data_c25520_2n0c ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID c25520_2n0c _Entry.Title ; NMR structure of Neuromedin C in 10% TFE ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2015-03-05 _Entry.Accession_date 2015-03-05 _Entry.Last_release_date 2015-10-19 _Entry.Original_release_date 2015-10-19 _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.81 _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype SOLUTION _Entry.Details 'This entry describes the solution structure of Neuromedin C in presence of 10% TFE' _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 Miquel Adrover . . . c25520_2n0c 2 Pilar Sanchis . . . c25520_2n0c 3 Bartolome Vilanova . . . c25520_2n0c 4 Kris Pauwels . . . c25520_2n0c 5 Gabriel Martorell . . . c25520_2n0c 6 'Juan Jesus' Perez . . . c25520_2n0c 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' . c25520_2n0c stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID 'Feeding regulation' . c25520_2n0c 'Growth and differentiation of human tumors' . c25520_2n0c Neuropeptide . c25520_2n0c stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 c25520_2n0c stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 34 c25520_2n0c '15N chemical shifts' 12 c25520_2n0c '1H chemical shifts' 69 c25520_2n0c 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 . . 2015-10-19 . original BMRB . c25520_2n0c stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID BMRB 25519 'Neuromedin C in aqueous solution' c25520_2n0c BMRB 25521 'Neuromedin C in 25% TFE' c25520_2n0c BMRB 25522 'Neuromedin C in 40% TFE' c25520_2n0c BMRB 25523 'Neuromedin C in 60% TFE' c25520_2n0c BMRB 25524 'Neuromedin C in 90% TFE' c25520_2n0c BMRB 25525 'Neuromedin C in presence of SDS micelles' c25520_2n0c PDB 1C98 'SOLUTION STRUCTURE OF NEUROMEDIN B' c25520_2n0c PDB 1C9A 'SOLUTION STRUCTURE OF NEUROMEDIN B' c25520_2n0c PDB 2N0C 'BMRB Entry Tracking System' c25520_2n0c stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID c25520_2n0c _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID . _Citation.Full_citation . _Citation.Title ; Conformational ensembles of neuromedin C reveal a progressive coil-helix transition within a binding-induced folding mechanism ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'RSC ADV' _Citation.Journal_name_full . _Citation.Journal_volume 5 _Citation.Journal_issue . _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first 83074 _Citation.Page_last 83088 _Citation.Year 2015 _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 Miquel Adrover . . . c25520_2n0c 1 2 Pilar Sanchis . . . c25520_2n0c 1 3 Bartolome Vilanova . . . c25520_2n0c 1 4 Kris Pauwels . . . c25520_2n0c 1 5 Gabriel Martorell . . . c25520_2n0c 1 6 'Juan Jesus' Perez . . . c25520_2n0c 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID c25520_2n0c _Assembly.ID 1 _Assembly.Name 'Neuromedin C in 10% TFE' _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 'Neuromedin C' 1 $Neuromedin_C A . yes native no no . . . c25520_2n0c 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_Neuromedin_C _Entity.Sf_category entity _Entity.Sf_framecode Neuromedin_C _Entity.Entry_ID c25520_2n0c _Entity.ID 1 _Entity.BMRB_code . _Entity.Name Neuromedin_C _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 ; GNHWAVGHLMX ; _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 11 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method man _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 1123.295 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_biological_function.Biological_function _Entity_biological_function.Entry_ID _Entity_biological_function.Entity_ID 'Elicits gastrin release and regulates gastric acid secretion and enteric motor function.' c25520_2n0c 1 'Mediates on neurotransmission and neuromodulation.' c25520_2n0c 1 'Plays a central role in regulation of the neuroendocrine and autonomic systems' c25520_2n0c 1 'Regulate growth and/or differentiation of different human tumors.' c25520_2n0c 1 stop_ loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 1 GLY . c25520_2n0c 1 2 2 ASN . c25520_2n0c 1 3 3 HIS . c25520_2n0c 1 4 4 TRP . c25520_2n0c 1 5 5 ALA . c25520_2n0c 1 6 6 VAL . c25520_2n0c 1 7 7 GLY . c25520_2n0c 1 8 8 HIS . c25520_2n0c 1 9 9 LEU . c25520_2n0c 1 10 10 MET . c25520_2n0c 1 11 11 NH2 . c25520_2n0c 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 . GLY 1 1 c25520_2n0c 1 . ASN 2 2 c25520_2n0c 1 . HIS 3 3 c25520_2n0c 1 . TRP 4 4 c25520_2n0c 1 . ALA 5 5 c25520_2n0c 1 . VAL 6 6 c25520_2n0c 1 . GLY 7 7 c25520_2n0c 1 . HIS 8 8 c25520_2n0c 1 . LEU 9 9 c25520_2n0c 1 . MET 10 10 c25520_2n0c 1 . NH2 11 11 c25520_2n0c 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 c25520_2n0c _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.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.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Details _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $Neuromedin_C . 9606 organism . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . c25520_2n0c 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 c25520_2n0c _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_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.Details _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $Neuromedin_C . 