16 . 2114 . 1 1 7 PRO HG2 H -3.481 4.849 -1.329 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HG2 . . . . . . . . . c19595_2mgo 1 . 16 . 2115 . 1 1 7 PRO HG3 H -4.254 4.087 0.073 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HG3 . . . . . . . . . c19595_2mgo 1 . 16 . 2116 . 1 1 7 PRO N N -2.683 2.079 -1.866 . . . 1.0 . . . . . . . . . . . . A . 7 PRO N . . . . . . . . . c19595_2mgo 1 . 16 . 2117 . 1 1 7 PRO O O -2.549 3.977 -3.951 . . . 1.0 . . . . . . . . . . . . A . 7 PRO O . . . . . . . . . c19595_2mgo 1 . 16 . 2118 . 1 1 8 LEU C C -4.749 4.543 -6.645 . . . 1.0 . . . . . . . . . . . . A . 8 LEU C . . . . . . . . . c19595_2mgo 1 . 16 . 2119 . 1 1 8 LEU CA C -3.776 3.412 -6.369 . . . 1.0 . . . . . . . . . . . . A . 8 LEU CA . . . . . . . . . c19595_2mgo 1 . 16 . 2120 . 1 1 8 LEU CB C -3.830 2.393 -7.515 . . . 1.0 . . . . . . . . . . . . A . 8 LEU CB . . . . . . . . . c19595_2mgo 1 . 16 . 2121 . 1 1 8 LEU CD1 C -2.792 0.306 -6.455 . . . 1.0 . . . . . . . . . . . . A . 8 LEU CD1 . . . . . . . . . c19595_2mgo 1 . 16 . 2122 . 1 1 8 LEU CD2 C -2.759 0.611 -8.937 . . . 1.0 . . . . . . . . . . . . A . 8 LEU CD2 . . . . . . . . . c19595_2mgo 1 . 16 . 2123 . 1 1 8 LEU CG C -2.715 1.318 -7.595 . . . 1.0 . . . . . . . . . . . . A . 8 LEU CG . . . . . . . . . c19595_2mgo 1 . 16 . 2124 . 1 1 8 LEU H H -4.756 2.095 -5.015 . . . 1.0 . . . . . . . . . . . . A . 8 LEU H . . . . . . . . . c19595_2mgo 1 . 16 . 2125 . 1 1 8 LEU HA H -2.788 3.833 -6.307 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HA . . . . . . . . . c19595_2mgo 1 . 16 . 2126 . 1 1 8 LEU HB2 H -4.779 1.883 -7.440 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HB2 . . . . . . . . . c19595_2mgo 1 . 16 . 2127 . 1 1 8 LEU HB3 H -3.834 2.976 -8.419 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HB3 . . . . . . . . . c19595_2mgo 1 . 16 . 2128 . 1 1 8 LEU HD11 H -2.704 0.823 -5.511 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HD11 . . . . . . . . . c19595_2mgo 1 . 16 . 2129 . 1 1 8 LEU HD12 H -1.985 -0.404 -6.554 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HD12 . . . . . . . . . c19595_2mgo 1 . 16 . 2130 . 1 1 8 LEU HD13 H -3.737 -0.215 -6.496 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HD13 . . . . . . . . . c19595_2mgo 1 . 16 . 2131 . 1 1 8 LEU HD21 H -2.597 1.328 -9.729 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HD21 . . . . . . . . . c19595_2mgo 1 . 16 . 2132 . 1 1 8 LEU HD22 H -3.722 0.140 -9.067 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HD22 . . . . . . . . . c19595_2mgo 1 . 16 . 2133 . 1 1 8 LEU HD23 H -1.984 -0.142 -8.970 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HD23 . . . . . . . . . c19595_2mgo 1 . 16 . 2134 . 1 1 8 LEU HG H -1.761 1.814 -7.515 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HG . . . . . . . . . c19595_2mgo 1 . 16 . 2135 . 1 1 8 LEU N N -4.062 2.788 -5.072 . . . 1.0 . . . . . . . . . . . . A . 8 LEU N . . . . . . . . . c19595_2mgo 1 . 16 . 2136 . 1 1 8 LEU O O -4.718 5.211 -7.694 . . . 1.0 . . . . . . . . . . . . A . 8 LEU O . . . . . . . . . c19595_2mgo 1 . 16 . 2137 . 1 1 9 GLY C C -7.180 5.803 -4.364 . . . 1.0 . . . . . . . . . . . . A . 9 GLY C . . . . . . . . . c19595_2mgo 1 . 16 . 2138 . 1 1 9 GLY CA C -6.591 5.722 -5.728 . . . 1.0 . . . . . . . . . . . . A . 9 GLY CA . . . . . . . . . c19595_2mgo 1 . 16 . 2139 . 1 1 9 GLY H H -5.452 4.174 -4.917 . . . 1.0 . . . . . . . . . . . . A . 9 GLY H . . . . . . . . . c19595_2mgo 1 . 16 . 2140 . 1 1 9 GLY HA2 H -6.172 6.677 -6.006 . . . 1.0 . . . . . . . . . . . . A . 9 GLY HA2 . . . . . . . . . c19595_2mgo 1 . 16 . 2141 . 1 1 9 GLY HA3 H -7.363 5.438 -6.428 . . . 1.0 . . . . . . . . . . . . A . 9 GLY HA3 . . . . . . . . . c19595_2mgo 1 . 16 . 2142 . 1 1 9 GLY N N -5.568 4.738 -5.705 . . . 1.0 . . . . . . . . . . . . A . 9 GLY N . . . . . . . . . c19595_2mgo 1 . 16 . 2143 . 1 1 9 GLY O O -6.433 5.539 -3.396 . . . 1.0 . . . . . . . . . . . . A . 9 GLY O . . . . . . . . . c19595_2mgo 1 . 16 . 2144 . 1 1 9 GLY OXT O -8.388 6.083 -4.228 . . . 1.0 . . . . . . . . . . . . A . 9 GLY OXT . . . . . . . . . c19595_2mgo 1 . 17 . 2145 . 1 1 1 CYS C C 4.492 0.171 -0.730 . . . 1.0 . . . . . . . . . . . . A . 1 CYS C . . . . . . . . . c19595_2mgo 1 . 17 . 2146 . 1 1 1 CYS CA C 4.329 1.396 0.132 . . . 1.0 . . . . . . . . . . . . A . 1 CYS CA . . . . . . . . . c19595_2mgo 1 . 17 . 2147 . 1 1 1 CYS CB C 2.846 1.567 0.428 . . . 1.0 . . . . . . . . . . . . A . 1 CYS CB . . . . . . . . . c19595_2mgo 1 . 17 . 2148 . 1 1 1 CYS H1 H 4.377 2.677 -1.463 . . . 1.0 . . . . . . . . . . . . A . 1 CYS H1 . . . . . . . . . c19595_2mgo 1 . 17 . 2149 . 1 1 1 CYS H2 H 5.881 2.432 -0.745 . . . 1.0 . . . . . . . . . . . . A . 1 CYS H2 . . . . . . . . . c19595_2mgo 1 . 17 . 2150 . 1 1 1 CYS H3 H 4.730 3.420 0.013 . . . 1.0 . . . . . . . . . . . . A . 1 CYS H3 . . . . . . . . . c19595_2mgo 1 . 17 . 2151 . 1 1 1 CYS HA H 4.866 1.268 1.058 . . . 1.0 . . . . . . . . . . . . A . 1 CYS HA . . . . . . . . . c19595_2mgo 1 . 17 . 2152 . 1 1 1 CYS HB2 H 2.301 1.656 -0.501 . . . 1.0 . . . . . . . . . . . . A . 1 CYS HB2 . . . . . . . . . c19595_2mgo 1 . 17 . 2153 . 1 1 1 CYS HB3 H 2.512 0.674 0.933 . . . 1.0 . . . . . . . . . . . . A . 1 CYS HB3 . . . . . . . . . c19595_2mgo 1 . 17 . 2154 . 1 1 1 CYS N N 4.867 2.560 -0.553 . . . 1.0 . . . . . . . . . . . . A . 1 CYS N . . . . . . . . . c19595_2mgo 1 . 17 . 2155 . 1 1 1 CYS O O 4.287 0.235 -1.936 . . . 1.0 . . . . . . . . . . . . A . 1 CYS O . . . . . . . . . c19595_2mgo 1 . 17 . 2156 . 1 1 1 CYS SG S 2.396 2.991 1.466 . . . 1.0 . . . . . . . . . . . . A . 1 CYS SG . . . . . . . . . c19595_2mgo 1 . 17 . 2157 . 1 1 2 TYR C C 3.838 -3.116 -0.499 . . . 1.0 . . . . . . . . . . . . A . 2 TYR C . . . . . . . . . c19595_2mgo 1 . 17 . 2158 . 1 1 2 TYR CA C 4.997 -2.184 -0.861 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CA . . . . . . . . . c19595_2mgo 1 . 17 . 2159 . 1 1 2 TYR CB C 6.353 -2.817 -0.531 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CB . . . . . . . . . c19595_2mgo 1 . 17 . 2160 . 1 1 2 TYR CD1 C 7.369 -3.469 -2.736 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CD1 . . . . . . . . . c19595_2mgo 1 . 17 . 2161 . 1 1 2 TYR CD2 C 6.703 -5.214 -1.266 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CD2 . . . . . . . . . c19595_2mgo 1 . 17 . 2162 . 1 1 2 TYR CE1 C 7.796 -4.397 -3.653 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CE1 . . . . . . . . . c19595_2mgo 1 . 17 . 2163 . 1 1 2 TYR CE2 C 7.131 -6.151 -2.180 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CE2 . . . . . . . . . c19595_2mgo 1 . 17 . 2164 . 1 1 2 TYR CG C 6.815 -3.857 -1.527 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CG . . . . . . . . . c19595_2mgo 1 . 17 . 2165 . 1 1 2 TYR CZ C 7.675 -5.737 -3.369 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CZ . . . . . . . . . c19595_2mgo 1 . 17 . 2166 . 1 1 2 TYR H H 5.012 -0.941 0.845 . . . 1.0 . . . . . . . . . . . . A . 2 TYR H . . . . . . . . . c19595_2mgo 1 . 17 . 2167 . 1 1 2 TYR HA H 4.948 -1.951 -1.912 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HA . . . . . . . . . c19595_2mgo 1 . 17 . 2168 . 1 1 2 TYR HB2 H 7.094 -2.033 -0.509 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HB2 . . . . . . . . . c19595_2mgo 1 . 17 . 2169 . 1 1 2 TYR HB3 H 6.298 -3.280 0.443 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HB3 . . . . . . . . . c19595_2mgo 1 . 17 . 2170 . 1 1 2 TYR HD1 H 7.463 -2.416 -2.957 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HD1 . . . . . . . . . c19595_2mgo 1 . 17 . 2171 . 1 1 2 TYR HD2 H 6.273 -5.536 -0.330 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HD2 . . . . . . . . . c19595_2mgo 1 . 17 . 2172 . 1 1 2 TYR HE1 H 8.221 -4.065 -4.588 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HE1 . . . . . . . . . c19595_2mgo 1 . 17 . 2173 . 1 1 2 TYR HE2 H 7.035 -7.202 -1.960 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HE2 . . . . . . . . . c19595_2mgo 1 . 17 . 2174 . 1 1 2 TYR HH H 8.984 -6.415 -4.576 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HH . . . . . . . . . c19595_2mgo 1 . 17 . 2175 . 1 1 2 TYR N N 4.841 -0.947 -0.124 . . . 1.0 . . . . . . . . . . . . A . 2 TYR N . . . . . . . . . c19595_2mgo 1 . 17 . 2176 . 1 1 2 TYR O O 3.778 -4.277 -0.900 . . . 1.0 . . . . . . . . . . . . A . 2 TYR O . . . . . . . . . c19595_2mgo 1 . 17 . 2177 . 1 1 2 TYR OH O 8.102 -6.662 -4.274 . . . 1.0 . . . . . . . . . . . . A . 2 TYR OH . . . . . . . . . c19595_2mgo 1 . 17 . 2178 . 1 1 3 ILE C C 0.586 -2.675 -0.062 . . . 1.0 . . . . . . . . . . . . A . 3 ILE C . . . . . . . . . c19595_2mgo 1 . 17 . 2179 . 1 1 3 ILE CA C 1.764 -3.254 0.676 . . . 1.0 . . . . . . . . . . . . A . 3 ILE CA . . . . . . . . . c19595_2mgo 1 . 17 . 2180 . 1 1 3 ILE CB C 1.541 -3.101 2.211 . . . 1.0 . . . . . . . . . . . . A . 3 ILE CB . . . . . . . . . c19595_2mgo 1 . 17 . 2181 . 1 1 3 ILE CD1 C 1.093 -1.378 4.077 . . . 1.0 . . . . . . . . . . . . A . 3 ILE CD1 . . . . . . . . . c19595_2mgo 1 . 17 . 2182 . 1 1 3 ILE CG1 C 1.394 -1.613 2.612 . . . 1.0 . . . . . . . . . . . . A . 3 ILE CG1 . . . . . . . . . c19595_2mgo 1 . 17 . 2183 . 1 1 3 ILE CG2 C 2.680 -3.762 2.980 . . . 1.0 . . . . . . . . . . . . A . 3 ILE CG2 . . . . . . . . . c19595_2mgo 1 . 17 . 2184 . 1 1 3 ILE H H 2.987 -1.639 0.509 . . . 1.0 . . . . . . . . . . . . A . 3 ILE H . . . . . . . . . c19595_2mgo 1 . 17 . 2185 . 1 1 3 ILE HA H 1.868 -4.302 0.439 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HA . . . . . . . . . c19595_2mgo 1 . 17 . 2186 . 1 1 3 ILE HB H 0.628 -3.621 2.457 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HB . . . . . . . . . c19595_2mgo 1 . 17 . 2187 . 1 1 3 ILE HD11 H 0.150 -1.840 4.327 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HD11 . . . . . . . . . c19595_2mgo 1 . 17 . 2188 . 1 1 3 ILE HD12 H 1.035 -0.317 4.267 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HD12 . . . . . . . . . c19595_2mgo 1 . 17 . 2189 . 1 1 3 ILE HD13 H 1.876 -1.813 4.678 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HD13 . . . . . . . . . c19595_2mgo 1 . 17 . 2190 . 1 1 3 ILE HG12 H 2.308 -1.092 2.376 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HG12 . . . . . . . . . c19595_2mgo 1 . 17 . 2191 . 1 1 3 ILE HG13 H 0.592 -1.181 2.033 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HG13 . . . . . . . . . c19595_2mgo 1 . 17 . 2192 . 1 1 3 ILE HG21 H 2.505 -3.660 4.040 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HG21 . . . . . . . . . c19595_2mgo 1 . 17 . 2193 . 1 1 3 ILE HG22 H 3.610 -3.279 2.721 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HG22 . . . . . . . . . c19595_2mgo 1 . 17 . 2194 . 1 1 3 ILE HG23 H 2.735 -4.808 2.719 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HG23 . . . . . . . . . c19595_2mgo 1 . 17 . 2195 . 1 1 3 ILE N N 2.920 -2.573 0.249 . . . 1.0 . . . . . . . . . . . . A . 3 ILE N . . . . . . . . . c19595_2mgo 1 . 17 . 2196 . 1 1 3 ILE O O 0.549 -1.468 -0.355 . . . 1.0 . . . . . . . . . . . . A . 3 ILE O . . . . . . . . . c19595_2mgo 1 . 17 . 2197 . 1 1 4 GLN C C -2.541 -2.433 -0.077 . . . 1.0 . . . . . . . . . . . . A . 4 GLN C . . . . . . . . . c19595_2mgo 1 . 17 . 2198 . 1 1 4 GLN CA C -1.571 -3.081 -1.057 . . . 1.0 . . . . . . . . . . . . A . 4 GLN CA . . . . . . . . . c19595_2mgo 1 . 17 . 2199 . 1 1 4 GLN CB C -2.217 -4.260 -1.803 . . . 1.0 . . . . . . . . . . . . A . 4 GLN CB . . . . . . . . . c19595_2mgo 1 . 17 . 2200 . 1 1 4 GLN CD C -4.008 -5.056 -3.416 . . . 1.0 . . . . . . . . . . . . A . 4 GLN CD . . . . . . . . . c19595_2mgo 1 . 17 . 2201 . 1 1 4 GLN CG C -3.371 -3.870 -2.721 . . . 1.0 . . . . . . . . . . . . A . 4 GLN CG . . . . . . . . . c19595_2mgo 1 . 17 . 2202 . 1 1 4 GLN H H -0.219 -4.430 -0.066 . . . 1.0 . . . . . . . . . . . . A . 4 GLN H . . . . . . . . . c19595_2mgo 1 . 17 . 2203 . 1 1 4 GLN HA H -1.268 -2.321 -1.755 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HA . . . . . . . . . c19595_2mgo 1 . 17 . 2204 . 1 1 4 GLN HB2 H -1.465 -4.749 -2.404 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HB2 . . . . . . . . . c19595_2mgo 1 . 17 . 2205 . 1 1 4 GLN HB3 H -2.591 -4.965 -1.074 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HB3 . . . . . . . . . c19595_2mgo 1 . 17 . 2206 . 1 1 4 GLN HE21 H -4.518 -3.922 -4.951 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HE21 . . . . . . . . . c19595_2mgo 1 . 17 . 2207 . 1 1 4 GLN HE22 H -4.986 -5.579 -5.052 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HE22 . . . . . . . . . c19595_2mgo 1 . 17 . 2208 . 1 1 4 GLN HG2 H -4.127 -3.374 -2.131 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HG2 . . . . . . . . . c19595_2mgo 1 . 17 . 2209 . 1 1 4 GLN HG3 H -3.000 -3.185 -3.470 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HG3 . . . . . . . . . c19595_2mgo 1 . 17 . 2210 . 1 1 4 GLN N N -0.365 -3.501 -0.342 . . . 1.0 . . . . . . . . . . . . A . 4 GLN N . . . . . . . . . c19595_2mgo 1 . 17 . 2211 . 1 1 4 GLN NE2 N -4.550 -4.833 -4.586 . . . 1.0 . . . . . . . . . . . . A . 4 GLN NE2 . . . . . . . . . c19595_2mgo 1 . 17 . 2212 . 1 1 4 GLN O O -3.533 -1.811 -0.451 . . . 1.0 . . . . . . . . . . . . A . 4 GLN O . . . . . . . . . c19595_2mgo 1 . 17 . 2213 . 1 1 4 GLN OE1 O -4.026 -6.170 -2.892 . . . 1.0 . . . . . . . . . . . . A . 4 GLN OE1 . . . . . . . . . c19595_2mgo 1 . 17 . 2214 . 1 1 5 ASN C C -2.545 -0.528 2.544 . . . 1.0 . . . . . . . . . . . . A . 5 ASN C . . . . . . . . . c19595_2mgo 1 . 17 . 2215 . 1 1 5 ASN CA C -2.959 -1.961 2.276 . . . 1.0 . . . . . . . . . . . . A . 5 ASN CA . . . . . . . . . c19595_2mgo 1 . 17 . 2216 . 1 1 5 ASN CB C -2.782 -2.790 3.556 . . . 1.0 . . . . . . . . . . . . A . 5 ASN CB . . . . . . . . . c19595_2mgo 1 . 17 . 2217 . 1 1 5 ASN CG C -3.412 -4.163 3.482 . . . 1.0 . . . . . . . . . . . . A . 5 ASN CG . . . . . . . . . c19595_2mgo 1 . 17 . 2218 . 1 1 5 ASN H H -1.343 -2.999 1.316 . . . 1.0 . . . . . . . . . . . . A . 5 ASN H . . . . . . . . . c19595_2mgo 1 . 17 . 2219 . 1 1 5 ASN HA H -4.000 -1.973 1.992 . . . 1.0 . . . . . . . . . . . . A . 5 ASN HA . . . . . . . . . c19595_2mgo 1 . 17 . 2220 . 1 1 5 ASN HB2 H -1.726 -2.920 3.740 . . . 1.0 . . . . . . . . . . . . A . 5 ASN HB2 . . . . . . . . . c19595_2mgo 1 . 17 . 2221 . 1 1 5 ASN HB3 H -3.218 -2.252 4.385 . . . 1.0 . . . . . . . . . . . . A . 5 ASN HB3 . . . . . . . . . c19595_2mgo 1 . 17 . 2222 . 1 1 5 ASN HD21 H -5.093 -3.440 4.199 . . . 1.0 . . . . . . . . . . . . A . 5 ASN HD21 . . . . . . . . . c19595_2mgo 1 . 17 . 2223 . 1 1 5 ASN HD22 H -5.109 -5.120 3.840 . . . 1.0 . . . . . . . . . . . . A . 5 ASN HD22 . . . . . . . . . c19595_2mgo 1 . 17 . 2224 . 1 1 5 ASN N N -2.185 -2.522 1.167 . . . 1.0 . . . . . . . . . . . . A . 5 ASN N . . . . . . . . . c19595_2mgo 1 . 17 . 2225 . 1 1 5 ASN ND2 N -4.647 -4.255 3.878 . . . 1.0 . . . . . . . . . . . . A . 5 ASN ND2 . . . . . . . . . c19595_2mgo 1 . 17 . 2226 . 1 1 5 ASN O O -2.818 0.021 3.602 . . . 1.0 . . . . . . . . . . . . A . 5 ASN O . . . . . . . . . c19595_2mgo 1 . 17 . 2227 . 1 1 5 ASN OD1 O -2.772 -5.137 3.078 . . . 1.0 . . . . . . . . . . . . A . 5 ASN OD1 . . . . . . . . . c19595_2mgo 1 . 17 . 2228 . 1 1 6 CYS C C -2.639 2.340 1.324 . . . 1.0 . . . . . . . . . . . . A . 6 CYS C . . . . . . . . . c19595_2mgo 1 . 17 . 2229 . 1 1 6 CYS CA C -1.473 1.441 1.708 . . . 1.0 . . . . . . . . . . . . A . 6 CYS CA . . . . . . . . . c19595_2mgo 1 . 17 . 2230 . 1 1 6 CYS CB C -0.279 1.701 0.789 . . . 1.0 . . . . . . . . . . . . A . 6 CYS CB . . . . . . . . . c19595_2mgo 1 . 17 . 2231 . 1 1 6 CYS H H -1.738 -0.419 0.757 . . . 1.0 . . . . . . . . . . . . A . 6 CYS H . . . . . . . . . c19595_2mgo 1 . 17 . 2232 . 1 1 6 CYS HA H -1.185 1.616 2.734 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HA . . . . . . . . . c19595_2mgo 1 . 17 . 2233 . 1 1 6 CYS HB2 H 0.491 0.979 1.015 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HB2 . . . . . . . . . c19595_2mgo 1 . 17 . 2234 . 1 1 6 CYS HB3 H -0.593 1.566 -0.235 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HB3 . . . . . . . . . c19595_2mgo 1 . 17 . 2235 . 1 1 6 CYS N N -1.900 0.071 1.587 . . . 1.0 . . . . . . . . . . . . A . 6 CYS N . . . . . . . . . c19595_2mgo 1 . 17 . 2236 . 1 1 6 CYS O O -3.208 2.174 0.239 . . . 1.0 . . . . . . . . . . . . A . 6 CYS O . . . . . . . . . c19595_2mgo 1 . 17 . 2237 . 1 1 6 CYS SG S 0.469 3.370 0.934 . . . 1.0 . . . . . . . . . . . . A . 6 CYS SG . . . . . . . . . c19595_2mgo 1 . 17 . 2238 . 1 1 7 PRO C C -3.820 5.128 0.808 . . . 1.0 . . . . . . . . . . . . A . 7 PRO C . . . . . . . . . c19595_2mgo 1 . 17 . 2239 . 1 1 7 PRO CA C -4.167 4.160 1.942 . . . 1.0 . . . . . . . . . . . . A . 7 PRO CA . . . . . . . . . c19595_2mgo 1 . 17 . 2240 . 1 1 7 PRO CB C -4.350 4.937 3.252 . . . 1.0 . . . . . . . . . . . . A . 7 PRO CB . . . . . . . . . c19595_2mgo 1 . 17 . 2241 . 1 1 7 PRO CD C -2.539 3.416 3.582 . . . 1.0 . . . . . . . . . . . . A . 7 PRO CD . . . . . . . . . c19595_2mgo 1 . 17 . 2242 . 1 1 7 PRO CG C -3.633 4.148 4.290 . . . 1.0 . . . . . . . . . . . . A . 7 PRO CG . . . . . . . . . c19595_2mgo 1 . 17 . 2243 . 1 1 7 PRO HA H -5.069 3.619 1.705 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HA . . . . . . . . . c19595_2mgo 1 . 17 . 2244 . 1 1 7 PRO HB2 H -3.932 5.927 3.148 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HB2 . . . . . . . . . c19595_2mgo 1 . 17 . 2245 . 1 1 7 PRO HB3 H -5.403 5.018 3.483 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HB3 . . . . . . . . . c19595_2mgo 1 . 17 . 2246 . 1 1 7 PRO HD2 H -1.632 4.002 3.569 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HD2 . . . . . . . . . c19595_2mgo 1 . 17 . 2247 . 1 1 7 PRO HD3 H -2.375 2.462 4.058 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HD3 . . . . . . . . . c19595_2mgo 1 . 17 . 2248 . 1 1 7 PRO HG2 H -3.219 4.812 5.034 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HG2 . . . . . . . . . c19595_2mgo 1 . 17 . 2249 . 1 1 7 PRO HG3 H -4.311 3.450 4.756 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HG3 . . . . . . . . . c19595_2mgo 1 . 17 . 2250 . 1 1 7 PRO N N -3.070 3.241 2.221 . . . 1.0 . . . . . . . . . . . . A . 7 PRO N . . . . . . . . . c19595_2mgo 1 . 17 . 2251 . 1 1 7 PRO O O -2.708 5.682 0.766 . . . 1.0 . . . . . . . . . . . . A . 7 PRO O . . . . . . . . . c19595_2mgo 1 . 17 . 2252 . 1 1 8 LEU C C -5.041 7.627 -0.911 . . . 1.0 . . . . . . . . . . . . A . 8 LEU C . . . . . . . . . c19595_2mgo 1 . 17 . 2253 . 1 1 8 LEU CA C -4.546 6.251 -1.238 . . . 1.0 . . . . . . . . . . . . A . 8 LEU CA . . . . . . . . . c19595_2mgo 1 . 17 . 2254 . 1 1 8 LEU CB C -5.210 5.772 -2.542 . . . 1.0 . . . . . . . . . . . . A . 8 LEU CB . . . . . . . . . c19595_2mgo 1 . 17 . 2255 . 1 1 8 LEU CD1 C -3.146 4.771 -3.608 . . . 1.0 . . . . . . . . . . . . A . 8 LEU CD1 . . . . . . . . . c19595_2mgo 1 . 17 . 2256 . 1 1 8 LEU CD2 C -4.826 3.270 -2.532 . . . 1.0 . . . . . . . . . . . . A . 8 LEU CD2 . . . . . . . . . c19595_2mgo 1 . 17 . 2257 . 1 1 8 LEU CG C -4.611 4.561 -3.285 . . . 1.0 . . . . . . . . . . . . A . 8 LEU CG . . . . . . . . . c19595_2mgo 1 . 17 . 2258 . 1 1 8 LEU H H -5.611 4.854 -0.027 . . . 1.0 . . . . . . . . . . . . A . 8 LEU H . . . . . . . . . c19595_2mgo 1 . 17 . 2259 . 1 1 8 LEU HA H -3.485 6.324 -1.376 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HA . . . . . . . . . c19595_2mgo 1 . 17 . 2260 . 1 1 8 LEU HB2 H -6.236 5.532 -2.308 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HB2 . . . . . . . . . c19595_2mgo 1 . 17 . 2261 . 1 1 8 LEU HB3 H -5.213 6.622 -3.206 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HB3 . . . . . . . . . c19595_2mgo 1 . 17 . 2262 . 1 1 8 LEU HD11 H -2.769 3.912 -4.143 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HD11 . . . . . . . . . c19595_2mgo 1 . 17 . 2263 . 1 1 8 LEU HD12 H -2.590 4.892 -2.691 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HD12 . . . . . . . . . c19595_2mgo 1 . 17 . 2264 . 1 1 8 LEU HD13 H -3.032 5.653 -4.220 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HD13 . . . . . . . . . c19595_2mgo 1 . 17 . 2265 . 1 1 8 LEU HD21 H -5.884 3.108 -2.392 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HD21 . . . . . . . . . c19595_2mgo 1 . 17 . 2266 . 1 1 8 LEU HD22 H -4.340 3.329 -1.569 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HD22 . . . . . . . . . c19595_2mgo 1 . 17 . 2267 . 1 1 8 LEU HD23 H -4.408 2.453 -3.101 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HD23 . . . . . . . . . c19595_2mgo 1 . 17 . 2268 . 1 1 8 LEU HG H -5.117 4.482 -4.236 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HG . . . . . . . . . c19595_2mgo 1 . 17 . 2269 . 1 1 8 LEU N N -4.756 5.333 -0.105 . . . 1.0 . . . . . . . . . . . . A . 8 LEU N . . . . . . . . . c19595_2mgo 1 . 17 . 2270 . 1 1 8 LEU O O -4.884 8.571 -1.685 . . . 1.0 . . . . . . . . . . . . A . 8 LEU O . . . . . . . . . c19595_2mgo 1 . 17 . 2271 . 1 1 9 GLY C C -6.914 8.704 1.945 . . . 1.0 . . . . . . . . . . . . A . 9 GLY C . . . . . . . . . c19595_2mgo 1 . 17 . 2272 . 1 1 9 GLY CA C -6.180 8.936 0.676 . . . 1.0 . . . . . . . . . . . . A . 9 GLY CA . . . . . . . . . c19595_2mgo 1 . 17 . 2273 . 1 1 9 GLY H H -5.617 6.909 0.760 . . . 1.0 . . . . . . . . . . . . A . 9 GLY H . . . . . . . . . c19595_2mgo 1 . 17 . 2274 . 1 1 9 GLY HA2 H -5.393 9.654 0.848 . . . 1.0 . . . . . . . . . . . . A . 9 GLY HA2 . . . . . . . . . c19595_2mgo 1 . 17 . 2275 . 1 1 9 GLY HA3 H -6.868 9.317 -0.064 . . . 1.0 . . . . . . . . . . . . A . 9 GLY HA3 . . . . . . . . . c19595_2mgo 1 . 17 . 2276 . 1 1 9 GLY N N -5.608 7.722 0.218 . . . 1.0 . . . . . . . . . . . . A . 9 GLY N . . . . . . . . . c19595_2mgo 1 . 17 . 2277 . 1 1 9 GLY O O -6.506 7.810 2.719 . . . 1.0 . . . . . . . . . . . . A . 9 GLY O . . . . . . . . . c19595_2mgo 1 . 17 . 2278 . 1 1 9 GLY OXT O -7.912 9.382 2.197 . . . 1.0 . . . . . . . . . . . . A . 9 GLY OXT . . . . . . . . . c19595_2mgo 1 . 18 . 2279 . 1 1 1 CYS C C 4.452 0.060 -0.675 . . . 1.0 . . . . . . . . . . . . A . 1 CYS C . . . . . . . . . c19595_2mgo 1 . 18 . 2280 . 1 1 1 CYS CA C 4.175 1.336 0.092 . . . 1.0 . . . . . . . . . . . . A . 1 CYS CA . . . . . . . . . c19595_2mgo 1 . 18 . 2281 . 1 1 1 CYS CB C 2.846 1.210 0.828 . . . 1.0 . . . . . . . . . . . . A . 1 CYS CB . . . . . . . . . c19595_2mgo 1 . 18 . 2282 . 1 1 1 CYS H1 H 3.356 2.295 -1.530 . . . 1.0 . . . . . . . . . . . . A . 1 CYS H1 . . . . . . . . . c19595_2mgo 1 . 18 . 2283 . 1 1 1 CYS H2 H 5.010 2.530 -1.363 . . . 1.0 . . . . . . . . . . . . A . 1 CYS H2 . . . . . . . . . c19595_2mgo 1 . 