'obtained from a vendor' . . . . . . . . . . . . . . . 'Neuromedin C was purchased from Holzel Diagnostika Handels GmbH' c25520_2n0c 1 stop_ save_ ################################# # Polymer residues and ligands # ################################# save_chem_comp_NH2 _Chem_comp.Sf_category chem_comp _Chem_comp.Sf_framecode chem_comp_NH2 _Chem_comp.Entry_ID c25520_2n0c _Chem_comp.ID NH2 _Chem_comp.Provenance PDB _Chem_comp.Name 'AMINO GROUP' _Chem_comp.Type NON-POLYMER _Chem_comp.BMRB_code NH2 _Chem_comp.PDB_code NH2 _Chem_comp.Ambiguous_flag yes _Chem_comp.Initial_date 2012-11-20 _Chem_comp.Modified_date 2012-11-20 _Chem_comp.Release_status REL _Chem_comp.Replaced_by . _Chem_comp.Replaces . _Chem_comp.One_letter_code . _Chem_comp.Three_letter_code NH2 _Chem_comp.Number_atoms_all 3 _Chem_comp.Number_atoms_nh 1 _Chem_comp.PubChem_code . _Chem_comp.Subcomponent_list . _Chem_comp.InCHi_code InChI=1/H3N/h1H3 _Chem_comp.Mon_nstd_flag . _Chem_comp.Mon_nstd_class . _Chem_comp.Mon_nstd_details . _Chem_comp.Mon_nstd_parent . _Chem_comp.Mon_nstd_parent_comp_ID . _Chem_comp.Std_deriv_one_letter_code . _Chem_comp.Std_deriv_three_letter_code . _Chem_comp.Std_deriv_BMRB_code . _Chem_comp.Std_deriv_PDB_code . _Chem_comp.Std_deriv_chem_comp_name . _Chem_comp.Synonyms . _Chem_comp.Formal_charge 0 _Chem_comp.Paramagnetic . _Chem_comp.Aromatic no _Chem_comp.Formula 'H2 N' _Chem_comp.Formula_weight 16.023 _Chem_comp.Formula_mono_iso_wt_nat . _Chem_comp.Formula_mono_iso_wt_13C . _Chem_comp.Formula_mono_iso_wt_15N . _Chem_comp.Formula_mono_iso_wt_13C_15N . _Chem_comp.Image_file_name . _Chem_comp.Image_file_format . _Chem_comp.Topo_file_name . _Chem_comp.Topo_file_format . _Chem_comp.Struct_file_name . _Chem_comp.Struct_file_format . _Chem_comp.Stereochem_param_file_name . _Chem_comp.Stereochem_param_file_format . _Chem_comp.Model_details . _Chem_comp.Model_erf . _Chem_comp.Model_source . _Chem_comp.Model_coordinates_details . _Chem_comp.Model_coordinates_missing_flag no _Chem_comp.Ideal_coordinates_details 'OpenEye OEToolkits' _Chem_comp.Ideal_coordinates_missing_flag no _Chem_comp.Model_coordinates_db_code 2FLY _Chem_comp.Processing_site RCSB _Chem_comp.Vendor . _Chem_comp.Vendor_product_code . _Chem_comp.Details . _Chem_comp.DB_query_date . _Chem_comp.DB_last_query_revised_last_date . loop_ _Chem_comp_descriptor.Descriptor _Chem_comp_descriptor.Type _Chem_comp_descriptor.Program _Chem_comp_descriptor.Program_version _Chem_comp_descriptor.Entry_ID _Chem_comp_descriptor.Comp_ID InChI=1/H3N/h1H3 InChI InChI 1.02b c25520_2n0c NH2 N SMILES ACDLabs 10.04 c25520_2n0c NH2 QGZKDVFQNNGYKY-UHFFFAOYAF InChIKey InChI 1.02b c25520_2n0c NH2 [NH2] SMILES CACTVS 3.341 c25520_2n0c NH2 [NH2] SMILES 'OpenEye OEToolkits' 1.5.0 c25520_2n0c NH2 [NH2] SMILES_CANONICAL CACTVS 3.341 c25520_2n0c NH2 [NH2] SMILES_CANONICAL 'OpenEye OEToolkits' 1.5.0 c25520_2n0c NH2 stop_ loop_ _Chem_comp_identifier.Identifier _Chem_comp_identifier.Type _Chem_comp_identifier.Program _Chem_comp_identifier.Program_version _Chem_comp_identifier.Entry_ID _Chem_comp_identifier.Comp_ID ammonia 'SYSTEMATIC NAME' ACDLabs 10.04 c25520_2n0c NH2 l^{2}-azane 'SYSTEMATIC NAME' 'OpenEye OEToolkits' 1.5.0 c25520_2n0c NH2 stop_ loop_ _Chem_comp_atom.Atom_ID _Chem_comp_atom.BMRB_code _Chem_comp_atom.PDB_atom_ID _Chem_comp_atom.Alt_atom_ID _Chem_comp_atom.Auth_atom_ID _Chem_comp_atom.Type_symbol _Chem_comp_atom.Isotope_number _Chem_comp_atom.Chirality _Chem_comp_atom.Stereo_config _Chem_comp_atom.Charge _Chem_comp_atom.Partial_charge _Chem_comp_atom.Oxidation_number _Chem_comp_atom.Unpaired_electron_number _Chem_comp_atom.Align _Chem_comp_atom.Aromatic_flag _Chem_comp_atom.Leaving_atom_flag _Chem_comp_atom.Substruct_code _Chem_comp_atom.Ionizable _Chem_comp_atom.Drawing_2D_coord_x _Chem_comp_atom.Drawing_2D_coord_y _Chem_comp_atom.Model_Cartn_x _Chem_comp_atom.Model_Cartn_x_esd _Chem_comp_atom.Model_Cartn_y _Chem_comp_atom.Model_Cartn_y_esd _Chem_comp_atom.Model_Cartn_z _Chem_comp_atom.Model_Cartn_z_esd _Chem_comp_atom.Model_Cartn_x_ideal _Chem_comp_atom.Model_Cartn_y_ideal _Chem_comp_atom.Model_Cartn_z_ideal _Chem_comp_atom.PDBX_ordinal _Chem_comp_atom.Details _Chem_comp_atom.Entry_ID _Chem_comp_atom.Comp_ID N N N N . N . . N 0 . . . 1 no no . . . . 10.091 . 8.978 . -7.810 . 0.000 0.000 0.000 1 . c25520_2n0c NH2 HN1 HN1 HN1 1HN . H . . N 0 . . . 1 no no . . . . 9.517 . 8.769 . -7.044 . -0.385 -0.545 -0.771 2 . c25520_2n0c NH2 HN2 HN2 HN2 2HN . H . . N 0 . . . 1 no no . . . . 10.323 . 9.890 . -8.082 . 1.020 0.000 0.000 3 . c25520_2n0c NH2 stop_ loop_ _Chem_comp_bond.ID _Chem_comp_bond.Type _Chem_comp_bond.Value_order _Chem_comp_bond.Atom_ID_1 _Chem_comp_bond.Atom_ID_2 _Chem_comp_bond.Aromatic_flag _Chem_comp_bond.Stereo_config _Chem_comp_bond.Ordinal _Chem_comp_bond.Details _Chem_comp_bond.Entry_ID _Chem_comp_bond.Comp_ID 1 . SING N HN1 no N 1 . c25520_2n0c NH2 2 . SING N HN2 no N 2 . c25520_2n0c NH2 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID c25520_2n0c _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details 'The sample was prepared in 10mM acetate buffer at pH 4.0 in presence of 10% TFE' _Sample.Aggregate_sample_number . _Sample.Solvent_system trifluoroethanol/water _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 'Neuromedin C' 'natural abundance' . . 