18 . 2284 . 1 1 1 CYS H3 H 3.932 3.347 -0.335 . . . 1.0 . . . . . . . . . . . . A . 1 CYS H3 . . . . . . . . . c19595_2mgo 1 . 18 . 2285 . 1 1 1 CYS HA H 4.968 1.505 0.803 . . . 1.0 . . . . . . . . . . . . A . 1 CYS HA . . . . . . . . . c19595_2mgo 1 . 18 . 2286 . 1 1 1 CYS HB2 H 2.073 1.007 0.104 . . . 1.0 . . . . . . . . . . . . A . 1 CYS HB2 . . . . . . . . . c19595_2mgo 1 . 18 . 2287 . 1 1 1 CYS HB3 H 2.892 0.377 1.515 . . . 1.0 . . . . . . . . . . . . A . 1 CYS HB3 . . . . . . . . . c19595_2mgo 1 . 18 . 2288 . 1 1 1 CYS N N 4.116 2.457 -0.838 . . . 1.0 . . . . . . . . . . . . A . 1 CYS N . . . . . . . . . c19595_2mgo 1 . 18 . 2289 . 1 1 1 CYS O O 4.293 0.027 -1.893 . . . 1.0 . . . . . . . . . . . . A . 1 CYS O . . . . . . . . . c19595_2mgo 1 . 18 . 2290 . 1 1 1 CYS SG S 2.354 2.687 1.767 . . . 1.0 . . . . . . . . . . . . A . 1 CYS SG . . . . . . . . . c19595_2mgo 1 . 18 . 2291 . 1 1 2 TYR C C 3.988 -3.224 -0.381 . . . 1.0 . . . . . . . . . . . . A . 2 TYR C . . . . . . . . . c19595_2mgo 1 . 18 . 2292 . 1 1 2 TYR CA C 5.153 -2.268 -0.624 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CA . . . . . . . . . c19595_2mgo 1 . 18 . 2293 . 1 1 2 TYR CB C 6.481 -2.873 -0.119 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CB . . . . . . . . . c19595_2mgo 1 . 18 . 2294 . 1 1 2 TYR CD1 C 6.046 -4.347 1.884 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CD1 . . . . . . . . . c19595_2mgo 1 . 18 . 2295 . 1 1 2 TYR CD2 C 7.039 -2.223 2.258 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CD2 . . . . . . . . . c19595_2mgo 1 . 18 . 2296 . 1 1 2 TYR CE1 C 6.072 -4.608 3.224 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CE1 . . . . . . . . . c19595_2mgo 1 . 18 . 2297 . 1 1 2 TYR CE2 C 7.070 -2.479 3.610 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CE2 . . . . . . . . . c19595_2mgo 1 . 18 . 2298 . 1 1 2 TYR CG C 6.526 -3.151 1.371 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CG . . . . . . . . . c19595_2mgo 1 . 18 . 2299 . 1 1 2 TYR CZ C 6.583 -3.675 4.085 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CZ . . . . . . . . . c19595_2mgo 1 . 18 . 2300 . 1 1 2 TYR H H 5.056 -0.900 0.984 . . . 1.0 . . . . . . . . . . . . A . 2 TYR H . . . . . . . . . c19595_2mgo 1 . 18 . 2301 . 1 1 2 TYR HA H 5.222 -2.087 -1.686 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HA . . . . . . . . . c19595_2mgo 1 . 18 . 2302 . 1 1 2 TYR HB2 H 6.641 -3.811 -0.624 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HB2 . . . . . . . . . c19595_2mgo 1 . 18 . 2303 . 1 1 2 TYR HB3 H 7.291 -2.199 -0.359 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HB3 . . . . . . . . . c19595_2mgo 1 . 18 . 2304 . 1 1 2 TYR HD1 H 5.643 -5.088 1.209 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HD1 . . . . . . . . . c19595_2mgo 1 . 18 . 2305 . 1 1 2 TYR HD2 H 7.419 -1.283 1.885 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HD2 . . . . . . . . . c19595_2mgo 1 . 18 . 2306 . 1 1 2 TYR HE1 H 5.681 -5.549 3.582 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HE1 . . . . . . . . . c19595_2mgo 1 . 18 . 2307 . 1 1 2 TYR HE2 H 7.473 -1.738 4.282 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HE2 . . . . . . . . . c19595_2mgo 1 . 18 . 2308 . 1 1 2 TYR HH H 6.826 -4.869 5.551 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HH . . . . . . . . . c19595_2mgo 1 . 18 . 2309 . 1 1 2 TYR N N 4.886 -0.982 0.019 . . . 1.0 . . . . . . . . . . . . A . 2 TYR N . . . . . . . . . c19595_2mgo 1 . 18 . 2310 . 1 1 2 TYR O O 4.030 -4.405 -0.726 . . . 1.0 . . . . . . . . . . . . A . 2 TYR O . . . . . . . . . c19595_2mgo 1 . 18 . 2311 . 1 1 2 TYR OH O 6.606 -3.935 5.426 . . . 1.0 . . . . . . . . . . . . A . 2 TYR OH . . . . . . . . . c19595_2mgo 1 . 18 . 2312 . 1 1 3 ILE C C 0.635 -2.638 -0.107 . . . 1.0 . . . . . . . . . . . . A . 3 ILE C . . . . . . . . . c19595_2mgo 1 . 18 . 2313 . 1 1 3 ILE CA C 1.774 -3.380 0.537 . . . 1.0 . . . . . . . . . . . . A . 3 ILE CA . . . . . . . . . c19595_2mgo 1 . 18 . 2314 . 1 1 3 ILE CB C 1.536 -3.453 2.072 . . . 1.0 . . . . . . . . . . . . A . 3 ILE CB . . . . . . . . . c19595_2mgo 1 . 18 . 2315 . 1 1 3 ILE CD1 C 1.280 -2.038 4.198 . . . 1.0 . . . . . . . . . . . . A . 3 ILE CD1 . . . . . . . . . c19595_2mgo 1 . 18 . 2316 . 1 1 3 ILE CG1 C 1.632 -2.057 2.726 . . . 1.0 . . . . . . . . . . . . A . 3 ILE CG1 . . . . . . . . . c19595_2mgo 1 . 18 . 2317 . 1 1 3 ILE CG2 C 2.481 -4.445 2.733 . . . 1.0 . . . . . . . . . . . . A . 3 ILE CG2 . . . . . . . . . c19595_2mgo 1 . 18 . 2318 . 1 1 3 ILE H H 2.962 -1.742 0.450 . . . 1.0 . . . . . . . . . . . . A . 3 ILE H . . . . . . . . . c19595_2mgo 1 . 18 . 2319 . 1 1 3 ILE HA H 1.834 -4.383 0.139 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HA . . . . . . . . . c19595_2mgo 1 . 18 . 2320 . 1 1 3 ILE HB H 0.534 -3.822 2.210 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HB . . . . . . . . . c19595_2mgo 1 . 18 . 2321 . 1 1 3 ILE HD11 H 1.358 -1.030 4.574 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HD11 . . . . . . . . . c19595_2mgo 1 . 18 . 2322 . 1 1 3 ILE HD12 H 1.960 -2.680 4.738 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HD12 . . . . . . . . . c19595_2mgo 1 . 18 . 2323 . 1 1 3 ILE HD13 H 0.269 -2.393 4.330 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HD13 . . . . . . . . . c19595_2mgo 1 . 18 . 2324 . 1 1 3 ILE HG12 H 2.643 -1.693 2.628 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HG12 . . . . . . . . . c19595_2mgo 1 . 18 . 2325 . 1 1 3 ILE HG13 H 0.963 -1.382 2.212 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HG13 . . . . . . . . . c19595_2mgo 1 . 18 . 2326 . 1 1 3 ILE HG21 H 2.294 -4.466 3.796 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HG21 . . . . . . . . . c19595_2mgo 1 . 18 . 2327 . 1 1 3 ILE HG22 H 3.502 -4.143 2.553 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HG22 . . . . . . . . . c19595_2mgo 1 . 18 . 2328 . 1 1 3 ILE HG23 H 2.318 -5.430 2.320 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HG23 . . . . . . . . . c19595_2mgo 1 . 18 . 2329 . 1 1 3 ILE N N 2.965 -2.688 0.223 . . . 1.0 . . . . . . . . . . . . A . 3 ILE N . . . . . . . . . c19595_2mgo 1 . 18 . 2330 . 1 1 3 ILE O O 0.699 -1.408 -0.258 . . . 1.0 . . . . . . . . . . . . A . 3 ILE O . . . . . . . . . c19595_2mgo 1 . 18 . 2331 . 1 1 4 GLN C C -2.480 -2.138 -0.109 . . . 1.0 . . . . . . . . . . . . A . 4 GLN C . . . . . . . . . c19595_2mgo 1 . 18 . 2332 . 1 1 4 GLN CA C -1.548 -2.757 -1.136 . . . 1.0 . . . . . . . . . . . . A . 4 GLN CA . . . . . . . . . c19595_2mgo 1 . 18 . 2333 . 1 1 4 GLN CB C -2.282 -3.785 -1.991 . . . 1.0 . . . . . . . . . . . . A . 4 GLN CB . . . . . . . . . c19595_2mgo 1 . 18 . 2334 . 1 1 4 GLN CD C -3.715 -5.862 -2.060 . . . 1.0 . . . . . . . . . . . . A . 4 GLN CD . . . . . . . . . c19595_2mgo 1 . 18 . 2335 . 1 1 4 GLN CG C -3.070 -4.815 -1.195 . . . 1.0 . . . . . . . . . . . . A . 4 GLN CG . . . . . . . . . c19595_2mgo 1 . 18 . 2336 . 1 1 4 GLN H H -0.356 -4.312 -0.270 . . . 1.0 . . . . . . . . . . . . A . 4 GLN H . . . . . . . . . c19595_2mgo 1 . 18 . 2337 . 1 1 4 GLN HA H -1.173 -1.962 -1.755 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HA . . . . . . . . . c19595_2mgo 1 . 18 . 2338 . 1 1 4 GLN HB2 H -2.961 -3.272 -2.655 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HB2 . . . . . . . . . c19595_2mgo 1 . 18 . 2339 . 1 1 4 GLN HB3 H -1.541 -4.311 -2.577 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HB3 . . . . . . . . . c19595_2mgo 1 . 18 . 2340 . 1 1 4 GLN HE21 H -3.656 -7.139 -0.569 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HE21 . . . . . . . . . c19595_2mgo 1 . 18 . 2341 . 1 1 4 GLN HE22 H -4.343 -7.722 -2.038 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HE22 . . . . . . . . . c19595_2mgo 1 . 18 . 2342 . 1 1 4 GLN HG2 H -2.405 -5.311 -0.506 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HG2 . . . . . . . . . c19595_2mgo 1 . 18 . 2343 . 1 1 4 GLN HG3 H -3.841 -4.303 -0.638 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HG3 . . . . . . . . . c19595_2mgo 1 . 18 . 2344 . 1 1 4 GLN N N -0.390 -3.350 -0.467 . . . 1.0 . . . . . . . . . . . . A . 4 GLN N . . . . . . . . . c19595_2mgo 1 . 18 . 2345 . 1 1 4 GLN NE2 N -3.924 -7.014 -1.506 . . . 1.0 . . . . . . . . . . . . A . 4 GLN NE2 . . . . . . . . . c19595_2mgo 1 . 18 . 2346 . 1 1 4 GLN O O -3.405 -1.393 -0.429 . . . 1.0 . . . . . . . . . . . . A . 4 GLN O . . . . . . . . . c19595_2mgo 1 . 18 . 2347 . 1 1 4 GLN OE1 O -4.054 -5.616 -3.221 . . . 1.0 . . . . . . . . . . . . A . 4 GLN OE1 . . . . . . . . . c19595_2mgo 1 . 18 . 2348 . 1 1 5 ASN C C -2.155 -0.723 2.814 . . . 1.0 . . . . . . . . . . . . A . 5 ASN C . . . . . . . . . c19595_2mgo 1 . 18 . 2349 . 1 1 5 ASN CA C -2.914 -1.918 2.275 . . . 1.0 . . . . . . . . . . . . A . 5 ASN CA . . . . . . . . . c19595_2mgo 1 . 18 . 2350 . 1 1 5 ASN CB C -3.039 -3.008 3.360 . . . 1.0 . . . . . . . . . . . . A . 5 ASN CB . . . . . . . . . c19595_2mgo 1 . 18 . 2351 . 1 1 5 ASN CG C -3.841 -4.214 2.898 . . . 1.0 . . . . . . . . . . . . A . 5 ASN CG . . . . . . . . . c19595_2mgo 1 . 18 . 2352 . 1 1 5 ASN H H -1.427 -3.040 1.216 . . . 1.0 . . . . . . . . . . . . A . 5 ASN H . . . . . . . . . c19595_2mgo 1 . 18 . 2353 . 1 1 5 ASN HA H -3.896 -1.606 1.953 . . . 1.0 . . . . . . . . . . . . A . 5 ASN HA . . . . . . . . . c19595_2mgo 1 . 18 . 2354 . 1 1 5 ASN HB2 H -2.051 -3.344 3.636 . . . 1.0 . . . . . . . . . . . . A . 5 ASN HB2 . . . . . . . . . c19595_2mgo 1 . 18 . 2355 . 1 1 5 ASN HB3 H -3.523 -2.585 4.229 . . . 1.0 . . . . . . . . . . . . A . 5 ASN HB3 . . . . . . . . . c19595_2mgo 1 . 18 . 2356 . 1 1 5 ASN HD21 H -2.825 -5.404 4.100 . . . 1.0 . . . . . . . . . . . . A . 5 ASN HD21 . . . . . . . . . c19595_2mgo 1 . 18 . 2357 . 1 1 5 ASN HD22 H -4.021 -6.164 3.122 . . . 1.0 . . . . . . . . . . . . A . 5 ASN HD22 . . . . . . . . . c19595_2mgo 1 . 18 . 2358 . 1 1 5 ASN N N -2.189 -2.433 1.116 . . . 1.0 . . . . . . . . . . . . A . 5 ASN N . . . . . . . . . c19595_2mgo 1 . 18 . 2359 . 1 1 5 ASN ND2 N -3.540 -5.365 3.433 . . . 1.0 . . . . . . . . . . . . A . 5 ASN ND2 . . . . . . . . . c19595_2mgo 1 . 18 . 2360 . 1 1 5 ASN O O -2.113 -0.473 4.016 . . . 1.0 . . . . . . . . . . . . A . 5 ASN O . . . . . . . . . c19595_2mgo 1 . 18 . 2361 . 1 1 5 ASN OD1 O -4.737 -4.102 2.060 . . . 1.0 . . . . . . . . . . . . A . 5 ASN OD1 . . . . . . . . . c19595_2mgo 1 . 18 . 2362 . 1 1 6 CYS C C -1.536 2.209 2.965 . . . 1.0 . . . . . . . . . . . . A . 6 CYS C . . . . . . . . . c19595_2mgo 1 . 18 . 2363 . 1 1 6 CYS CA C -0.771 1.194 2.123 . . . 1.0 . . . . . . . . . . . . A . 6 CYS CA . . . . . . . . . c19595_2mgo 1 . 18 . 2364 . 1 1 6 CYS CB C -0.407 1.821 0.768 . . . 1.0 . . . . . . . . . . . . A . 6 CYS CB . . . . . . . . . c19595_2mgo 1 . 18 . 2365 . 1 1 6 CYS H H -1.725 -0.265 0.953 . . . 1.0 . . . . . . . . . . . . A . 6 CYS H . . . . . . . . . c19595_2mgo 1 . 18 . 2366 . 1 1 6 CYS HA H 0.142 0.900 2.616 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HA . . . . . . . . . c19595_2mgo 1 . 18 . 2367 . 1 1 6 CYS HB2 H 0.088 1.083 0.158 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HB2 . . . . . . . . . c19595_2mgo 1 . 18 . 2368 . 1 1 6 CYS HB3 H -1.326 2.102 0.274 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HB3 . . . . . . . . . c19595_2mgo 1 . 18 . 2369 . 1 1 6 CYS N N -1.576 0.012 1.880 . . . 1.0 . . . . . . . . . . . . A . 6 CYS N . . . . . . . . . c19595_2mgo 1 . 18 . 2370 . 1 1 6 CYS O O -2.667 2.571 2.614 . . . 1.0 . . . . . . . . . . . . A . 6 CYS O . . . . . . . . . c19595_2mgo 1 . 18 . 2371 . 1 1 6 CYS SG S 0.659 3.309 0.847 . . . 1.0 . . . . . . . . . . . . A . 6 CYS SG . . . . . . . . . c19595_2mgo 1 . 18 . 2372 . 1 1 7 PRO C C -1.663 4.990 4.187 . . . 1.0 . . . . . . . . . . . . A . 7 PRO C . . . . . . . . . c19595_2mgo 1 . 18 . 2373 . 1 1 7 PRO CA C -1.571 3.668 4.942 . . . 1.0 . . . . . . . . . . . . A . 7 PRO CA . . . . . . . . . c19595_2mgo 1 . 18 . 2374 . 1 1 7 PRO CB C -0.612 3.806 6.136 . . . 1.0 . . . . . . . . . . . . A . 7 PRO CB . . . . . . . . . c19595_2mgo 1 . 18 . 2375 . 1 1 7 PRO CD C 0.318 2.168 4.666 . . . 1.0 . . . . . . . . . . . . A . 7 PRO CD . . . . . . . . . c19595_2mgo 1 . 18 . 2376 . 1 1 7 PRO CG C 0.241 2.587 6.100 . . . 1.0 . . . . . . . . . . . . A . 7 PRO CG . . . . . . . . . c19595_2mgo 1 . 18 . 2377 . 1 1 7 PRO HA H -2.553 3.372 5.279 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HA . . . . . . . . . c19595_2mgo 1 . 18 . 2378 . 1 1 7 PRO HB2 H -0.022 4.702 6.019 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HB2 . . . . . . . . . c19595_2mgo 1 . 18 . 2379 . 1 1 7 PRO HB3 H -1.180 3.862 7.052 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HB3 . . . . . . . . . c19595_2mgo 1 . 18 . 2380 . 1 1 7 PRO HD2 H 1.159 2.637 4.175 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HD2 . . . . . . . . . c19595_2mgo 1 . 18 . 2381 . 1 1 7 PRO HD3 H 0.387 1.093 4.603 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HD3 . . . . . . . . . c19595_2mgo 1 . 18 . 2382 . 1 1 7 PRO HG2 H 1.229 2.814 6.478 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HG2 . . . . . . . . . c19595_2mgo 1 . 18 . 2383 . 1 1 7 PRO HG3 H -0.214 1.807 6.693 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HG3 . . . . . . . . . c19595_2mgo 1 . 18 . 2384 . 1 1 7 PRO N N -0.961 2.647 4.103 . . . 1.0 . . . . . . . . . . . . A . 7 PRO N . . . . . . . . . c19595_2mgo 1 . 18 . 2385 . 1 1 7 PRO O O -0.663 5.687 4.000 . . . 1.0 . . . . . . . . . . . . A . 7 PRO O . . . . . . . . . c19595_2mgo 1 . 18 . 2386 . 1 1 8 LEU C C -3.703 7.574 3.725 . . . 1.0 . . . . . . . . . . . . A . 8 LEU C . . . . . . . . . c19595_2mgo 1 . 18 . 2387 . 1 1 8 LEU CA C -3.045 6.508 2.912 . . . 1.0 . . . . . . . . . . . . A . 8 LEU CA . . . . . . . . . c19595_2mgo 1 . 18 . 2388 . 1 1 8 LEU CB C -3.874 6.213 1.677 . . . 1.0 . . . . . . . . . . . . A . 8 LEU CB . . . . . . . . . c19595_2mgo 1 . 18 . 2389 . 1 1 8 LEU CD1 C -4.255 5.017 -0.476 . . . 1.0 . . . . . . . . . . . . A . 8 LEU CD1 . . . . . . . . . c19595_2mgo 1 . 18 . 2390 . 1 1 8 LEU CD2 C -1.969 5.788 0.115 . . . 1.0 . . . . . . . . . . . . A . 8 LEU CD2 . . . . . . . . . c19595_2mgo 1 . 18 . 2391 . 1 1 8 LEU CG C -3.277 5.249 0.656 . . . 1.0 . . . . . . . . . . . . A . 8 LEU CG . . . . . . . . . c19595_2mgo 1 . 18 . 2392 . 1 1 8 LEU H H -3.592 4.688 3.865 . . . 1.0 . . . . . . . . . . . . A . 8 LEU H . . . . . . . . . c19595_2mgo 1 . 18 . 2393 . 1 1 8 LEU HA H -2.078 6.865 2.618 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HA . . . . . . . . . c19595_2mgo 1 . 18 . 2394 . 1 1 8 LEU HB2 H -4.812 5.796 2.014 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HB2 . . . . . . . . . c19595_2mgo 1 . 18 . 2395 . 1 1 8 LEU HB3 H -4.073 7.154 1.190 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HB3 . . . . . . . . . c19595_2mgo 1 . 18 . 2396 . 1 1 8 LEU HD11 H -4.472 5.954 -0.965 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HD11 . . . . . . . . . c19595_2mgo 1 . 18 . 2397 . 1 1 8 LEU HD12 H -5.170 4.598 -0.081 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HD12 . . . . . . . . . c19595_2mgo 1 . 18 . 2398 . 1 1 8 LEU HD13 H -3.824 4.330 -1.188 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HD13 . . . . . . . . . c19595_2mgo 1 . 18 . 2399 . 1 1 8 LEU HD21 H -2.134 6.751 -0.344 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HD21 . . . . . . . . . c19595_2mgo 1 . 18 . 2400 . 1 1 8 LEU HD22 H -1.581 5.100 -0.622 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HD22 . . . . . . . . . c19595_2mgo 1 . 18 . 2401 . 1 1 8 LEU HD23 H -1.256 5.884 0.920 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HD23 . . . . . . . . . c19595_2mgo 1 . 18 . 2402 . 1 1 8 LEU HG H -3.083 4.299 1.135 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HG . . . . . . . . . c19595_2mgo 1 . 18 . 2403 . 1 1 8 LEU N N -2.843 5.301 3.705 . . . 1.0 . . . . . . . . . . . . A . 8 LEU N . . . . . . . . . c19595_2mgo 1 . 18 . 2404 . 1 1 8 LEU O O -3.853 8.722 3.298 . . . 1.0 . . . . . . . . . . . . A . 8 LEU O . . . . . . . . . c19595_2mgo 1 . 18 . 2405 . 1 1 9 GLY C C -5.514 7.229 6.725 . . . 1.0 . . . . . . . . . . . . A . 9 GLY C . . . . . . . . . c19595_2mgo 1 . 18 . 2406 . 1 1 9 GLY CA C -4.724 8.051 5.779 . . . 1.0 . . . . . . . . . . . . A . 9 GLY CA . . . . . . . . . c19595_2mgo 1 . 18 . 2407 . 1 1 9 GLY H H -3.824 6.269 5.071 . . . 1.0 . . . . . . . . . . . . A . 9 GLY H . . . . . . . . . c19595_2mgo 1 . 18 . 2408 . 1 1 9 GLY HA2 H -3.998 8.640 6.323 . . . 1.0 . . . . . . . . . . . . A . 9 GLY HA2 . . . . . . . . . c19595_2mgo 1 . 18 . 2409 . 1 1 9 GLY HA3 H -5.391 8.704 5.237 . . . 1.0 . . . . . . . . . . . . A . 9 GLY HA3 . . . . . . . . . c19595_2mgo 1 . 18 . 2410 . 1 1 9 GLY N N -4.054 7.197 4.866 . . . 1.0 . . . . . . . . . . . . A . 9 GLY N . . . . . . . . . c19595_2mgo 1 . 18 . 2411 . 1 1 9 GLY O O -4.970 6.831 7.755 . . . 1.0 . . . . . . . . . . . . A . 9 GLY O . . . . . . . . . c19595_2mgo 1 . 18 . 2412 . 1 1 9 GLY OXT O -6.685 6.906 6.420 . . . 1.0 . . . . . . . . . . . . A . 9 GLY OXT . . . . . . . . . c19595_2mgo 1 . 19 . 2413 . 1 1 1 CYS C C 4.586 0.273 -0.618 . . . 1.0 . . . . . . . . . . . . A . 1 CYS C . . . . . . . . . c19595_2mgo 1 . 19 . 2414 . 1 1 1 CYS CA C 4.720 1.536 0.204 . . . 1.0 . . . . . . . . . . . . A . 1 CYS CA . . . . . . . . . c19595_2mgo 1 . 19 . 2415 . 1 1 1 CYS CB C 3.408 1.871 0.898 . . . 1.0 . . . . . . . . . . . . A . 1 CYS CB . . . . . . . . . c19595_2mgo 1 . 19 . 2416 . 1 1 1 CYS H1 H 4.373 2.752 -1.389 . . . 1.0 . . . . . . . . . . . . A . 1 CYS H1 . . . . . . . . . c19595_2mgo 1 . 19 . 2417 . 1 1 1 CYS H2 H 6.011 2.407 -1.114 . . . 1.0 . . . . . . . . . . . . A . 1 CYS H2 . . . . . . . . . c19595_2mgo 1 . 19 . 2418 . 1 1 1 CYS H3 H 5.211 3.509 -0.118 . . . 1.0 . . . . . . . . . . . . A . 1 CYS H3 . . . . . . . . . c19595_2mgo 1 . 19 . 2419 . 1 1 1 CYS HA H 5.495 1.399 0.942 . . . 1.0 . . . . . . . . . . . . A . 1 CYS HA . . . . . . . . . c19595_2mgo 1 . 19 . 2420 . 1 1 1 CYS HB2 H 3.070 1.003 1.445 . . . 1.0 . . . . . . . . . . . . A . 1 CYS HB2 . . . . . . . . . c19595_2mgo 1 . 19 . 2421 . 1 1 1 CYS HB3 H 3.561 2.686 1.590 . . . 1.0 . . . . . . . . . . . . A . 1 CYS HB3 . . . . . . . . . c19595_2mgo 1 . 19 . 2422 . 1 1 1 CYS N N 5.102 2.632 -0.660 . . . 1.0 . . . . . . . . . . . . A . 1 CYS N . . . . . . . . . c19595_2mgo 1 . 19 . 2423 . 1 1 1 CYS O O 4.026 0.292 -1.718 . . . 1.0 . . . . . . . . . . . . A . 1 CYS O . . . . . . . . . c19595_2mgo 1 . 19 . 2424 . 1 1 1 CYS SG S 2.079 2.354 -0.245 . . . 1.0 . . . . . . . . . . . . A . 1 CYS SG . . . . . . . . . c19595_2mgo 1 . 19 . 2425 . 1 1 2 TYR C C 4.028 -2.978 -0.162 . . . 1.0 . . . . . . . . . . . . A . 2 TYR C . . . . . . . . . c19595_2mgo 1 . 19 . 2426 . 1 1 2 TYR CA C 5.068 -2.070 -0.820 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CA . . . . . . . . . c19595_2mgo 1 . 19 . 2427 . 1 1 2 TYR CB C 6.483 -2.684 -0.799 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CB . . . . . . . . . c19595_2mgo 1 . 19 . 2428 . 1 1 2 TYR CD1 C 6.512 -3.810 -3.058 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CD1 . . . . . . . . . c19595_2mgo 1 . 19 . 2429 . 1 1 2 TYR CD2 C 7.075 -5.112 -1.151 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CD2 . . . . . . . . . c19595_2mgo 1 . 19 . 2430 . 1 1 2 TYR CE1 C 6.713 -4.903 -3.869 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CE1 . . . . . . . . . c19595_2mgo 1 . 19 . 2431 . 1 1 2 TYR CE2 C 7.278 -6.210 -1.955 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CE2 . . . . . . . . . c19595_2mgo 1 . 19 . 2432 . 1 1 2 TYR CG C 6.686 -3.896 -1.687 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CG . . . . . . . . . c19595_2mgo 1 . 19 . 2433 . 1 1 2 TYR CZ C 7.094 -6.102 -3.313 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CZ . . . . . . . . . c19595_2mgo 1 . 19 . 2434 . 1 1 2 TYR H H 5.512 -0.797 0.778 . . . 1.0 . . . . . . . . . . . . A . 2 TYR H . . . . . . . . . c19595_2mgo 1 . 19 . 2435 . 1 1 2 TYR HA H 4.773 -1.877 -1.841 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HA . . . . . . . . . c19595_2mgo 1 . 19 . 2436 . 1 1 2 TYR HB2 H 7.189 -1.931 -1.117 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HB2 . . . . . . . . . c19595_2mgo 1 . 19 . 2437 . 1 1 2 TYR HB3 H 6.716 -2.969 0.215 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HB3 . . . . . . . . . c19595_2mgo 1 . 19 . 2438 . 1 1 2 TYR HD1 H 6.208 -2.870 -3.495 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HD1 . . . . . . . . . c19595_2mgo 1 . 19 . 2439 . 1 1 2 TYR HD2 H 7.219 -5.195 -0.084 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HD2 . . . . . . . . . c19595_2mgo 1 . 19 . 2440 . 1 1 2 TYR HE1 H 6.570 -4.808 -4.936 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HE1 . . . . . . . . . c19595_2mgo 1 . 19 . 2441 . 1 1 2 TYR HE2 H 7.579 -7.148 -1.510 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HE2 . . . . . . . . . c19595_2mgo 1 . 19 . 2442 . 1 1 2 TYR HH H 7.013 -7.989 -3.640 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HH . . . . . . . . . c19595_2mgo 1 . 19 . 2443 . 1 1 2 TYR N N 5.097 -0.814 -0.113 . . . 1.0 . . . . . . . . . . . . A . 2 TYR N . . . . . . . . . c19595_2mgo 1 . 19 . 2444 . 1 1 2 TYR O O 4.317 -4.083 0.293 . . . 1.0 . . . . . . . . . . . . A . 2 TYR O . . . . . . . . . c19595_2mgo 1 . 19 . 2445 . 1 1 2 TYR OH O 7.294 -7.195 -4.121 . . . 1.0 . . . . . . . . . . . . A . 2 TYR OH . . . . . . . . . c19595_2mgo 1 . 19 . 2446 . 1 1 3 ILE C C 0.518 -2.937 -0.350 . . . 1.0 . . . . . . . . . . . . A . 3 ILE C . . . . . . . . . c19595_2mgo 1 . 19 . 2447 . 1 1 3 ILE CA C 1.721 -3.175 0.535 . . . 1.0 . . . . . . . . . . . . A . 3 ILE CA . . . . . . . . . c19595_2mgo 1 . 19 . 2448 . 1 1 3 ILE CB C 1.362 -2.569 1.941 . . . 1.0 . . . . . . . . . . . . A . 3 ILE CB . . . . . . . . . c19595_2mgo 1 . 19 . 2449 . 1 1 3 ILE CD1 C 2.298 -1.301 3.967 . . . 1.0 . . . . . . . . . . . . A . 3 ILE CD1 . . . . . . . . . c19595_2mgo 1 . 19 . 2450 . 1 1 3 ILE CG1 C 2.599 -2.006 2.661 . . . 1.0 . . . . . . . . . . . . A . 3 ILE CG1 . . . . . . . . . c19595_2mgo 1 . 19 . 2451 . 1 1 3 ILE CG2 C 0.696 -3.634 2.823 . . . 1.0 . . . . . . . . . . . . A . 3 ILE CG2 . . . . . . . . . c19595_2mgo 1 . 19 . 2452 . 1 1 3 ILE H H 2.588 -1.628 -0.528 . . . 1.0 . . . . . . . . . . . . A . 3 ILE H . . . . . . . . . c19595_2mgo 1 . 19 . 2453 . 1 1 3 ILE HA H 1.943 -4.227 0.627 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HA . . . . . . . . . c19595_2mgo 1 . 