1 $Neuromedin_C . . 5.0 . . mM 0.1 . . . c25520_2n0c 1 2 'sodium acetate' 'natural abundance' . . . . . . 10 . . mM 0.1 . . . c25520_2n0c 1 3 DSS 'natural abundance' . . . . . . 1.6 . . mM 0.1 . . . c25520_2n0c 1 4 TFE '[U-99% 2H]' . . . . . . 10 . . % 0.5 . . . c25520_2n0c 1 5 D2O '[U-100% 2H]' . . . . . . 10 . . % 1 . . . c25520_2n0c 1 6 H2O 'natural abundance' . . . . . . 80 . . % . . . . c25520_2n0c 1 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID c25520_2n0c _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' 0.01 . M c25520_2n0c 1 pH 4.0 . pH c25520_2n0c 1 pressure 1 . atm c25520_2n0c 1 temperature 273 . K c25520_2n0c 1 stop_ save_ ############################ # Computer software used # ############################ save_NMRPipe _Software.Sf_category software _Software.Sf_framecode NMRPipe _Software.Entry_ID c25520_2n0c _Software.ID 1 _Software.Name NMRPipe _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . c25520_2n0c 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing c25520_2n0c 1 stop_ save_ save_XEASY _Software.Sf_category software _Software.Sf_framecode XEASY _Software.Entry_ID c25520_2n0c _Software.ID 2 _Software.Name XEASY _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bartels et al.' . . c25520_2n0c 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' c25520_2n0c 2 'peak picking' c25520_2n0c 2 stop_ save_ save_CYANA _Software.Sf_category software _Software.Sf_framecode CYANA _Software.Entry_ID c25520_2n0c _Software.ID 3 _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' . . c25520_2n0c 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'geometry optimization' c25520_2n0c 3 refinement c25520_2n0c 3 'structure solution' c25520_2n0c 3 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 c25520_2n0c _NMR_spectrometer.ID 1 _NMR_spectrometer.Details 'Bruker Avance III spectrometer operating at 14.1T (600MHz) and equipped with a 5-mm 13C, 15N, 1H triple resonance cryoprobe.' _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 c25520_2n0c _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 'Bruker Avance III spectrometer operating at 14.1T (600MHz) and equipped with a 5-mm 13C, 15N, 1H triple resonance cryoprobe.' . . c25520_2n0c 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 c25520_2n0c _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 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . c25520_2n0c 1 2 '2D 1H-1H NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . c25520_2n0c 1 3 '2D 1H-15N HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . c25520_2n0c 1 4 '2D 1H-13C HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . c25520_2n0c 1 5 '2D 1H-13C HSQC aromatic' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . c25520_2n0c 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_reference_1 _Chem_shift_reference.Entry_ID c25520_2n0c _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 carbons' . . . . ppm 0 internal direct 1.0 . . . . . . . . . c25520_2n0c 1 H 1 DSS protons . . . . ppm 0 internal direct 1.0 . . . . . . . . . c25520_2n0c 1 N 15 water protons . . . . ppm 0 internal indirect 0.101329118 . . . . . . . . . c25520_2n0c 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 c25520_2n0c _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' . . . c25520_2n0c 1 3 '2D 1H-15N HSQC' . . . c25520_2n0c 1 4 '2D 1H-13C HSQC' . . . c25520_2n0c 1 5 '2D 1H-13C HSQC aromatic' . . . c25520_2n0c 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 2 $XEASY . . c25520_2n0c 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 GLY HA2 H 1 3.808 0.010 . 2 . . . A 1 GLY HA2 . c25520_2n0c 1 2 . 1 1 1 1 GLY HA3 H 1 3.808 0.010 . 2 . . . A 1 GLY HA3 . c25520_2n0c 1 3 . 1 1 1 1 GLY CA C 13 43.357 0.100 . 1 . . . A 1 GLY CA . c25520_2n0c 1 4 . 1 1 2 2 ASN H H 1 8.660 0.010 . 1 . . . A 2 ASN H . c25520_2n0c 1 5 . 1 1 2 2 ASN HA H 1 4.638 0.010 . 1 . . . A 2 ASN HA . c25520_2n0c 1 6 . 1 1 2 2 ASN HB2 H 1 2.546 0.010 . 2 . . . A 2 ASN HB2 . c25520_2n0c 1 7 . 1 1 2 2 ASN HB3 H 1 2.546 0.010 . 2 . . . A 2 ASN HB3 . c25520_2n0c 1 8 . 1 1 2 2 ASN HD21 H 1 6.906 0.010 . 2 . . . A 2 ASN HD21 . c25520_2n0c 1 9 . 1 1 2 2 ASN HD22 H 1 7.536 0.013 . 2 . . . A 2 ASN HD22 . c25520_2n0c 1 10 . 1 1 2 2 ASN CA C 13 53.289 0.100 . 1 . . . A 2 ASN CA . c25520_2n0c 1 11 . 1 1 2 2 ASN CB C 13 38.910 0.100 . 1 . . . A 2 ASN CB . c25520_2n0c 1 12 . 1 1 2 2 ASN N N 15 118.479 0.100 . 1 . . . A 2 ASN N . c25520_2n0c 1 13 . 1 1 2 2 ASN ND2 N 15 113.171 0.100 . 1 . . . A 2 ASN ND2 . c25520_2n0c 1 14 . 1 1 3 3 HIS H H 1 8.574 0.010 . 1 . . . A 3 HIS H . c25520_2n0c 1 15 . 1 1 3 3 HIS HA H 1 4.608 0.010 . 1 . . . A 3 HIS HA . c25520_2n0c 1 16 . 1 1 3 3 HIS HB2 H 1 3.061 0.010 . 2 . . . A 3 HIS HB2 . c25520_2n0c 1 17 . 1 1 3 3 HIS HB3 H 1 3.127 0.010 . 2 . . . A 3 HIS HB3 . c25520_2n0c 1 18 . 1 1 3 3 HIS HD2 H 1 7.095 0.011 . 1 . . . A 3 HIS HD2 . c25520_2n0c 1 19 . 1 1 3 3 HIS HE1 H 1 8.466 0.010 . 1 . . . A 3 HIS HE1 . c25520_2n0c 1 20 . 1 1 3 3 HIS CA C 13 55.510 0.100 . 1 . . . A 3 HIS CA . c25520_2n0c 1 21 . 1 1 3 3 HIS CB C 13 28.993 0.100 . 1 . . . A 3 HIS CB . c25520_2n0c 1 22 . 1 1 3 3 HIS CD2 C 13 120.143 0.100 . 1 . . . A 3 HIS CD2 . c25520_2n0c 1 23 . 1 1 3 3 HIS CE1 C 13 136.446 0.100 . 