19 . 2454 . 1 1 3 ILE HB H 0.638 -1.789 1.775 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HB . . . . . . . . . c19595_2mgo 1 . 19 . 2455 . 1 1 3 ILE HD11 H 3.217 -0.942 4.406 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HD11 . . . . . . . . . c19595_2mgo 1 . 19 . 2456 . 1 1 3 ILE HD12 H 1.825 -1.998 4.644 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HD12 . . . . . . . . . c19595_2mgo 1 . 19 . 2457 . 1 1 3 ILE HD13 H 1.635 -0.467 3.785 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HD13 . . . . . . . . . c19595_2mgo 1 . 19 . 2458 . 1 1 3 ILE HG12 H 3.273 -2.820 2.878 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HG12 . . . . . . . . . c19595_2mgo 1 . 19 . 2459 . 1 1 3 ILE HG13 H 3.095 -1.305 2.006 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HG13 . . . . . . . . . c19595_2mgo 1 . 19 . 2460 . 1 1 3 ILE HG21 H 0.485 -3.211 3.794 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HG21 . . . . . . . . . c19595_2mgo 1 . 19 . 2461 . 1 1 3 ILE HG22 H 1.360 -4.478 2.935 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HG22 . . . . . . . . . c19595_2mgo 1 . 19 . 2462 . 1 1 3 ILE HG23 H -0.227 -3.956 2.364 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HG23 . . . . . . . . . c19595_2mgo 1 . 19 . 2463 . 1 1 3 ILE N N 2.810 -2.478 -0.095 . . . 1.0 . . . . . . . . . . . . A . 3 ILE N . . . . . . . . . c19595_2mgo 1 . 19 . 2464 . 1 1 3 ILE O O 0.537 -2.041 -1.199 . . . 1.0 . . . . . . . . . . . . A . 3 ILE O . . . . . . . . . c19595_2mgo 1 . 19 . 2465 . 1 1 4 GLN C C -2.765 -2.806 0.014 . . . 1.0 . . . . . . . . . . . . A . 4 GLN C . . . . . . . . . c19595_2mgo 1 . 19 . 2466 . 1 1 4 GLN CA C -1.753 -3.506 -0.879 . . . 1.0 . . . . . . . . . . . . A . 4 GLN CA . . . . . . . . . c19595_2mgo 1 . 19 . 2467 . 1 1 4 GLN CB C -2.319 -4.842 -1.356 . . . 1.0 . . . . . . . . . . . . A . 4 GLN CB . . . . . . . . . c19595_2mgo 1 . 19 . 2468 . 1 1 4 GLN CD C -2.021 -6.937 -2.759 . . . 1.0 . . . . . . . . . . . . A . 4 GLN CD . . . . . . . . . c19595_2mgo 1 . 19 . 2469 . 1 1 4 GLN CG C -1.378 -5.662 -2.227 . . . 1.0 . . . . . . . . . . . . A . 4 GLN CG . . . . . . . . . c19595_2mgo 1 . 19 . 2470 . 1 1 4 GLN H H -0.418 -4.380 0.543 . . . 1.0 . . . . . . . . . . . . A . 4 GLN H . . . . . . . . . c19595_2mgo 1 . 19 . 2471 . 1 1 4 GLN HA H -1.538 -2.875 -1.726 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HA . . . . . . . . . c19595_2mgo 1 . 19 . 2472 . 1 1 4 GLN HB2 H -2.554 -5.433 -0.483 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HB2 . . . . . . . . . c19595_2mgo 1 . 19 . 2473 . 1 1 4 GLN HB3 H -3.228 -4.661 -1.910 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HB3 . . . . . . . . . c19595_2mgo 1 . 19 . 2474 . 1 1 4 GLN HE21 H -3.267 -7.033 -1.210 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HE21 . . . . . . . . . c19595_2mgo 1 . 19 . 2475 . 1 1 4 GLN HE22 H -3.417 -8.285 -2.381 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HE22 . . . . . . . . . c19595_2mgo 1 . 19 . 2476 . 1 1 4 GLN HG2 H -1.072 -5.057 -3.069 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HG2 . . . . . . . . . c19595_2mgo 1 . 19 . 2477 . 1 1 4 GLN HG3 H -0.508 -5.927 -1.646 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HG3 . . . . . . . . . c19595_2mgo 1 . 19 . 2478 . 1 1 4 GLN N N -0.513 -3.682 -0.139 . . . 1.0 . . . . . . . . . . . . A . 4 GLN N . . . . . . . . . c19595_2mgo 1 . 19 . 2479 . 1 1 4 GLN NE2 N -2.992 -7.467 -2.046 . . . 1.0 . . . . . . . . . . . . A . 4 GLN NE2 . . . . . . . . . c19595_2mgo 1 . 19 . 2480 . 1 1 4 GLN O O -3.918 -2.582 -0.365 . . . 1.0 . . . . . . . . . . . . A . 4 GLN O . . . . . . . . . c19595_2mgo 1 . 19 . 2481 . 1 1 4 GLN OE1 O -1.658 -7.427 -3.833 . . . 1.0 . . . . . . . . . . . . A . 4 GLN OE1 . . . . . . . . . c19595_2mgo 1 . 19 . 2482 . 1 1 5 ASN C C -2.718 -0.392 2.434 . . . 1.0 . . . . . . . . . . . . A . 5 ASN C . . . . . . . . . c19595_2mgo 1 . 19 . 2483 . 1 1 5 ASN CA C -3.131 -1.812 2.205 . . . 1.0 . . . . . . . . . . . . A . 5 ASN CA . . . . . . . . . c19595_2mgo 1 . 19 . 2484 . 1 1 5 ASN CB C -3.060 -2.578 3.532 . . . 1.0 . . . . . . . . . . . . A . 5 ASN CB . . . . . . . . . c19595_2mgo 1 . 19 . 2485 . 1 1 5 ASN CG C -3.702 -3.931 3.460 . . . 1.0 . . . . . . . . . . . . A . 5 ASN CG . . . . . . . . . c19595_2mgo 1 . 19 . 2486 . 1 1 5 ASN H H -1.349 -2.585 1.343 . . . 1.0 . . . . . . . . . . . . A . 5 ASN H . . . . . . . . . c19595_2mgo 1 . 19 . 2487 . 1 1 5 ASN HA H -4.151 -1.834 1.854 . . . 1.0 . . . . . . . . . . . . A . 5 ASN HA . . . . . . . . . c19595_2mgo 1 . 19 . 2488 . 1 1 5 ASN HB2 H -2.024 -2.711 3.808 . . . 1.0 . . . . . . . . . . . . A . 5 ASN HB2 . . . . . . . . . c19595_2mgo 1 . 19 . 2489 . 1 1 5 ASN HB3 H -3.557 -2.000 4.298 . . . 1.0 . . . . . . . . . . . . A . 5 ASN HB3 . . . . . . . . . c19595_2mgo 1 . 19 . 2490 . 1 1 5 ASN HD21 H -5.448 -3.158 3.963 . . . 1.0 . . . . . . . . . . . . A . 5 ASN HD21 . . . . . . . . . c19595_2mgo 1 . 19 . 2491 . 1 1 5 ASN HD22 H -5.431 -4.857 3.668 . . . 1.0 . . . . . . . . . . . . A . 5 ASN HD22 . . . . . . . . . c19595_2mgo 1 . 19 . 2492 . 1 1 5 ASN N N -2.301 -2.437 1.183 . . . 1.0 . . . . . . . . . . . . A . 5 ASN N . . . . . . . . . c19595_2mgo 1 . 19 . 2493 . 1 1 5 ASN ND2 N -4.977 -3.989 3.728 . . . 1.0 . . . . . . . . . . . . A . 5 ASN ND2 . . . . . . . . . c19595_2mgo 1 . 19 . 2494 . 1 1 5 ASN O O -2.973 0.168 3.502 . . . 1.0 . . . . . . . . . . . . A . 5 ASN O . . . . . . . . . c19595_2mgo 1 . 19 . 2495 . 1 1 5 ASN OD1 O -3.049 -4.925 3.152 . . . 1.0 . . . . . . . . . . . . A . 5 ASN OD1 . . . . . . . . . c19595_2mgo 1 . 19 . 2496 . 1 1 6 CYS C C -2.923 2.465 1.652 . . . 1.0 . . . . . . . . . . . . A . 6 CYS C . . . . . . . . . c19595_2mgo 1 . 19 . 2497 . 1 1 6 CYS CA C -1.688 1.586 1.544 . . . 1.0 . . . . . . . . . . . . A . 6 CYS CA . . . . . . . . . c19595_2mgo 1 . 19 . 2498 . 1 1 6 CYS CB C -0.854 1.991 0.342 . . . 1.0 . . . . . . . . . . . . A . 6 CYS CB . . . . . . . . . c19595_2mgo 1 . 19 . 2499 . 1 1 6 CYS H H -1.953 -0.271 0.594 . . . 1.0 . . . . . . . . . . . . A . 6 CYS H . . . . . . . . . c19595_2mgo 1 . 19 . 2500 . 1 1 6 CYS HA H -1.098 1.674 2.443 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HA . . . . . . . . . c19595_2mgo 1 . 19 . 2501 . 1 1 6 CYS HB2 H -1.459 1.927 -0.547 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HB2 . . . . . . . . . c19595_2mgo 1 . 19 . 2502 . 1 1 6 CYS HB3 H -0.534 3.015 0.473 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HB3 . . . . . . . . . c19595_2mgo 1 . 19 . 2503 . 1 1 6 CYS N N -2.104 0.207 1.437 . . . 1.0 . . . . . . . . . . . . A . 6 CYS N . . . . . . . . . c19595_2mgo 1 . 19 . 2504 . 1 1 6 CYS O O -3.862 2.298 0.854 . . . 1.0 . . . . . . . . . . . . A . 6 CYS O . . . . . . . . . c19595_2mgo 1 . 19 . 2505 . 1 1 6 CYS SG S 0.640 0.976 0.092 . . . 1.0 . . . . . . . . . . . . A . 6 CYS SG . . . . . . . . . c19595_2mgo 1 . 19 . 2506 . 1 1 7 PRO C C -4.576 5.011 1.719 . . . 1.0 . . . . . . . . . . . . A . 7 PRO C . . . . . . . . . c19595_2mgo 1 . 19 . 2507 . 1 1 7 PRO CA C -4.112 4.228 2.934 . . . 1.0 . . . . . . . . . . . . A . 7 PRO CA . . . . . . . . . c19595_2mgo 1 . 19 . 2508 . 1 1 7 PRO CB C -3.607 5.172 4.018 . . . 1.0 . . . . . . . . . . . . A . 7 PRO CB . . . . . . . . . c19595_2mgo 1 . 19 . 2509 . 1 1 7 PRO CD C -1.907 3.548 3.681 . . . 1.0 . . . . . . . . . . . . A . 7 PRO CD . . . . . . . . . c19595_2mgo 1 . 19 . 2510 . 1 1 7 PRO CG C -2.568 4.387 4.727 . . . 1.0 . . . . . . . . . . . . A . 7 PRO CG . . . . . . . . . c19595_2mgo 1 . 19 . 2511 . 1 1 7 PRO HA H -4.952 3.667 3.317 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HA . . . . . . . . . c19595_2mgo 1 . 19 . 2512 . 1 1 7 PRO HB2 H -3.197 6.059 3.558 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HB2 . . . . . . . . . c19595_2mgo 1 . 19 . 2513 . 1 1 7 PRO HB3 H -4.418 5.443 4.677 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HB3 . . . . . . . . . c19595_2mgo 1 . 19 . 2514 . 1 1 7 PRO HD2 H -1.062 4.072 3.259 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HD2 . . . . . . . . . c19595_2mgo 1 . 19 . 2515 . 1 1 7 PRO HD3 H -1.602 2.607 4.112 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HD3 . . . . . . . . . c19595_2mgo 1 . 19 . 2516 . 1 1 7 PRO HG2 H -1.850 5.050 5.185 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HG2 . . . . . . . . . c19595_2mgo 1 . 19 . 2517 . 1 1 7 PRO HG3 H -3.029 3.758 5.473 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HG3 . . . . . . . . . c19595_2mgo 1 . 19 . 2518 . 1 1 7 PRO N N -2.970 3.352 2.672 . . . 1.0 . . . . . . . . . . . . A . 7 PRO N . . . . . . . . . c19595_2mgo 1 . 19 . 2519 . 1 1 7 PRO O O -3.936 5.966 1.284 . . . 1.0 . . . . . . . . . . . . A . 7 PRO O . . . . . . . . . c19595_2mgo 1 . 19 . 2520 . 1 1 8 LEU C C -7.481 6.006 0.528 . . . 1.0 . . . . . . . . . . . . A . 8 LEU C . . . . . . . . . c19595_2mgo 1 . 19 . 2521 . 1 1 8 LEU CA C -6.279 5.241 0.024 . . . 1.0 . . . . . . . . . . . . A . 8 LEU CA . . . . . . . . . c19595_2mgo 1 . 19 . 2522 . 1 1 8 LEU CB C -6.673 4.216 -1.030 . . . 1.0 . . . . . . . . . . . . A . 8 LEU CB . . . . . . . . . c19595_2mgo 1 . 19 . 2523 . 1 1 8 LEU CD1 C -6.051 5.567 -3.051 . . . 1.0 . . . . . . . . . . . . A . 8 LEU CD1 . . . . . . . . . c19595_2mgo 1 . 19 . 2524 . 1 1 8 LEU CD2 C -7.603 3.625 -3.273 . . . 1.0 . . . . . . . . . . . . A . 8 LEU CD2 . . . . . . . . . c19595_2mgo 1 . 19 . 2525 . 1 1 8 LEU CG C -7.150 4.761 -2.378 . . . 1.0 . . . . . . . . . . . . A . 8 LEU CG . . . . . . . . . c19595_2mgo 1 . 19 . 2526 . 1 1 8 LEU H H -6.066 3.734 1.483 . . . 1.0 . . . . . . . . . . . . A . 8 LEU H . . . . . . . . . c19595_2mgo 1 . 19 . 2527 . 1 1 8 LEU HA H -5.561 5.937 -0.370 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HA . . . . . . . . . c19595_2mgo 1 . 19 . 2528 . 1 1 8 LEU HB2 H -5.813 3.584 -1.184 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HB2 . . . . . . . . . c19595_2mgo 1 . 19 . 2529 . 1 1 8 LEU HB3 H -7.460 3.605 -0.615 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HB3 . . . . . . . . . c19595_2mgo 1 . 19 . 2530 . 1 1 8 LEU HD11 H -5.796 6.419 -2.436 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HD11 . . . . . . . . . c19595_2mgo 1 . 19 . 2531 . 1 1 8 LEU HD12 H -6.388 5.911 -4.018 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HD12 . . . . . . . . . c19595_2mgo 1 . 19 . 2532 . 1 1 8 LEU HD13 H -5.178 4.944 -3.174 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HD13 . . . . . . . . . c19595_2mgo 1 . 19 . 2533 . 1 1 8 LEU HD21 H -6.775 2.955 -3.449 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HD21 . . . . . . . . . c19595_2mgo 1 . 19 . 2534 . 1 1 8 LEU HD22 H -7.953 4.020 -4.214 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HD22 . . . . . . . . . c19595_2mgo 1 . 19 . 2535 . 1 1 8 LEU HD23 H -8.401 3.083 -2.789 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HD23 . . . . . . . . . c19595_2mgo 1 . 19 . 2536 . 1 1 8 LEU HG H -7.991 5.421 -2.213 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HG . . . . . . . . . c19595_2mgo 1 . 19 . 2537 . 1 1 8 LEU N N -5.669 4.571 1.153 . . . 1.0 . . . . . . . . . . . . A . 8 LEU N . . . . . . . . . c19595_2mgo 1 . 19 . 2538 . 1 1 8 LEU O O -8.185 6.698 -0.199 . . . 1.0 . . . . . . . . . . . . A . 8 LEU O . . . . . . . . . c19595_2mgo 1 . 19 . 2539 . 1 1 9 GLY C C -8.585 6.197 3.937 . . . 1.0 . . . . . . . . . . . . A . 9 GLY C . . . . . . . . . c19595_2mgo 1 . 19 . 2540 . 1 1 9 GLY CA C -8.724 6.494 2.484 . . . 1.0 . . . . . . . . . . . . A . 9 GLY CA . . . . . . . . . c19595_2mgo 1 . 19 . 2541 . 1 1 9 GLY H H -7.002 5.313 2.230 . . . 1.0 . . . . . . . . . . . . A . 9 GLY H . . . . . . . . . c19595_2mgo 1 . 19 . 2542 . 1 1 9 GLY HA2 H -8.683 7.561 2.322 . . . 1.0 . . . . . . . . . . . . A . 9 GLY HA2 . . . . . . . . . c19595_2mgo 1 . 19 . 2543 . 1 1 9 GLY HA3 H -9.669 6.106 2.134 . . . 1.0 . . . . . . . . . . . . A . 9 GLY HA3 . . . . . . . . . c19595_2mgo 1 . 19 . 2544 . 1 1 9 GLY N N -7.664 5.874 1.778 . . . 1.0 . . . . . . . . . . . . A . 9 GLY N . . . . . . . . . c19595_2mgo 1 . 19 . 2545 . 1 1 9 GLY O O -7.903 6.956 4.644 . . . 1.0 . . . . . . . . . . . . A . 9 GLY O . . . . . . . . . c19595_2mgo 1 . 19 . 2546 . 1 1 9 GLY OXT O -9.118 5.177 4.401 . . . 1.0 . . . . . . . . . . . . A . 9 GLY OXT . . . . . . . . . c19595_2mgo 1 . 20 . 2547 . 1 1 1 CYS C C 4.416 -0.080 -0.626 . . . 1.0 . . . . . . . . . . . . A . 1 CYS C . . . . . . . . . c19595_2mgo 1 . 20 . 2548 . 1 1 1 CYS CA C 4.132 1.315 -0.091 . . . 1.0 . . . . . . . . . . . . A . 1 CYS CA . . . . . . . . . c19595_2mgo 1 . 20 . 2549 . 1 1 1 CYS CB C 3.047 1.261 0.980 . . . 1.0 . . . . . . . . . . . . A . 1 CYS CB . . . . . . . . . c19595_2mgo 1 . 20 . 2550 . 1 1 1 CYS H1 H 3.480 3.119 -0.931 . . . 1.0 . . . . . . . . . . . . A . 1 CYS H1 . . . . . . . . . c19595_2mgo 1 . 20 . 2551 . 1 1 1 CYS H2 H 2.857 1.723 -1.655 . . . 1.0 . . . . . . . . . . . . A . 1 CYS H2 . . . . . . . . . c19595_2mgo 1 . 20 . 2552 . 1 1 1 CYS H3 H 4.452 2.156 -1.919 . . . 1.0 . . . . . . . . . . . . A . 1 CYS H3 . . . . . . . . . c19595_2mgo 1 . 20 . 2553 . 1 1 1 CYS HA H 5.040 1.737 0.316 . . . 1.0 . . . . . . . . . . . . A . 1 CYS HA . . . . . . . . . c19595_2mgo 1 . 20 . 2554 . 1 1 1 CYS HB2 H 2.176 0.759 0.588 . . . 1.0 . . . . . . . . . . . . A . 1 CYS HB2 . . . . . . . . . c19595_2mgo 1 . 20 . 2555 . 1 1 1 CYS HB3 H 3.424 0.696 1.819 . . . 1.0 . . . . . . . . . . . . A . 1 CYS HB3 . . . . . . . . . c19595_2mgo 1 . 20 . 2556 . 1 1 1 CYS N N 3.696 2.142 -1.207 . . . 1.0 . . . . . . . . . . . . A . 1 CYS N . . . . . . . . . c19595_2mgo 1 . 20 . 2557 . 1 1 1 CYS O O 4.192 -0.338 -1.821 . . . 1.0 . . . . . . . . . . . . A . 1 CYS O . . . . . . . . . c19595_2mgo 1 . 20 . 2558 . 1 1 1 CYS SG S 2.508 2.889 1.621 . . . 1.0 . . . . . . . . . . . . A . 1 CYS SG . . . . . . . . . c19595_2mgo 1 . 20 . 2559 . 1 1 2 TYR C C 3.944 -3.111 -0.483 . . . 1.0 . . . . . . . . . . . . A . 2 TYR C . . . . . . . . . c19595_2mgo 1 . 20 . 2560 . 1 1 2 TYR CA C 5.206 -2.333 -0.245 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CA . . . . . . . . . c19595_2mgo 1 . 20 . 2561 . 1 1 2 TYR CB C 6.188 -3.083 0.669 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CB . . . . . . . . . c19595_2mgo 1 . 20 . 2562 . 1 1 2 TYR CD1 C 7.279 -4.645 -0.992 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CD1 . . . . . . . . . c19595_2mgo 1 . 20 . 2563 . 1 1 2 TYR CD2 C 6.049 -5.608 0.805 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CD2 . . . . . . . . . c19595_2mgo 1 . 20 . 2564 . 1 1 2 TYR CE1 C 7.562 -5.902 -1.480 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CE1 . . . . . . . . . c19595_2mgo 1 . 20 . 2565 . 1 1 2 TYR CE2 C 6.324 -6.870 0.318 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CE2 . . . . . . . . . c19595_2mgo 1 . 20 . 2566 . 1 1 2 TYR CG C 6.521 -4.473 0.159 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CG . . . . . . . . . c19595_2mgo 1 . 20 . 2567 . 1 1 2 TYR CZ C 7.082 -7.009 -0.824 . . . 1.0 . . . . . . . . . . . . A . 2 TYR CZ . . . . . . . . . c19595_2mgo 1 . 20 . 2568 . 1 1 2 TYR H H 5.089 -0.745 1.152 . . . 1.0 . . . . . . . . . . . . A . 2 TYR H . . . . . . . . . c19595_2mgo 1 . 20 . 2569 . 1 1 2 TYR HA H 5.641 -2.213 -1.212 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HA . . . . . . . . . c19595_2mgo 1 . 20 . 2570 . 1 1 2 TYR HB2 H 7.108 -2.521 0.739 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HB2 . . . . . . . . . c19595_2mgo 1 . 20 . 2571 . 1 1 2 TYR HB3 H 5.753 -3.181 1.652 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HB3 . . . . . . . . . c19595_2mgo 1 . 20 . 2572 . 1 1 2 TYR HD1 H 7.660 -3.776 -1.508 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HD1 . . . . . . . . . c19595_2mgo 1 . 20 . 2573 . 1 1 2 TYR HD2 H 5.459 -5.499 1.703 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HD2 . . . . . . . . . c19595_2mgo 1 . 20 . 2574 . 1 1 2 TYR HE1 H 8.157 -6.008 -2.377 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HE1 . . . . . . . . . c19595_2mgo 1 . 20 . 2575 . 1 1 2 TYR HE2 H 5.947 -7.740 0.836 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HE2 . . . . . . . . . c19595_2mgo 1 . 20 . 2576 . 1 1 2 TYR HH H 8.296 -8.329 -1.497 . . . 1.0 . . . . . . . . . . . . A . 2 TYR HH . . . . . . . . . c19595_2mgo 1 . 20 . 2577 . 1 1 2 TYR N N 4.910 -0.989 0.217 . . . 1.0 . . . . . . . . . . . . A . 2 TYR N . . . . . . . . . c19595_2mgo 1 . 20 . 2578 . 1 1 2 TYR O O 3.800 -3.828 -1.475 . . . 1.0 . . . . . . . . . . . . A . 2 TYR O . . . . . . . . . c19595_2mgo 1 . 20 . 2579 . 1 1 2 TYR OH O 7.348 -8.261 -1.315 . . . 1.0 . . . . . . . . . . . . A . 2 TYR OH . . . . . . . . . c19595_2mgo 1 . 20 . 2580 . 1 1 3 ILE C C 0.756 -2.493 0.031 . . . 1.0 . . . . . . . . . . . . A . 3 ILE C . . . . . . . . . c19595_2mgo 1 . 20 . 2581 . 1 1 3 ILE CA C 1.794 -3.543 0.308 . . . 1.0 . . . . . . . . . . . . A . 3 ILE CA . . . . . . . . . c19595_2mgo 1 . 20 . 2582 . 1 1 3 ILE CB C 1.448 -4.350 1.585 . . . 1.0 . . . . . . . . . . . . A . 3 ILE CB . . . . . . . . . c19595_2mgo 1 . 20 . 2583 . 1 1 3 ILE CD1 C 1.130 -4.224 4.126 . . . 1.0 . . . . . . . . . . . . A . 3 ILE CD1 . . . . . . . . . c19595_2mgo 1 . 20 . 2584 . 1 1 3 ILE CG1 C 1.525 -3.488 2.856 . . . 1.0 . . . . . . . . . . . . A . 3 ILE CG1 . . . . . . . . . c19595_2mgo 1 . 20 . 2585 . 1 1 3 ILE CG2 C 2.351 -5.573 1.702 . . . 1.0 . . . . . . . . . . . . A . 3 ILE CG2 . . . . . . . . . c19595_2mgo 1 . 20 . 2586 . 1 1 3 ILE H H 3.237 -2.293 1.088 . . . 1.0 . . . . . . . . . . . . A . 3 ILE H . . . . . . . . . c19595_2mgo 1 . 20 . 2587 . 1 1 3 ILE HA H 1.822 -4.220 -0.534 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HA . . . . . . . . . c19595_2mgo 1 . 20 . 2588 . 1 1 3 ILE HB H 0.434 -4.689 1.452 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HB . . . . . . . . . c19595_2mgo 1 . 20 . 2589 . 1 1 3 ILE HD11 H 1.767 -5.088 4.246 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HD11 . . . . . . . . . c19595_2mgo 1 . 20 . 2590 . 1 1 3 ILE HD12 H 0.102 -4.546 4.052 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HD12 . . . . . . . . . c19595_2mgo 1 . 20 . 2591 . 1 1 3 ILE HD13 H 1.250 -3.571 4.977 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HD13 . . . . . . . . . c19595_2mgo 1 . 20 . 2592 . 1 1 3 ILE HG12 H 2.545 -3.158 2.983 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HG12 . . . . . . . . . c19595_2mgo 1 . 20 . 2593 . 1 1 3 ILE HG13 H 0.879 -2.629 2.747 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HG13 . . . . . . . . . c19595_2mgo 1 . 20 . 2594 . 1 1 3 ILE HG21 H 3.379 -5.247 1.767 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HG21 . . . . . . . . . c19595_2mgo 1 . 20 . 2595 . 1 1 3 ILE HG22 H 2.228 -6.200 0.831 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HG22 . . . . . . . . . c19595_2mgo 1 . 20 . 2596 . 1 1 3 ILE HG23 H 2.093 -6.129 2.591 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HG23 . . . . . . . . . c19595_2mgo 1 . 20 . 2597 . 1 1 3 ILE N N 3.045 -2.928 0.377 . . . 1.0 . . . . . . . . . . . . A . 3 ILE N . . . . . . . . . c19595_2mgo 1 . 20 . 2598 . 1 1 3 ILE O O 0.858 -1.363 0.505 . . . 1.0 . . . . . . . . . . . . A . 3 ILE O . . . . . . . . . c19595_2mgo 1 . 20 . 2599 . 1 1 4 GLN C C -2.375 -1.825 -0.080 . . . 1.0 . . . . . . . . . . . . A . 4 GLN C . . . . . . . . . c19595_2mgo 1 . 20 . 2600 . 1 1 4 GLN CA C -1.296 -1.960 -1.146 . . . 1.0 . . . . . . . . . . . . A . 4 GLN CA . . . . . . . . . c19595_2mgo 1 . 20 . 2601 . 1 1 4 GLN CB C -1.885 -2.390 -2.497 . . . 1.0 . . . . . . . . . . . . A . 4 GLN CB . . . . . . . . . c19595_2mgo 1 . 20 . 2602 . 1 1 4 GLN CD C -2.938 -4.204 -3.887 . . . 1.0 . . . . . . . . . . . . A . 4 GLN CD . . . . . . . . . c19595_2mgo 1 . 20 . 2603 . 1 1 4 GLN CG C -2.379 -3.824 -2.541 . . . 1.0 . . . . . . . . . . . . A . 4 GLN CG . . . . . . . . . c19595_2mgo 1 . 20 . 2604 . 1 1 4 GLN H H -0.205 -3.807 -0.995 . . . 1.0 . . . . . . . . . . . . A . 4 GLN H . . . . . . . . . c19595_2mgo 1 . 20 . 2605 . 1 1 4 GLN HA H -0.841 -0.989 -1.259 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HA . . . . . . . . . c19595_2mgo 1 . 20 . 2606 . 1 1 4 GLN HB2 H -2.719 -1.744 -2.733 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HB2 . . . . . . . . . c19595_2mgo 1 . 20 . 2607 . 1 1 4 GLN HB3 H -1.128 -2.271 -3.259 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HB3 . . . . . . . . . c19595_2mgo 1 . 20 . 2608 . 1 1 4 GLN HE21 H -4.749 -3.688 -3.307 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HE21 . . . . . . . . . c19595_2mgo 1 . 20 . 2609 . 1 1 4 GLN HE22 H -4.637 -4.273 -4.909 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HE22 . . . . . . . . . c19595_2mgo 1 . 20 . 2610 . 1 1 4 GLN HG2 H -1.548 -4.478 -2.330 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HG2 . . . . . . . . . c19595_2mgo 1 . 20 . 2611 . 1 1 4 GLN HG3 H -3.147 -3.955 -1.792 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HG3 . . . . . . . . . c19595_2mgo 1 . 20 . 2612 . 1 1 4 GLN N N -0.223 -2.866 -0.722 . . . 1.0 . . . . . . . . . . . . A . 4 GLN N . . . . . . . . . c19595_2mgo 1 . 20 . 2613 . 1 1 4 GLN NE2 N -4.219 -4.041 -4.052 . . . 1.0 . . . . . . . . . . . . A . 4 GLN NE2 . . . . . . . . . c19595_2mgo 1 . 20 . 2614 . 1 1 4 GLN O O -3.394 -1.174 -0.278 . . . 1.0 . . . . . . . . . . . . A . 4 GLN O . . . . . . . . . c19595_2mgo 1 . 20 . 2615 . 1 1 4 GLN OE1 O -2.212 -4.664 -4.768 . . . 1.0 . . . . . . . . . . . . A . 4 GLN OE1 . . . . . . . . . c19595_2mgo 1 . 20 . 2616 . 1 1 5 ASN C C -2.423 -1.249 3.141 . . . 1.0 . . . . . . . . . . . . A . 5 ASN C . . . . . . . . . c19595_2mgo 1 . 20 . 2617 . 1 1 5 ASN CA C -3.003 -2.323 2.205 . . . 1.0 . . . . . . . . . . . . A . 5 ASN CA . . . . . . . . . c19595_2mgo 1 . 20 . 2618 . 1 1 5 ASN CB C -3.056 -3.695 2.911 . . . 1.0 . . . . . . . . . . . . A . 5 ASN CB . . . . . . . . . c19595_2mgo 1 . 20 . 2619 . 1 1 5 ASN CG C -4.275 -3.885 3.821 . . . 1.0 . . . . . . . . . . . . A . 5 ASN CG . . . . . . . . . c19595_2mgo 1 . 20 . 2620 . 1 1 5 ASN H H -1.268 -2.897 1.125 . . . 1.0 . . . . . . . . . . . . A . 5 ASN H . . . . . . . . . c19595_2mgo 1 . 20 . 2621 . 1 1 5 ASN HA H -3.986 -2.030 1.866 . . . 1.0 . . . . . . . . . . . . A . 5 ASN HA . . . . . . . . . c19595_2mgo 1 . 20 . 2622 . 1 1 5 ASN HB2 H -3.076 -4.473 2.162 . . . 1.0 . . . . . . . . . . . . A . 5 ASN HB2 . . . . . . . . . c19595_2mgo 1 . 20 . 2623 . 1 1 5 ASN HB3 H -2.163 -3.810 3.508 . . . 