1 . . . A 3 HIS CE1 . c25520_2n0c 1 24 . 1 1 3 3 HIS N N 15 119.562 0.100 . 1 . . . A 3 HIS N . c25520_2n0c 1 25 . 1 1 4 4 TRP H H 1 8.151 0.011 . 1 . . . A 4 TRP H . c25520_2n0c 1 26 . 1 1 4 4 TRP HA H 1 4.667 0.010 . 1 . . . A 4 TRP HA . c25520_2n0c 1 27 . 1 1 4 4 TRP HB2 H 1 3.183 0.010 . 1 . . . A 4 TRP HB2 . c25520_2n0c 1 28 . 1 1 4 4 TRP HB3 H 1 3.270 0.010 . 1 . . . A 4 TRP HB3 . c25520_2n0c 1 29 . 1 1 4 4 TRP HD1 H 1 7.217 0.010 . 1 . . . A 4 TRP HD1 . c25520_2n0c 1 30 . 1 1 4 4 TRP HE1 H 1 10.135 0.010 . 1 . . . A 4 TRP HE1 . c25520_2n0c 1 31 . 1 1 4 4 TRP HE3 H 1 7.569 0.011 . 1 . . . A 4 TRP HE3 . c25520_2n0c 1 32 . 1 1 4 4 TRP HZ2 H 1 7.469 0.010 . 1 . . . A 4 TRP HZ2 . c25520_2n0c 1 33 . 1 1 4 4 TRP HZ3 H 1 7.136 0.010 . 1 . . . A 4 TRP HZ3 . c25520_2n0c 1 34 . 1 1 4 4 TRP HH2 H 1 7.228 0.010 . 1 . . . A 4 TRP HH2 . c25520_2n0c 1 35 . 1 1 4 4 TRP CA C 13 57.294 0.100 . 1 . . . A 4 TRP CA . c25520_2n0c 1 36 . 1 1 4 4 TRP CB C 13 29.991 0.100 . 1 . . . A 4 TRP CB . c25520_2n0c 1 37 . 1 1 4 4 TRP CD1 C 13 127.390 0.100 . 1 . . . A 4 TRP CD1 . c25520_2n0c 1 38 . 1 1 4 4 TRP CE3 C 13 120.954 0.100 . 1 . . . A 4 TRP CE3 . c25520_2n0c 1 39 . 1 1 4 4 TRP CZ2 C 13 114.695 0.100 . 1 . . . A 4 TRP CZ2 . c25520_2n0c 1 40 . 1 1 4 4 TRP CZ3 C 13 122.145 0.100 . 1 . . . A 4 TRP CZ3 . c25520_2n0c 1 41 . 1 1 4 4 TRP CH2 C 13 124.780 0.100 . 1 . . . A 4 TRP CH2 . c25520_2n0c 1 42 . 1 1 4 4 TRP N N 15 122.216 0.100 . 1 . . . A 4 TRP N . c25520_2n0c 1 43 . 1 1 4 4 TRP NE1 N 15 129.298 0.100 . 1 . . . A 4 TRP NE1 . c25520_2n0c 1 44 . 1 1 5 5 ALA H H 1 8.227 0.010 . 1 . . . A 5 ALA H . c25520_2n0c 1 45 . 1 1 5 5 ALA HA H 1 4.318 0.010 . 1 . . . A 5 ALA HA . c25520_2n0c 1 46 . 1 1 5 5 ALA HB1 H 1 1.325 0.010 . 1 . . . A 5 ALA HB1 . c25520_2n0c 1 47 . 1 1 5 5 ALA HB2 H 1 1.325 0.010 . 1 . . . A 5 ALA HB2 . c25520_2n0c 1 48 . 1 1 5 5 ALA HB3 H 1 1.325 0.010 . 1 . . . A 5 ALA HB3 . c25520_2n0c 1 49 . 1 1 5 5 ALA CA C 13 52.482 0.100 . 1 . . . A 5 ALA CA . c25520_2n0c 1 50 . 1 1 5 5 ALA CB C 13 19.435 0.100 . 1 . . . A 5 ALA CB . c25520_2n0c 1 51 . 1 1 5 5 ALA N N 15 125.699 0.100 . 1 . . . A 5 ALA N . c25520_2n0c 1 52 . 1 1 6 6 VAL H H 1 8.062 0.010 . 1 . . . A 6 VAL H . c25520_2n0c 1 53 . 1 1 6 6 VAL HA H 1 3.999 0.010 . 1 . . . A 6 VAL HA . c25520_2n0c 1 54 . 1 1 6 6 VAL HB H 1 2.059 0.010 . 1 . . . A 6 VAL HB . c25520_2n0c 1 55 . 1 1 6 6 VAL HG11 H 1 0.980 0.010 . 2 . . . A 6 VAL HG11 . c25520_2n0c 1 56 . 1 1 6 6 VAL HG12 H 1 0.980 0.010 . 2 . . . A 6 VAL HG12 . c25520_2n0c 1 57 . 1 1 6 6 VAL HG13 H 1 0.980 0.010 . 2 . . . A 6 VAL HG13 . c25520_2n0c 1 58 . 1 1 6 6 VAL HG21 H 1 0.940 0.010 . 2 . . . A 6 VAL HG21 . c25520_2n0c 1 59 . 1 1 6 6 VAL HG22 H 1 0.940 0.010 . 2 . . . A 6 VAL HG22 . c25520_2n0c 1 60 . 1 1 6 6 VAL HG23 H 1 0.940 0.010 . 2 . . . A 6 VAL HG23 . c25520_2n0c 1 61 . 1 1 6 6 VAL CA C 13 62.981 0.100 . 1 . . . A 6 VAL CA . c25520_2n0c 1 62 . 1 1 6 6 VAL CB C 13 32.674 0.100 . 1 . . . A 6 VAL CB . c25520_2n0c 1 63 . 1 1 6 6 VAL CG1 C 13 20.770 0.100 . 1 . . . A 6 VAL CG1 . c25520_2n0c 1 64 . 1 1 6 6 VAL CG2 C 13 21.114 0.100 . 1 . . . A 6 VAL CG2 . c25520_2n0c 1 65 . 1 1 6 6 VAL N N 15 119.498 0.100 . 1 . . . A 6 VAL N . c25520_2n0c 1 66 . 1 1 7 7 GLY H H 1 8.486 0.010 . 1 . . . A 7 GLY H . c25520_2n0c 1 67 . 1 1 7 7 GLY HA2 H 1 3.902 0.010 . 2 . . . A 7 GLY HA2 . c25520_2n0c 1 68 . 1 1 7 7 GLY HA3 H 1 3.902 0.010 . 2 . . . A 7 GLY HA3 . c25520_2n0c 1 69 . 1 1 7 7 GLY CA C 13 45.167 0.100 . 1 . . . A 7 GLY CA . c25520_2n0c 1 70 . 1 1 7 7 GLY N N 15 112.204 0.100 . 1 . . . A 7 GLY N . c25520_2n0c 1 71 . 1 1 8 8 HIS H H 1 8.277 0.010 . 1 . . . A 8 HIS H . c25520_2n0c 1 72 . 1 1 8 8 HIS HA H 1 4.636 0.010 . 1 . . . A 8 HIS HA . c25520_2n0c 1 73 . 1 1 8 8 HIS HB2 H 1 3.233 0.010 . 1 . . . A 8 HIS HB2 . c25520_2n0c 1 74 . 1 1 8 8 HIS HB3 H 1 3.104 0.010 . 1 . . . A 8 HIS HB3 . c25520_2n0c 1 75 . 1 1 8 8 HIS HD2 H 1 7.173 0.010 . 1 . . . A 8 HIS HD2 . c25520_2n0c 1 76 . 1 1 8 8 HIS HE1 H 1 8.478 0.010 . 1 . . . A 8 HIS HE1 . c25520_2n0c 1 77 . 1 1 8 8 HIS CA C 13 55.510 0.100 . 1 . . . A 8 HIS CA . c25520_2n0c 1 78 . 1 1 8 8 HIS CB C 13 29.004 0.100 . 1 . . . A 8 HIS CB . c25520_2n0c 1 79 . 1 1 8 8 HIS CD2 C 13 120.168 0.100 . 1 . . . A 8 HIS CD2 . c25520_2n0c 1 80 . 1 1 8 8 HIS CE1 C 13 136.444 0.100 . 1 . . . A 8 HIS CE1 . c25520_2n0c 1 81 . 1 1 8 8 HIS N N 15 118.178 0.100 . 1 . . . A 8 HIS N . c25520_2n0c 1 82 . 1 1 9 9 LEU H H 1 8.359 0.010 . 1 . . . A 9 LEU H . c25520_2n0c 1 83 . 1 1 9 9 LEU HA H 1 4.304 0.010 . 1 . . . A 9 LEU HA . c25520_2n0c 1 84 . 1 1 9 9 LEU HB2 H 1 1.555 0.010 . 1 . . . A 9 LEU HB2 . c25520_2n0c 1 85 . 1 1 9 9 LEU HB3 H 1 1.626 0.010 . 1 . . . A 9 LEU HB3 . c25520_2n0c 1 86 . 1 1 9 9 LEU HG H 1 1.569 0.010 . 1 . . . A 9 LEU HG . c25520_2n0c 1 87 . 1 1 9 9 LEU HD11 H 1 0.903 0.010 . 2 . . . A 9 LEU HD11 . c25520_2n0c 1 88 . 1 1 9 9 LEU HD12 H 1 0.903 0.010 . 2 . . . A 9 LEU HD12 . c25520_2n0c 1 89 . 1 1 9 9 LEU HD13 H 1 0.903 0.010 . 2 . . . A 9 LEU HD13 . c25520_2n0c 1 90 . 1 1 9 9 LEU HD21 H 1 0.850 0.010 . 2 . . . A 9 LEU HD21 . c25520_2n0c 1 91 . 1 1 9 9 LEU HD22 H 1 0.850 0.010 . 2 . . . A 9 LEU HD22 . c25520_2n0c 1 92 . 1 1 9 9 LEU HD23 H 1 0.850 0.010 . 2 . . . A 9 LEU HD23 . c25520_2n0c 1 93 . 1 1 9 9 LEU CA C 13 55.544 0.100 . 