1.0 . . . . . . . . . . . . A . 5 ASN HB3 . . . . . . . . . c19595_2mgo 1 . 20 . 2624 . 1 1 5 ASN HD21 H -4.188 -5.845 3.556 . . . 1.0 . . . . . . . . . . . . A . 5 ASN HD21 . . . . . . . . . c19595_2mgo 1 . 20 . 2625 . 1 1 5 ASN HD22 H -5.453 -5.285 4.571 . . . 1.0 . . . . . . . . . . . . A . 5 ASN HD22 . . . . . . . . . c19595_2mgo 1 . 20 . 2626 . 1 1 5 ASN N N -2.110 -2.404 1.059 . . . 1.0 . . . . . . . . . . . . A . 5 ASN N . . . . . . . . . c19595_2mgo 1 . 20 . 2627 . 1 1 5 ASN ND2 N -4.674 -5.118 3.999 . . . 1.0 . . . . . . . . . . . . A . 5 ASN ND2 . . . . . . . . . c19595_2mgo 1 . 20 . 2628 . 1 1 5 ASN O O -2.681 -1.206 4.341 . . . 1.0 . . . . . . . . . . . . A . 5 ASN O . . . . . . . . . c19595_2mgo 1 . 20 . 2629 . 1 1 5 ASN OD1 O -4.840 -2.939 4.360 . . . 1.0 . . . . . . . . . . . . A . 5 ASN OD1 . . . . . . . . . c19595_2mgo 1 . 20 . 2630 . 1 1 6 CYS C C -1.915 1.903 3.234 . . . 1.0 . . . . . . . . . . . . A . 6 CYS C . . . . . . . . . c19595_2mgo 1 . 20 . 2631 . 1 1 6 CYS CA C -0.976 0.697 3.250 . . . 1.0 . . . . . . . . . . . . A . 6 CYS CA . . . . . . . . . c19595_2mgo 1 . 20 . 2632 . 1 1 6 CYS CB C 0.336 1.014 2.530 . . . 1.0 . . . . . . . . . . . . A . 6 CYS CB . . . . . . . . . c19595_2mgo 1 . 20 . 2633 . 1 1 6 CYS H H -1.468 -0.485 1.597 . . . 1.0 . . . . . . . . . . . . A . 6 CYS H . . . . . . . . . c19595_2mgo 1 . 20 . 2634 . 1 1 6 CYS HA H -0.765 0.393 4.263 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HA . . . . . . . . . c19595_2mgo 1 . 20 . 2635 . 1 1 6 CYS HB2 H 0.970 0.141 2.576 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HB2 . . . . . . . . . c19595_2mgo 1 . 20 . 2636 . 1 1 6 CYS HB3 H 0.125 1.225 1.495 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HB3 . . . . . . . . . c19595_2mgo 1 . 20 . 2637 . 1 1 6 CYS N N -1.620 -0.392 2.561 . . . 1.0 . . . . . . . . . . . . A . 6 CYS N . . . . . . . . . c19595_2mgo 1 . 20 . 2638 . 1 1 6 CYS O O -2.365 2.321 2.161 . . . 1.0 . . . . . . . . . . . . A . 6 CYS O . . . . . . . . . c19595_2mgo 1 . 20 . 2639 . 1 1 6 CYS SG S 1.310 2.399 3.192 . . . 1.0 . . . . . . . . . . . . A . 6 CYS SG . . . . . . . . . c19595_2mgo 1 . 20 . 2640 . 1 1 7 PRO C C -2.604 4.850 3.919 . . . 1.0 . . . . . . . . . . . . A . 7 PRO C . . . . . . . . . c19595_2mgo 1 . 20 . 2641 . 1 1 7 PRO CA C -3.201 3.569 4.488 . . . 1.0 . . . . . . . . . . . . A . 7 PRO CA . . . . . . . . . c19595_2mgo 1 . 20 . 2642 . 1 1 7 PRO CB C -3.479 3.745 5.985 . . . 1.0 . . . . . . . . . . . . A . 7 PRO CB . . . . . . . . . c19595_2mgo 1 . 20 . 2643 . 1 1 7 PRO CD C -1.844 1.997 5.740 . . . 1.0 . . . . . . . . . . . . A . 7 PRO CD . . . . . . . . . c19595_2mgo 1 . 20 . 2644 . 1 1 7 PRO CG C -2.892 2.553 6.658 . . . 1.0 . . . . . . . . . . . . A . 7 PRO CG . . . . . . . . . c19595_2mgo 1 . 20 . 2645 . 1 1 7 PRO HA H -4.123 3.346 3.973 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HA . . . . . . . . . c19595_2mgo 1 . 20 . 2646 . 1 1 7 PRO HB2 H -3.006 4.655 6.323 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HB2 . . . . . . . . . c19595_2mgo 1 . 20 . 2647 . 1 1 7 PRO HB3 H -4.545 3.808 6.151 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HB3 . . . . . . . . . c19595_2mgo 1 . 20 . 2648 . 1 1 7 PRO HD2 H -0.872 2.398 5.982 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HD2 . . . . . . . . . c19595_2mgo 1 . 20 . 2649 . 1 1 7 PRO HD3 H -1.843 0.920 5.809 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HD3 . . . . . . . . . c19595_2mgo 1 . 20 . 2650 . 1 1 7 PRO HG2 H -2.440 2.856 7.591 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HG2 . . . . . . . . . c19595_2mgo 1 . 20 . 2651 . 1 1 7 PRO HG3 H -3.664 1.820 6.841 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HG3 . . . . . . . . . c19595_2mgo 1 . 20 . 2652 . 1 1 7 PRO N N -2.283 2.441 4.407 . . . 1.0 . . . . . . . . . . . . A . 7 PRO N . . . . . . . . . c19595_2mgo 1 . 20 . 2653 . 1 1 7 PRO O O -1.750 5.479 4.538 . . . 1.0 . . . . . . . . . . . . A . 7 PRO O . . . . . . . . . c19595_2mgo 1 . 20 . 2654 . 1 1 8 LEU C C -3.684 7.420 2.061 . . . 1.0 . . . . . . . . . . . . A . 8 LEU C . . . . . . . . . c19595_2mgo 1 . 20 . 2655 . 1 1 8 LEU CA C -2.549 6.431 2.101 . . . 1.0 . . . . . . . . . . . . A . 8 LEU CA . . . . . . . . . c19595_2mgo 1 . 20 . 2656 . 1 1 8 LEU CB C -2.002 6.189 0.706 . . . 1.0 . . . . . . . . . . . . A . 8 LEU CB . . . . . . . . . c19595_2mgo 1 . 20 . 2657 . 1 1 8 LEU CD1 C -0.346 5.130 -0.849 . . . 1.0 . . . . . . . . . . . . A . 8 LEU CD1 . . . . . . . . . c19595_2mgo 1 . 20 . 2658 . 1 1 8 LEU CD2 C 0.412 5.968 1.376 . . . 1.0 . . . . . . . . . . . . A . 8 LEU CD2 . . . . . . . . . c19595_2mgo 1 . 20 . 2659 . 1 1 8 LEU CG C -0.736 5.331 0.604 . . . 1.0 . . . . . . . . . . . . A . 8 LEU CG . . . . . . . . . c19595_2mgo 1 . 20 . 2660 . 1 1 8 LEU H H -3.577 4.582 2.210 . . . 1.0 . . . . . . . . . . . . A . 8 LEU H . . . . . . . . . c19595_2mgo 1 . 20 . 2661 . 1 1 8 LEU HA H -1.781 6.840 2.732 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HA . . . . . . . . . c19595_2mgo 1 . 20 . 2662 . 1 1 8 LEU HB2 H -2.781 5.719 0.125 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HB2 . . . . . . . . . c19595_2mgo 1 . 20 . 2663 . 1 1 8 LEU HB3 H -1.810 7.164 0.291 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HB3 . . . . . . . . . c19595_2mgo 1 . 20 . 2664 . 1 1 8 LEU HD11 H -1.148 4.630 -1.372 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HD11 . . . . . . . . . c19595_2mgo 1 . 20 . 2665 . 1 1 8 LEU HD12 H 0.548 4.526 -0.900 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HD12 . . . . . . . . . c19595_2mgo 1 . 20 . 2666 . 1 1 8 LEU HD13 H -0.161 6.090 -1.305 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HD13 . . . . . . . . . c19595_2mgo 1 . 20 . 2667 . 1 1 8 LEU HD21 H 0.162 6.030 2.424 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HD21 . . . . . . . . . c19595_2mgo 1 . 20 . 2668 . 1 1 8 LEU HD22 H 0.601 6.957 0.988 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HD22 . . . . . . . . . c19595_2mgo 1 . 20 . 2669 . 1 1 8 LEU HD23 H 1.299 5.362 1.256 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HD23 . . . . . . . . . c19595_2mgo 1 . 20 . 2670 . 1 1 8 LEU HG H -0.935 4.360 1.031 . . . 1.0 . . . . . . . . . . . . A . 8 LEU HG . . . . . . . . . c19595_2mgo 1 . 20 . 2671 . 1 1 8 LEU N N -2.997 5.191 2.720 . . . 1.0 . . . . . . . . . . . . A . 8 LEU N . . . . . . . . . c19595_2mgo 1 . 20 . 2672 . 1 1 8 LEU O O -3.563 8.548 1.580 . . . 1.0 . . . . . . . . . . . . A . 8 LEU O . . . . . . . . . c19595_2mgo 1 . 20 . 2673 . 1 1 9 GLY C C -7.117 6.961 2.191 . . . 1.0 . . . . . . . . . . . . A . 9 GLY C . . . . . . . . . c19595_2mgo 1 . 20 . 2674 . 1 1 9 GLY CA C -5.950 7.759 2.668 . . . 1.0 . . . . . . . . . . . . A . 9 GLY CA . . . . . . . . . c19595_2mgo 1 . 20 . 2675 . 1 1 9 GLY H H -4.696 6.066 2.902 . . . 1.0 . . . . . . . . . . . . A . 9 GLY H . . . . . . . . . c19595_2mgo 1 . 20 . 2676 . 1 1 9 GLY HA2 H -6.108 8.050 3.696 . . . 1.0 . . . . . . . . . . . . A . 9 GLY HA2 . . . . . . . . . c19595_2mgo 1 . 20 . 2677 . 1 1 9 GLY HA3 H -5.853 8.641 2.053 . . . 1.0 . . . . . . . . . . . . A . 9 GLY HA3 . . . . . . . . . c19595_2mgo 1 . 20 . 2678 . 1 1 9 GLY N N -4.755 6.986 2.578 . . . 1.0 . . . . . . . . . . . . A . 9 GLY N . . . . . . . . . c19595_2mgo 1 . 20 . 2679 . 1 1 9 GLY O O -7.502 7.073 1.024 . . . 1.0 . . . . . . . . . . . . A . 9 GLY O . . . . . . . . . c19595_2mgo 1 . 20 . 2680 . 1 1 9 GLY OXT O -7.622 6.127 2.955 . . . 1.0 . . . . . . . . . . . . A . 9 GLY OXT . . . . . . . . . c19595_2mgo 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 c19595_2mgo _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 2mgo.mr . . 'MR format' 1 comment 'Not applicable' 'Not applicable' 0 c19595_2mgo 1 1 2mgo.mr . . XPLOR/CNS 2 distance NOE simple 49 c19595_2mgo 1 1 2mgo.mr . . XPLOR/CNS 3 'dihedral angle' 'Not applicable' 'Not applicable' 8 c19595_2mgo 1 1 2mgo.mr . . 'MR format' 4 'nomenclature mapping' 'Not applicable' 'Not applicable' 0 c19595_2mgo 1 stop_ save_ save_CNS/XPLOR_distance_constraints_2 _Gen_dist_constraint_list.Sf_category general_distance_constraints _Gen_dist_constraint_list.Sf_framecode CNS/XPLOR_distance_constraints_2 _Gen_dist_constraint_list.Entry_ID c19595_2mgo _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 2 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 . . . . c19595_2mgo 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 TYR H H . . . 1 1 2 2 TYR HB2 H . . . . . 2.735 1.8 3.67 . . . . . A . 2 TYR H . . A . 2 TYR HB2 . . . 2 . HN . . . . . 2 . HB2 . . c19595_2mgo 1 2 1 . . 1 1 2 2 TYR H H . . . 1 1 2 2 TYR HB3 H . . . . . 2.735 1.8 3.67 . . . . . A . 2 TYR H . . A . 2 TYR HB3 . . . 2 . HN . . . . . 2 . HB1 . . c19595_2mgo 1 3 1 . . 1 1 3 3 ILE H H . . . 1 1 3 3 ILE HB H . . . . . 2.705 1.8 3.61 . . . . . A . 3 ILE H . . A . 3 ILE HB . . . 3 . HN . . . . . 3 . HB . . c19595_2mgo 1 4 1 . . 1 1 2 2 TYR H H . . . 1 1 1 1 CYS HA H . . . . . 2.300 1.8 2.80 . . . . . A . 2 TYR H . . A . 1 CYS HA . . . 2 . HN . . . . . 1 . HA . . c19595_2mgo 1 5 1 . . 1 1 2 2 TYR H H . . . 1 1 1 1 CYS HB2 H . . . . . 2.935 1.8 4.07 . . . . . A . 2 TYR H . . A . 1 CYS HB2 . . . 2 . HN . . . . . 1 . HB2 . . c19595_2mgo 1 6 1 . . 1 1 2 2 TYR H H . . . 1 1 1 1 CYS HB3 H . . . . . 2.935 1.8 4.07 . . . . . A . 2 TYR H . . A . 1 CYS HB3 . . . 2 . HN . . . . . 1 . HB1 . . c19595_2mgo 1 7 1 . . 1 1 3 3 ILE H H . . . 1 1 2 2 TYR HA H . . . . . 2.455 1.8 3.11 . . . . . A . 3 ILE H . . A . 2 TYR HA . . . 3 . HN . . . . . 2 . HA . . c19595_2mgo 1 8 1 . . 1 1 3 3 ILE HA H . . . 1 1 4 4 GLN H H . . . . . 2.425 1.8 3.05 . . . . . A . 3 ILE HA . . A . 4 GLN H . . . 3 . HA . . . . . 4 . HN . . c19595_2mgo 1 9 1 . . 1 1 3 3 ILE HB H . . . 1 1 4 4 GLN H H . . . . . 2.380 1.8 2.96 . . . . . A . 3 ILE HB . . A . 4 GLN H . . . 3 . HB . . . . . 4 . HN . . c19595_2mgo 1 10 1 . . 1 1 4 4 GLN HA H . . . 1 1 5 5 ASN H H . . . . . 2.425 1.8 3.05 . . . . . A . 4 GLN HA . . A . 5 ASN H . . . 4 . HA . . . . . 5 . HN . . c19595_2mgo 1 11 1 OR . 1 1 5 5 ASN H H . . . 1 1 4 4 GLN HB2 H . . . . . 3.470 1.8 5.14 . . . . . A . 5 ASN H . . A . 4 GLN HB2 . . . 5 . HN . . . . . 4 . HB# . . c19595_2mgo 1 11 2 OR . 1 1 5 5 ASN H H . . . 1 1 4 4 GLN HB3 H . . . . . 3.470 1.8 5.14 . . . . . A . 5 ASN H . . A . 4 GLN HB3 . . . 5 . HN . . . . . 4 . HB# . . c19595_2mgo 1 12 1 OR . 1 1 6 6 CYS H H . . . 1 1 5 5 ASN HB2 H . . . . . 3.860 1.8 5.92 . . . . . A . 6 CYS H . . A . 5 ASN HB2 . . . 6 . HN . . . . . 5 . HB# . . c19595_2mgo 1 12 2 OR . 1 1 5 5 ASN HB3 H . . . 1 1 6 6 CYS H H . . . . . 3.860 1.8 5.92 . . . . . A . 5 ASN HB3 . . A . 6 CYS H . . . 5 . HB# . . . . . 6 . HN . . c19595_2mgo 1 13 1 . . 1 1 6 6 CYS H H . . . 1 1 5 5 ASN HA H . . . . . 2.395 1.8 2.99 . . . . . A . 6 CYS H . . A . 5 ASN HA . . . 6 . HN . . . . . 5 . HA . . c19595_2mgo 1 14 1 . . 1 1 7 7 PRO HA H . . . 1 1 8 8 LEU H H . . . . . 2.225 1.8 2.65 . . . . . A . 7 PRO HA . . A . 8 LEU H . . . 7 . HA . . . . . 8 . HN . . c19595_2mgo 1 15 1 . . 1 1 8 8 LEU HA H . . . 1 1 9 9 GLY H H . . . . . 2.365 1.8 2.93 . . . . . A . 8 LEU HA . . A . 9 GLY H . . . 8 . HA . . . . . 9 . HN . . c19595_2mgo 1 16 1 . . 1 1 9 9 GLY H H . . . 1 1 8 8 LEU HB2 H . . . . . 2.875 1.8 3.95 . . . . . A . 