1 . . . A 9 LEU CA . c25520_2n0c 1 94 . 1 1 9 9 LEU CB C 13 42.220 0.100 . 1 . . . A 9 LEU CB . c25520_2n0c 1 95 . 1 1 9 9 LEU CG C 13 26.821 0.100 . 1 . . . A 9 LEU CG . c25520_2n0c 1 96 . 1 1 9 9 LEU CD1 C 13 24.896 0.100 . 1 . . . A 9 LEU CD1 . c25520_2n0c 1 97 . 1 1 9 9 LEU CD2 C 13 23.465 0.100 . 1 . . . A 9 LEU CD2 . c25520_2n0c 1 98 . 1 1 9 9 LEU N N 15 121.616 0.100 . 1 . . . A 9 LEU N . c25520_2n0c 1 99 . 1 1 10 10 MET H H 1 8.359 0.011 . 1 . . . A 10 MET H . c25520_2n0c 1 100 . 1 1 10 10 MET HA H 1 4.428 0.010 . 1 . . . A 10 MET HA . c25520_2n0c 1 101 . 1 1 10 10 MET HB2 H 1 2.088 0.010 . 1 . . . A 10 MET HB2 . c25520_2n0c 1 102 . 1 1 10 10 MET HB3 H 1 1.984 0.010 . 1 . . . A 10 MET HB3 . c25520_2n0c 1 103 . 1 1 10 10 MET HG2 H 1 2.587 0.010 . 1 . . . A 10 MET HG2 . c25520_2n0c 1 104 . 1 1 10 10 MET HG3 H 1 2.502 0.010 . 1 . . . A 10 MET HG3 . c25520_2n0c 1 105 . 1 1 10 10 MET HE1 H 1 2.085 0.010 . 1 . . . A 10 MET HE1 . c25520_2n0c 1 106 . 1 1 10 10 MET HE2 H 1 2.085 0.010 . 1 . . . A 10 MET HE2 . c25520_2n0c 1 107 . 1 1 10 10 MET HE3 H 1 2.085 0.010 . 1 . . . A 10 MET HE3 . c25520_2n0c 1 108 . 1 1 10 10 MET CA C 13 55.207 0.100 . 1 . . . A 10 MET CA . c25520_2n0c 1 109 . 1 1 10 10 MET CB C 13 32.872 0.100 . 1 . . . A 10 MET CB . c25520_2n0c 1 110 . 1 1 10 10 MET CG C 13 32.047 0.100 . 1 . . . A 10 MET CG . c25520_2n0c 1 111 . 1 1 10 10 MET CE C 13 16.738 0.100 . 1 . . . A 10 MET CE . c25520_2n0c 1 112 . 1 1 10 10 MET N N 15 123.702 0.100 . 1 . . . A 10 MET N . c25520_2n0c 1 113 . 1 1 11 11 NH2 HN1 H 1 7.525 0.010 . 1 . . . . 11 NH2 HN1 . c25520_2n0c 1 114 . 1 1 11 11 NH2 HN2 H 1 7.121 0.010 . 1 . . . . 11 NH2 HN2 . c25520_2n0c 1 115 . 1 1 11 11 NH2 N N 15 108.064 0.100 . 1 . . . . 11 NH2 N . c25520_2n0c 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 c25520_2n0c _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 17 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 c25520_2n0c _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 . . . c25520_2n0c 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 . . . . c25520_2n0c 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 GLY C C -8.128 5.588 2.211 . . . 1.0 . . . . . . . . . . . . A . 1 GLY C . . . . . . . . . c25520_2n0c 1 . 1 . 2 . 1 1 1 GLY CA C -9.051 5.601 3.414 . . . 1.0 . . . . . . . . . . . . A . 1 GLY CA . . . . . . . . . c25520_2n0c 1 . 1 . 3 . 1 1 1 GLY H1 H -10.425 4.099 3.188 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H1 . . . . . . . . . c25520_2n0c 1 . 1 . 4 . 1 1 1 GLY H2 H -9.776 4.230 4.753 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H2 . . . . . . . . . c25520_2n0c 1 . 1 . 5 . 1 1 1 GLY H3 H -8.847 3.566 3.495 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H3 . . . . . . . . . c25520_2n0c 1 . 1 . 6 . 1 1 1 GLY HA2 H -9.892 6.262 3.206 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA2 . . . . . . . . . c25520_2n0c 1 . 1 . 7 . 1 1 1 GLY HA3 H -8.503 5.986 4.274 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA3 . . . . . . . . . c25520_2n0c 1 . 1 . 8 . 1 1 1 GLY N N -9.561 4.281 3.736 . . . 1.0 . . . . . . . . . . . . A . 1 GLY N . . . . . . . . . c25520_2n0c 1 . 1 . 9 . 1 1 1 GLY O O -8.535 5.215 1.113 . . . 1.0 . . . . . . . . . . . . A . 1 GLY O . . . . . . . . . c25520_2n0c 1 . 1 . 10 . 1 1 2 ASN C C -5.111 4.729 1.281 . . . 1.0 . . . . . . . . . . . . A . 2 ASN C . . . . . . . . . c25520_2n0c 1 . 1 . 11 . 1 1 2 ASN CA C -5.899 6.035 1.344 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CA . . . . . . . . . c25520_2n0c 1 . 1 . 12 . 1 1 2 ASN CB C -4.940 7.213 1.539 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CB . . . . . . . . . c25520_2n0c 1 . 1 . 13 . 1 1 2 ASN CG C -5.559 8.535 1.129 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CG . . . . . . . . . c25520_2n0c 1 . 1 . 14 . 1 1 2 ASN H H -6.605 6.301 3.354 . . . 1.0 . . . . . . . . . . . . A . 2 ASN H . . . . . . . . . c25520_2n0c 1 . 1 . 15 . 1 1 2 ASN HA H -6.414 6.171 0.390 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HA . . . . . . . . . c25520_2n0c 1 . 1 . 16 . 1 1 2 ASN HB2 H -4.658 7.266 2.590 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HB2 . . . . . . . . . c25520_2n0c 1 . 1 . 17 . 1 1 2 ASN HB3 H -4.041 7.054 0.938 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HB3 . . . . . . . . . c25520_2n0c 1 . 1 . 18 . 1 1 2 ASN HD21 H -7.035 8.320 2.528 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HD21 . . . . . . . . . c25520_2n0c 1 . 1 . 19 . 1 1 2 ASN HD22 H -7.108 9.784 1.541 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HD22 . . . . . . . . . c25520_2n0c 1 . 1 . 20 . 1 1 2 ASN N N -6.881 5.999 2.420 . . . 1.0 . . . . . . . . . . . . A . 2 ASN N . . . . . . . . . c25520_2n0c 1 . 1 . 21 . 1 1 2 ASN ND2 N -6.652 8.905 1.785 . . . 1.0 . . . . . . . . . . . . A . 2 ASN ND2 . . . . . . . . . c25520_2n0c 1 . 1 . 22 . 1 1 2 ASN O O -4.975 4.026 2.282 . . . 1.0 . . . . . . . . . . . . A . 2 ASN O . . . . . . . . . c25520_2n0c 1 . 1 . 23 . 1 1 2 ASN OD1 O -5.060 9.215 0.232 . . . 1.0 . . . . . . . . . . . . A . 2 ASN OD1 . . . . . . . . . c25520_2n0c 1 . 1 . 24 . 1 1 3 HIS C C -2.326 3.464 0.075 . . . 1.0 . . . . . . . . . . . . A . 3 HIS C . . . . . . . . . c25520_2n0c 1 . 1 . 25 . 1 1 3 HIS CA C -3.818 3.193 -0.094 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CA . . . . . . . . . c25520_2n0c 1 . 1 . 26 . 1 1 3 HIS CB C -4.087 2.604 -1.482 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CB . . . . . . . . . c25520_2n0c 1 . 1 . 27 . 1 1 3 HIS CD2 C -5.751 0.672 -1.972 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CD2 . . . . . . . . . c25520_2n0c 1 . 1 . 28 . 1 1 3 HIS CE1 C -7.603 1.748 -1.519 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CE1 . . . . . . . . . c25520_2n0c 1 . 1 . 29 . 1 1 3 HIS CG C -5.433 1.944 -1.599 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CG . . . . . . . . . c25520_2n0c 1 . 1 . 30 . 1 1 3 HIS H H -4.740 5.037 -0.695 . . . 1.0 . . . . . . . . . . . . A . 3 HIS H . . . . . . . . . c25520_2n0c 1 . 1 . 31 . 1 1 3 HIS HA H -4.121 2.451 0.647 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HA . . . . . . . . . c25520_2n0c 1 . 1 . 32 . 1 1 3 HIS HB2 H -4.038 3.412 -2.210 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HB2 . . . . . . . . . c25520_2n0c 1 . 1 . 33 . 1 1 3 HIS HB3 H -3.313 1.870 -1.718 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HB3 . . . . . . . . . c25520_2n0c 1 . 1 . 34 . 1 1 3 HIS HD1 H -6.711 3.579 -1.012 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HD1 . . . . . . . . . c25520_2n0c 1 . 1 . 35 . 1 1 3 HIS HD2 H -5.086 -0.028 -2.456 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HD2 . . . . . . . . . c25520_2n0c 1 . 1 . 36 . 1 1 3 HIS HE1 H -8.649 1.977 -1.382 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HE1 . . . . . . . . . c25520_2n0c 1 . 1 . 37 . 1 1 3 HIS N N -4.593 4.413 0.098 . . . 1.0 . . . . . . . . . . . . A . 3 HIS N . . . . . . . . . c25520_2n0c 1 . 1 . 38 . 1 1 3 HIS ND1 N -6.615 2.609 -1.317 . . . 1.0 . . . . . . . . . . . . A . 3 HIS ND1 . . . . . . . . . c25520_2n0c 1 . 1 . 39 . 1 1 3 HIS NE2 N -7.130 0.566 -1.915 . . . 1.0 . . . . . . . . . . . . A . 3 HIS NE2 . . . . . . . . . c25520_2n0c 1 . 1 . 40 . 1 1 3 HIS O O -1.536 3.234 -0.841 . . . 1.0 . . . . . . . . . . . . A . 3 HIS O . . . . . . . . . c25520_2n0c 1 . 1 . 41 . 1 1 4 TRP C C 0.337 3.055 1.248 . . . 1.0 . . . . . . . . . . . . A . 4 TRP C . . . . . . . . . c25520_2n0c 1 . 1 . 42 . 1 1 4 TRP CA C -0.552 4.259 1.538 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CA . . . . . . . . . c25520_2n0c 1 . 1 . 43 . 1 1 4 TRP CB C -0.393 4.687 2.998 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CB . . . . . . . . . c25520_2n0c 1 . 1 . 44 . 1 1 4 TRP CD1 C -1.190 6.919 3.972 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CD1 . . . . . . . . . c25520_2n0c 1 . 1 . 45 . 1 1 4 TRP CD2 C 0.538 7.096 2.558 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CD2 . . . . . . . . . c25520_2n0c 1 . 1 . 46 . 1 1 4 TRP CE2 C 0.200 8.384 3.019 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CE2 . . . . . . . . . c25520_2n0c 1 . 1 . 47 . 1 1 4 TRP CE3 C 1.597 6.959 1.657 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CE3 . . . . . . . . . c25520_2n0c 1 . 1 . 48 . 1 1 4 TRP CG C -0.363 6.174 3.181 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CG . . . . . . . . . c25520_2n0c 1 . 1 . 49 . 1 1 4 TRP CH2 C 1.918 9.361 1.725 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CH2 . . . . . . . . . c25520_2n0c 1 . 1 . 50 . 1 1 4 TRP CZ2 C 0.885 9.525 2.607 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CZ2 . . . . . . . . . c25520_2n0c 1 . 1 . 51 . 1 1 4 TRP CZ3 C 2.276 8.092 1.250 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CZ3 . . . . . . . . . c25520_2n0c 1 . 1 . 52 . 1 1 4 TRP H H -2.652 4.122 1.969 . . . 1.0 . . . . . . . . . . . . A . 4 TRP H . . . . . . . . . c25520_2n0c 1 . 1 . 53 . 1 1 4 TRP HA H -0.241 5.079 0.891 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HA . . . . . . . . . c25520_2n0c 1 . 1 . 54 . 1 1 4 TRP HB2 H -1.237 4.296 3.562 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HB2 . . . . . . . . . c25520_2n0c 1 . 1 . 55 . 1 1 4 TRP HB3 H 0.529 4.270 3.415 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HB3 . . . . . . . . . c25520_2n0c 1 . 1 . 56 . 1 1 4 TRP HD1 H -1.988 6.521 4.582 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HD1 . . . . . . . . . c25520_2n0c 1 . 1 . 57 . 1 1 4 TRP HE1 H -1.314 9.021 4.365 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HE1 . . . . . . . . . c25520_2n0c 1 . 1 . 58 . 1 1 4 TRP HE3 H 1.882 5.985 1.290 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HE3 . . . . . . . . . c25520_2n0c 1 . 1 . 59 . 1 1 4 TRP HH2 H 2.467 10.230 1.389 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HH2 . . . . . . . . . c25520_2n0c 1 . 1 . 60 . 1 1 4 TRP HZ2 H 0.611 10.505 2.970 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HZ2 . . . . . . . . . c25520_2n0c 1 . 1 . 61 . 1 1 4 TRP HZ3 H 3.096 7.993 0.554 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HZ3 . . . . . . . . . c25520_2n0c 1 . 1 . 62 . 1 1 4 TRP N N -1.949 3.956 1.250 . . . 1.0 . . . . . . . . . . . . A . 4 TRP N . . . . . . . . . c25520_2n0c 1 . 1 . 63 . 1 1 4 TRP NE1 N -0.856 8.250 3.879 . . . 1.0 . . . . . . . . . . . . A . 4 TRP NE1 . . . . . . . . . c25520_2n0c 1 . 1 . 64 . 1 1 4 TRP O O 1.065 3.034 0.256 . . . 1.0 . . . . . . . . . . . . A . 4 TRP O . . . . . . . . . c25520_2n0c 1 . 1 . 65 . 1 1 5 ALA C C 0.185 -0.372 1.728 . . . 