9 GLY H . . A . 8 LEU HB2 . . . 9 . HN . . . . . 8 . HB2 . . c19595_2mgo 1 17 1 . . 1 1 2 2 TYR H H . . . 1 1 3 3 ILE H H . . . . . 2.815 1.8 3.83 . . . . . A . 2 TYR H . . A . 3 ILE H . . . 2 . HN . . . . . 3 . HN . . c19595_2mgo 1 18 1 . . 1 1 3 3 ILE H H . . . 1 1 4 4 GLN H H . . . . . 2.985 1.8 4.17 . . . . . A . 3 ILE H . . A . 4 GLN H . . . 3 . HN . . . . . 4 . HN . . c19595_2mgo 1 19 1 . . 1 1 4 4 GLN H H . . . 1 1 5 5 ASN H H . . . . . 2.335 1.8 2.87 . . . . . A . 4 GLN H . . A . 5 ASN H . . . 4 . HN . . . . . 5 . HN . . c19595_2mgo 1 20 1 . . 1 1 5 5 ASN H H . . . 1 1 6 6 CYS H H . . . . . 2.315 1.8 2.83 . . . . . A . 5 ASN H . . A . 6 CYS H . . . 5 . HN . . . . . 6 . HN . . c19595_2mgo 1 21 1 . . 1 1 8 8 LEU H H . . . 1 1 9 9 GLY H H . . . . . 2.395 1.8 2.99 . . . . . A . 8 LEU H . . A . 9 GLY H . . . 8 . HN . . . . . 9 . HN . . c19595_2mgo 1 22 1 . . 1 1 9 9 GLY H H . . . 1 1 8 8 LEU HB3 H . . . . . 2.875 1.8 3.95 . . . . . A . 9 GLY H . . A . 8 LEU HB3 . . . 9 . HN . . . . . 8 . HB1 . . c19595_2mgo 1 23 1 OR . 1 1 4 4 GLN H H . . . 1 1 4 4 GLN HG2 H . . . . . 3.905 1.8 6.01 . . . . . A . 4 GLN H . . A . 4 GLN HG2 . . . 4 . HN . . . . . 4 . HG# . . c19595_2mgo 1 23 2 OR . 1 1 4 4 GLN H H . . . 1 1 4 4 GLN HG3 H . . . . . 3.905 1.8 6.01 . . . . . A . 4 GLN H . . A . 4 GLN HG3 . . . 4 . HN . . . . . 4 . HG# . . c19595_2mgo 1 24 1 . . 1 1 3 3 ILE H H . . . 1 1 3 3 ILE HG12 H . . . . . 3.590 1.8 5.38 . . . . . A . 3 ILE H . . A . 3 ILE HG12 . . . 3 . HN . . . . . 3 . HG12 . . c19595_2mgo 1 25 1 . . 1 1 3 3 ILE H H . . . 1 1 3 3 ILE HG13 H . . . . . 3.590 1.8 5.38 . . . . . A . 3 ILE H . . A . 3 ILE HG13 . . . 3 . HN . . . . . 3 . HG11 . . c19595_2mgo 1 26 1 OR . 1 1 5 5 ASN H H . . . 1 1 4 4 GLN HG2 H . . . . . 4.090 1.8 6.38 . . . . . A . 5 ASN H . . A . 4 GLN HG2 . . . 5 . HN . . . . . 4 . HG# . . c19595_2mgo 1 26 2 OR . 1 1 5 5 ASN H H . . . 1 1 4 4 GLN HG3 H . . . . . 4.090 1.8 6.38 . . . . . A . 5 ASN H . . A . 4 GLN HG3 . . . 5 . HN . . . . . 4 . HG# . . c19595_2mgo 1 27 1 . . 1 1 2 2 TYR HA H . . . 1 1 2 2 TYR QD H . . . . . 3.985 1.8 6.17 . . . . . A . 2 TYR HA . . A . 2 TYR QD . . . 2 . HA . . . . . 2 . HD# . . c19595_2mgo 1 28 1 OR . 1 1 2 2 TYR QE H . . . 1 1 4 4 GLN HB2 H . . . . . 5.155 1.8 8.51 . . . . . A . 2 TYR QE . . A . 4 GLN HB2 . . . 2 . HE# . . . . . 4 . HB# . . c19595_2mgo 1 28 2 OR . 1 1 4 4 GLN HB3 H . . . 1 1 2 2 TYR QE H . . . . . 5.155 1.8 8.51 . . . . . A . 4 GLN HB3 . . A . 2 TYR QE . . . 4 . HB# . . . . . 2 . HE# . . c19595_2mgo 1 29 1 . . 1 1 2 2 TYR H H . . . 1 1 2 2 TYR QD H . . . . . 4.715 1.8 7.63 . . . . . A . 2 TYR H . . A . 2 TYR QD . . . 2 . HN . . . . . 2 . HD# . . c19595_2mgo 1 30 1 . . 1 1 6 6 CYS HA H . . . 1 1 7 7 PRO HD2 H . . . . . 2.550 1.8 3.30 . . . . . A . 6 CYS HA . . A . 7 PRO HD2 . . . 6 . HA . . . . . 7 . HD2 . . c19595_2mgo 1 31 1 . . 1 1 6 6 CYS HA H . . . 1 1 7 7 PRO HD3 H . . . . . 2.550 1.8 3.30 . . . . . A . 6 CYS HA . . A . 7 PRO HD3 . . . 6 . HA . . . . . 7 . HD1 . . c19595_2mgo 1 32 1 . . 1 1 3 3 ILE H H . . . 1 1 3 3 ILE MG H . . . . . 4.035 1.8 6.27 . . . . . A . 3 ILE H . . A . 3 ILE MG . . . 3 . HN . . . . . 3 . HG2# . . c19595_2mgo 1 33 1 . . 1 1 4 4 GLN H H . . . 1 1 3 3 ILE MG H . . . . . 3.665 1.8 5.53 . . . . . A . 4 GLN H . . A . 3 ILE MG . . . 4 . HN . . . . . 3 . HG2# . . c19595_2mgo 1 34 1 . . 1 1 6 6 CYS HA H . . . 1 1 1 1 CYS HB2 H . . . . . 3.450 1.8 5.10 . . . . . A . 6 CYS HA . . A . 1 CYS HB2 . . . 6 . HA . . . . . 1 . HB2 . . c19595_2mgo 1 35 1 . . 1 1 6 6 CYS HA H . . . 1 1 1 1 CYS HB3 H . . . . . 3.450 1.8 5.10 . . . . . A . 6 CYS HA . . A . 1 CYS HB3 . . . 6 . HA . . . . . 1 . HB1 . . c19595_2mgo 1 36 1 . . 1 1 8 8 LEU HA H . . . 1 1 8 8 LEU MD1 H . . . . . 3.695 1.8 5.59 . . . . . A . 8 LEU HA . . A . 8 LEU MD1 . . . 8 . HA . . . . . 8 . HD1# . . c19595_2mgo 1 37 1 . . 1 1 8 8 LEU HA H . . . 1 1 8 8 LEU MD2 H . . . . . 3.695 1.8 5.59 . . . . . A . 8 LEU HA . . A . 8 LEU MD2 . . . 8 . HA . . . . . 8 . HD2# . . c19595_2mgo 1 38 1 . . 1 1 3 3 ILE HA H . . . 1 1 3 3 ILE MD H . . . . . 3.635 1.8 5.47 . . . . . A . 3 ILE HA . . A . 3 ILE MD . . . 3 . HA . . . . . 3 . HD1# . . c19595_2mgo 1 39 1 OR . 1 1 2 2 TYR H H . . . 1 1 1 1 CYS HB3 H . . . . . 2.570 1.8 3.34 . . . . . A . 2 TYR H . . A . 1 CYS HB3 . . . 2 . HN . . . . . 1 . HB# . . c19595_2mgo 1 39 2 OR . 1 1 2 2 TYR H H . . . 1 1 1 1 CYS HB2 H . . . . . 2.570 1.8 3.34 . . . . . A . 2 TYR H . . A . 1 CYS HB2 . . . 2 . HN . . . . . 1 . HB# . . c19595_2mgo 1 40 1 OR . 1 1 6 6 CYS HA H . . . 1 1 1 1 CYS HB3 H . . . . . 3.030 1.8 4.26 . . . . . A . 6 CYS HA . . A . 1 CYS HB3 . . . 6 . HA . . . . . 1 . HB# . . c19595_2mgo 1 40 2 OR . 1 1 6 6 CYS HA H . . . 1 1 1 1 CYS HB2 H . . . . . 3.030 1.8 4.26 . . . . . A . 6 CYS HA . . A . 1 CYS HB2 . . . 6 . HA . . . . . 1 . HB# . . c19595_2mgo 1 41 1 OR . 1 1 2 2 TYR H H . . . 1 1 2 2 TYR HB3 H . . . . . 2.475 1.8 3.15 . . . . . A . 2 TYR H . . A . 2 TYR HB3 . . . 2 . HN . . . . . 2 . HB# . . c19595_2mgo 1 41 2 OR . 1 1 2 2 TYR H H . . . 1 1 2 2 TYR HB2 H . . . . . 2.475 1.8 3.15 . . . . . A . 2 TYR H . . A . 2 TYR HB2 . . . 2 . HN . . . . . 2 . HB# . . c19595_2mgo 1 42 1 OR . 1 1 3 3 ILE H H . . . 1 1 2 2 TYR HB3 H . . . . . 2.960 1.8 4.12 . . . . . A . 3 ILE H . . A . 2 TYR HB3 . . . 3 . HN . . . . . 2 . HB# . . c19595_2mgo 1 42 2 OR . 1 1 3 3 ILE H H . . . 1 1 2 2 TYR HB2 H . . . . . 2.960 1.8 4.12 . . . . . A . 3 ILE H . . A . 2 TYR HB2 . . . 3 . HN . . . . . 2 . HB# . . c19595_2mgo 1 43 1 OR . 1 1 3 3 ILE H H . . . 1 1 3 3 ILE HG13 H . . . . . 3.235 1.8 4.67 . . . . . A . 3 ILE H . . A . 3 ILE HG13 . . . 3 . HN . . . . . 3 . HG1# . . c19595_2mgo 1 43 2 OR . 1 1 3 3 ILE H H . . . 1 1 3 3 ILE HG12 H . . . . . 3.235 1.8 4.67 . . . . . A . 3 ILE H . . A . 3 ILE HG12 . . . 3 . HN . . . . . 3 . HG1# . . c19595_2mgo 1 44 1 OR . 1 1 4 4 GLN H H . . . 1 1 3 3 ILE HG13 H . . . . . 3.570 1.8 5.34 . . . . . A . 4 GLN H . . A . 3 ILE HG13 . . . 4 . HN . . . . . 3 . HG1# . . c19595_2mgo 1 44 2 OR . 1 1 4 4 GLN H H . . . 1 1 3 3 ILE HG12 H . . . . . 3.570 1.8 5.34 . . . . . A . 4 GLN H . . A . 3 ILE HG12 . . . 4 . HN . . . . . 3 . HG1# . . c19595_2mgo 1 45 1 OR . 1 1 5 5 ASN H H . . . 1 1 3 3 ILE HG13 H . . . . . 3.570 1.8 5.34 . . . . . A . 5 ASN H . . A . 3 ILE HG13 . . . 5 . HN . . . . . 3 . HG1# . . c19595_2mgo 1 45 2 OR . 1 1 5 5 ASN H H . . . 1 1 3 3 ILE HG12 H . . . . . 3.570 1.8 5.34 . . . . . A . 5 ASN H . . A . 3 ILE HG12 . . . 5 . HN . . . . . 3 . HG1# . . c19595_2mgo 1 46 1 OR . 1 1 6 6 CYS H H . . . 1 1 6 6 CYS HB2 H . . . . . 2.420 1.8 3.04 . . . . . A . 6 CYS H . . A . 6 CYS HB2 . . . 6 . HN . . . . . 6 . HB# . . c19595_2mgo 1 46 2 OR . 1 1 6 6 CYS H H . . . 1 1 6 6 CYS HB3 H . . . . . 2.420 1.8 3.04 . . . . . A . 6 CYS H . . A . 6 CYS HB3 . . . 6 . HN . . . . . 6 . HB# . . c19595_2mgo 1 47 1 OR . 1 1 6 6 CYS HB3 H . . . 1 1 7 7 PRO HD2 H . . . . . 2.990 1.8 4.18 . . . . . A . 6 CYS HB3 . . A . 7 PRO HD2 . . . 6 . HB# . . . . . 7 . HD# . . c19595_2mgo 1 47 2 OR . 1 1 6 6 CYS HB2 H . . . 1 1 7 7 PRO HD2 H . . . . . 2.990 1.8 4.18 . . . . . A . 6 CYS HB2 . . A . 7 PRO HD2 . . . 6 . HB# . . . . . 7 . HD# . . c19595_2mgo 1 47 3 OR . 1 1 7 7 PRO HD3 H . . . 1 1 6 6 CYS HB2 H . . . . . 2.990 1.8 4.18 . . . . . A . 7 PRO HD3 . . A . 6 CYS HB2 . . . 7 . HD# . . . . . 6 . HB# . . c19595_2mgo 1 47 4 OR . 1 1 6 6 CYS HB3 H . . . 1 1 7 7 PRO HD3 H . . . . . 2.990 1.8 4.18 . . . . . A . 6 CYS HB3 . . A . 7 PRO HD3 . . . 6 . HB# . . . . . 7 . HD# . . c19595_2mgo 1 48 1 OR . 1 1 8 8 LEU H H . . . 1 1 8 8 LEU HB2 H . . . . . 2.380 1.8 2.96 . . . . . A . 8 LEU H . . A . 8 LEU HB2 . . . 8 . HN . . . . . 8 . HB# . . c19595_2mgo 1 48 2 OR . 1 1 8 8 LEU H H . . . 1 1 8 8 LEU HB3 H . . . . . 2.380 1.8 2.96 . . . . . A . 8 LEU H . . A . 8 LEU HB3 . . . 8 . HN . . . . . 8 . HB# . . c19595_2mgo 1 49 1 OR . 1 1 8 8 LEU HA H . . . 1 1 8 8 LEU MD2 H . . . . . 2.925 1.8 4.05 . . . . . A . 8 LEU HA . . A . 8 LEU MD2 . . . 8 . HA . . . . . 8 . HD# . . c19595_2mgo 1 49 2 OR . 1 1 8 8 LEU HA H . . . 1 1 8 8 LEU MD1 H . . . . . 2.925 1.8 4.05 . . . . . A . 8 LEU HA . . A . 8 LEU MD1 . . . 8 . HA . . . . . 8 . HD# . . c19595_2mgo 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 'distance restraints' 1 1 1 21 c19595_2mgo 1 stop_ save_ save_CNS/XPLOR_dihedral_3 _Torsion_angle_constraint_list.Sf_category torsion_angle_constraints _Torsion_angle_constraint_list.Sf_framecode CNS/XPLOR_dihedral_3 _Torsion_angle_constraint_list.Entry_ID c19595_2mgo _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 3 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 . . . . c19595_2mgo 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 CYS C C . . 1 1 2 2 TYR N N . . 1 1 2 2 TYR CA C . . 1 1 2 2 TYR C C . -180.0 -20.0 . . . A . 1 CYS C . . A . 2 TYR N . . A . 2 TYR CA . . A . 2 TYR C . . . 1 . C . . . . . 2 . N . . . . . 2 . CA . . . . . 2 . C . . c19595_2mgo 1 2 . . 1 1 2 2 TYR C C . . 1 1 3 3 ILE N N . . 1 1 3 3 ILE CA C . . 1 1 3 3 ILE C C . -180.0 -20.0 . . . A . 2 TYR C . . A . 3 ILE N . . A . 3 ILE CA . . A . 3 ILE C . . . 2 . C . . . . . 3 . N . . . . . 3 . CA . . . . . 3 . C . . c19595_2mgo 1 3 . . 1 1 3 3 ILE C C . . 1 1 4 4 GLN N N . . 1 1 4 4 GLN CA C . . 1 1 4 4 GLN C C . -180.0 -20.0 . . . A . 3 ILE C . . A . 4 GLN N . . A . 4 GLN CA . . A . 4 GLN C . . . 3 . C . . . . . 4 . N . . . . . 4 . CA . . . . . 4 . C . . c19595_2mgo 1 4 . . 1 1 4 4 GLN C C . . 1 1 5 5 ASN N N . . 1 1 5 5 ASN CA C . . 1 1 5 5 ASN C C . -180.0 -20.0 . . . A . 4 GLN C . . A . 5 ASN N . . A . 5 ASN CA . . A . 5 ASN C . . . 4 . C . . . . . 5 . N . . . . . 5 . CA . . . . . 5 . C . . c19595_2mgo 1 5 . . 1 1 5 5 ASN C C . . 1 1 6 6 CYS N N . . 1 1 6 6 CYS CA C . . 1 1 6 6 CYS C C . -180.0 -20.0 . . . A . 5 ASN C . . A . 6 CYS N . . A . 6 CYS CA . . A . 6 CYS C . . . 5 . C . . . . . 6 . N . . . . . 6 . CA . . . . . 6 . C . . c19595_2mgo 1 6 . . 1 1 6 6 CYS N N . . 1 1 6 6 CYS CA C . . 1 1 6 6 CYS C C . . 1 1 7 7 PRO N N . 60.0 180.0 . . . A . 6 CYS N . . A . 6 CYS CA . . A . 6 CYS C . . A . 7 PRO N . . . 6 . N . . . . . 6 . CA . . . . . 6 . C . . . . . 7 . N . . c19595_2mgo 1 7 . . 1 1 7 7 PRO C C . . 1 1 8 8 LEU N N . . 1 1 8 8 LEU CA C . . 1 1 8 8 LEU C C . -180.0 -20.0 . . . A . 7 PRO C . . A . 8 LEU N . . A . 8 LEU CA . . A . 8 LEU C . . . 7 . C . . . . . 8 . N . . . . . 8 . CA . . . . . 8 . C . . c19595_2mgo 1 8 . . 1 1 6 6 CYS N N . . 1 1 6 6 CYS CA C . . 1 1 6 6 CYS CB C . . 1 1 6 6 CYS SG S . -210.0 -30.0 . . . A . 6 CYS N . . A . 6 CYS CA . . A . 6 CYS CB . . A . 6 CYS SG . . . 6 . N . . . . . 6 . CA . . . . . 6 . CB . . . . . 6 . SG . . c19595_2mgo 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 'dihedral restraints' 1 1 1 22 c19595_2mgo 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 c19595_2mgo _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 HORMONE 01-NOV-13 2MGO *TITLE NMR SOLUTION STRUCTURE OF OXYTOCIN *COMPND MOL_ID: 1; *COMPND 2 MOLECULE: OXYTOCIN; *COMPND 3 CHAIN: A; *COMPND 4 ENGINEERED: YES *SOURCE MOL_ID: 1; *SOURCE 2 SYNTHETIC: YES; *SOURCE 3 OTHER_DETAILS: THE PEPTIDE WAS CHEMICALLY SYNTHESIZED. *KEYWDS HORMONE *EXPDTA SOLUTION NMR *NUMMDL 20 *AUTHOR P.J.HARVEY, D.J.CRAIK *REVDAT 1 22-OCT-14 2MGO 0' save_