1.0 . . . . . . . . . . . . A . 5 ALA C . . . . . . . . . c25520_2n0c 1 . 1 . 66 . 1 1 5 ALA CA C 1.073 0.846 1.957 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CA . . . . . . . . . c25520_2n0c 1 . 1 . 67 . 1 1 5 ALA CB C 1.962 0.632 3.173 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CB . . . . . . . . . c25520_2n0c 1 . 1 . 68 . 1 1 5 ALA H H -0.346 2.136 2.927 . . . 1.0 . . . . . . . . . . . . A . 5 ALA H . . . . . . . . . c25520_2n0c 1 . 1 . 69 . 1 1 5 ALA HA H 1.724 0.950 1.085 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HA . . . . . . . . . c25520_2n0c 1 . 1 . 70 . 1 1 5 ALA HB1 H 1.336 0.434 4.042 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB1 . . . . . . . . . c25520_2n0c 1 . 1 . 71 . 1 1 5 ALA HB2 H 2.558 1.528 3.349 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB2 . . . . . . . . . c25520_2n0c 1 . 1 . 72 . 1 1 5 ALA HB3 H 2.623 -0.217 3.001 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB3 . . . . . . . . . c25520_2n0c 1 . 1 . 73 . 1 1 5 ALA N N 0.274 2.055 2.121 . . . 1.0 . . . . . . . . . . . . A . 5 ALA N . . . . . . . . . c25520_2n0c 1 . 1 . 74 . 1 1 5 ALA O O -0.271 -1.008 2.679 . . . 1.0 . . . . . . . . . . . . A . 5 ALA O . . . . . . . . . c25520_2n0c 1 . 1 . 75 . 1 1 6 VAL C C -0.442 -2.457 -1.208 . . . 1.0 . . . . . . . . . . . . A . 6 VAL C . . . . . . . . . c25520_2n0c 1 . 1 . 76 . 1 1 6 VAL CA C -0.894 -1.835 0.106 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CA . . . . . . . . . c25520_2n0c 1 . 1 . 77 . 1 1 6 VAL CB C -2.373 -1.433 -0.007 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CB . . . . . . . . . c25520_2n0c 1 . 1 . 78 . 1 1 6 VAL CG1 C -3.225 -2.635 -0.392 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CG1 . . . . . . . . . c25520_2n0c 1 . 1 . 79 . 1 1 6 VAL CG2 C -2.863 -0.819 1.296 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CG2 . . . . . . . . . c25520_2n0c 1 . 1 . 80 . 1 1 6 VAL H H 0.351 -0.127 -0.283 . . . 1.0 . . . . . . . . . . . . A . 6 VAL H . . . . . . . . . c25520_2n0c 1 . 1 . 81 . 1 1 6 VAL HA H -0.812 -2.593 0.888 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HA . . . . . . . . . c25520_2n0c 1 . 1 . 82 . 1 1 6 VAL HB H -2.462 -0.686 -0.798 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HB . . . . . . . . . c25520_2n0c 1 . 1 . 83 . 1 1 6 VAL HG11 H -3.013 -2.929 -1.419 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG11 . . . . . . . . . c25520_2n0c 1 . 1 . 84 . 1 1 6 VAL HG12 H -4.282 -2.383 -0.301 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG12 . . . . . . . . . c25520_2n0c 1 . 1 . 85 . 1 1 6 VAL HG13 H -2.990 -3.464 0.277 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG13 . . . . . . . . . c25520_2n0c 1 . 1 . 86 . 1 1 6 VAL HG21 H -3.942 -0.675 1.255 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG21 . . . . . . . . . c25520_2n0c 1 . 1 . 87 . 1 1 6 VAL HG22 H -2.378 0.144 1.455 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG22 . . . . . . . . . c25520_2n0c 1 . 1 . 88 . 1 1 6 VAL HG23 H -2.616 -1.490 2.119 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG23 . . . . . . . . . c25520_2n0c 1 . 1 . 89 . 1 1 6 VAL N N -0.059 -0.691 0.461 . . . 1.0 . . . . . . . . . . . . A . 6 VAL N . . . . . . . . . c25520_2n0c 1 . 1 . 90 . 1 1 6 VAL O O -0.271 -1.762 -2.211 . . . 1.0 . . . . . . . . . . . . A . 6 VAL O . . . . . . . . . c25520_2n0c 1 . 1 . 91 . 1 1 7 GLY C C 1.641 -4.232 -2.716 . . . 1.0 . . . . . . . . . . . . A . 7 GLY C . . . . . . . . . c25520_2n0c 1 . 1 . 92 . 1 1 7 GLY CA C 0.177 -4.468 -2.401 . . . 1.0 . . . . . . . . . . . . A . 7 GLY CA . . . . . . . . . c25520_2n0c 1 . 1 . 93 . 1 1 7 GLY H H -0.411 -4.300 -0.343 . . . 1.0 . . . . . . . . . . . . A . 7 GLY H . . . . . . . . . c25520_2n0c 1 . 1 . 94 . 1 1 7 GLY HA2 H 0.017 -5.538 -2.262 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA2 . . . . . . . . . c25520_2n0c 1 . 1 . 95 . 1 1 7 GLY HA3 H -0.425 -4.129 -3.244 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA3 . . . . . . . . . c25520_2n0c 1 . 1 . 96 . 1 1 7 GLY N N -0.252 -3.773 -1.201 . . . 1.0 . . . . . . . . . . . . A . 7 GLY N . . . . . . . . . c25520_2n0c 1 . 1 . 97 . 1 1 7 GLY O O 1.976 -3.425 -3.584 . . . 1.0 . . . . . . . . . . . . A . 7 GLY O . . . . . . . . . c25520_2n0c 1 . 1 . 98 . 1 1 8 HIS C C 4.579 -6.141 -2.594 . . . 1.0 . . . . . . . . . . . . A . 8 HIS C . . . . . . . . . c25520_2n0c 1 . 1 . 99 . 1 1 8 HIS CA C 3.955 -4.801 -2.216 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CA . . . . . . . . . c25520_2n0c 1 . 1 . 100 . 1 1 8 HIS CB C 4.624 -4.253 -0.953 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CB . . . . . . . . . c25520_2n0c 1 . 1 . 101 . 1 1 8 HIS CD2 C 3.489 -2.722 0.812 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CD2 . . . . . . . . . c25520_2n0c 1 . 1 . 102 . 1 1 8 HIS CE1 C 3.184 -0.970 -0.462 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CE1 . . . . . . . . . c25520_2n0c 1 . 1 . 103 . 1 1 8 HIS CG C 3.973 -3.001 -0.430 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CG . . . . . . . . . c25520_2n0c 1 . 1 . 104 . 1 1 8 HIS H H 2.179 -5.592 -1.303 . . . 1.0 . . . . . . . . . . . . A . 8 HIS H . . . . . . . . . c25520_2n0c 1 . 1 . 105 . 1 1 8 HIS HA H 4.148 -4.098 -3.029 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HA . . . . . . . . . c25520_2n0c 1 . 1 . 106 . 1 1 8 HIS HB2 H 4.579 -5.018 -0.180 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HB2 . . . . . . . . . c25520_2n0c 1 . 1 . 107 . 1 1 8 HIS HB3 H 5.670 -4.038 -1.175 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HB3 . . . . . . . . . c25520_2n0c 1 . 1 . 108 . 1 1 8 HIS HD1 H 4.027 -1.779 -2.205 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HD1 . . . . . . . . . c25520_2n0c 1 . 1 . 109 . 1 1 8 HIS HD2 H 3.683 -3.295 1.707 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HD2 . . . . . . . . . c25520_2n0c 1 . 1 . 110 . 1 1 8 HIS HE1 H 2.901 0.015 -0.801 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HE1 . . . . . . . . . c25520_2n0c 1 . 1 . 111 . 1 1 8 HIS N N 2.518 -4.938 -2.008 . . . 1.0 . . . . . . . . . . . . A . 8 HIS N . . . . . . . . . c25520_2n0c 1 . 1 . 112 . 1 1 8 HIS ND1 N 3.772 -1.882 -1.222 . . . 1.0 . . . . . . . . . . . . A . 8 HIS ND1 . . . . . . . . . c25520_2n0c 1 . 1 . 113 . 1 1 8 HIS NE2 N 2.993 -1.432 0.774 . . . 1.0 . . . . . . . . . . . . A . 8 HIS NE2 . . . . . . . . . c25520_2n0c 1 . 1 . 114 . 1 1 8 HIS O O 5.681 -6.471 -2.153 . . . 1.0 . . . . . . . . . . . . A . 8 HIS O . . . . . . . . . c25520_2n0c 1 . 1 . 115 . 1 1 9 LEU C C 4.766 -8.176 -5.320 . . . 1.0 . . . . . . . . . . . . A . 9 LEU C . . . . . . . . . c25520_2n0c 1 . 1 . 116 . 1 1 9 LEU CA C 4.353 -8.213 -3.852 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CA . . . . . . . . . c25520_2n0c 1 . 1 . 117 . 1 1 9 LEU CB C 3.274 -9.277 -3.641 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CB . . . . . . . . . c25520_2n0c 1 . 1 . 118 . 1 1 9 LEU CD1 C 1.622 -10.194 -1.994 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD1 . . . . . . . . . c25520_2n0c 1 . 1 . 119 . 1 1 9 LEU CD2 C 4.031 -10.848 -1.840 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD2 . . . . . . . . . c25520_2n0c 1 . 1 . 120 . 1 1 9 LEU CG C 3.058 -9.735 -2.198 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CG . . . . . . . . . c25520_2n0c 1 . 1 . 121 . 1 1 9 LEU H H 2.964 -6.579 -3.748 . . . 1.0 . . . . . . . . . . . . A . 9 LEU H . . . . . . . . . c25520_2n0c 1 . 1 . 122 . 1 1 9 LEU HA H 5.222 -8.503 -3.257 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HA . . . . . . . . . c25520_2n0c 1 . 1 . 123 . 1 1 9 LEU HB2 H 2.338 -8.860 -4.018 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB2 . . . . . . . . . c25520_2n0c 1 . 1 . 124 . 1 1 9 LEU HB3 H 3.523 -10.156 -4.247 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB3 . . . . . . . . . c25520_2n0c 1 . 1 . 125 . 1 1 9 LEU HD11 H 0.938 -9.364 -2.166 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD11 . . . . . . . . . c25520_2n0c 1 . 1 . 126 . 1 1 9 LEU HD12 H 1.500 -10.560 -0.974 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD12 . . . . . . . . . c25520_2n0c 1 . 1 . 127 . 1 1 9 LEU HD13 H 1.402 -10.998 -2.698 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD13 . . . . . . . . . c25520_2n0c 1 . 1 . 128 . 1 1 9 LEU HD21 H 3.791 -11.732 -2.431 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD21 . . . . . . . . . c25520_2n0c 1 . 1 . 129 . 1 1 9 LEU HD22 H 3.940 -11.084 -0.780 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD22 . . . . . . . . . c25520_2n0c 1 . 1 . 130 . 1 1 9 LEU HD23 H 5.052 -10.535 -2.055 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD23 . . . . . . . . . c25520_2n0c 1 . 1 . 131 . 1 1 9 LEU HG H 3.244 -8.882 -1.543 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HG . . . . . . . . . c25520_2n0c 1 . 1 . 132 . 1 1 9 LEU N N 3.869 -6.908 -3.414 . . . 1.0 . . . . . . . . . . . . A . 9 LEU N . . . . . . . . . c25520_2n0c 1 . 1 . 133 . 1 1 9 LEU O O 3.962 -7.848 -6.193 . . . 1.0 . . . . . . . . . . . . A . 9 LEU O . . . . . . . . . c25520_2n0c 1 . 1 . 134 . 1 1 10 MET C C 6.066 -9.761 -7.702 . . . 1.0 . . . . . . . . . . . . A . 10 MET C . . . . . . . . . c25520_2n0c 1 . 1 . 135 . 1 1 10 MET CA C 6.541 -8.524 -6.947 . . . 1.0 . . . . . . . . . . . . A . 10 MET CA . . . . . . . . . c25520_2n0c 1 . 1 . 136 . 1 1 10 MET CB C 8.071 -8.477 -6.935 . . . 1.0 . . . . . . . . . . . . A . 10 MET CB . . . . . . . . . c25520_2n0c 1 . 1 . 137 . 1 1 10 MET CE C 10.659 -8.167 -4.682 . . . 1.0 . . . . . . . . . . . . A . 10 MET CE . . . . . . . . . c25520_2n0c 1 . 1 . 138 . 1 1 10 MET CG C 8.634 -7.209 -6.313 . . . 1.0 . . . . . . . . . . . . A . 10 MET CG . . . . . . . . . c25520_2n0c 1 . 1 . 139 . 1 1 10 MET H H 6.640 -8.782 -4.816 . . . 1.0 . . . . . . . . . . . . A . 10 MET H . . . . . . . . . c25520_2n0c 1 . 1 . 140 . 1 1 10 MET HA H 6.179 -7.636 -7.467 . . . 1.0 . . . . . . . . . . . . A . 10 MET HA . . . . . . . . . c25520_2n0c 1 . 1 . 141 . 1 1 10 MET HB2 H 8.440 -9.333 -6.370 . . . 1.0 . . . . . . . . . . . . A . 10 MET HB2 . . . . . . . . . c25520_2n0c 1 . 1 . 142 . 1 1 10 MET HB3 H 8.432 -8.549 -7.961 . . . 1.0 . . . . . . . . . . . . A . 10 MET HB3 . . . . . . . . . c25520_2n0c 1 . 1 . 143 . 1 1 10 MET HE1 H 10.078 -7.702 -3.884 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE1 . . . . . . . . . c25520_2n0c 1 . 1 . 144 . 1 1 10 MET HE2 H 11.714 -8.174 -4.407 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE2 . . . . . . . . . c25520_2n0c 1 . 1 . 145 . 1 1 10 MET HE3 H 10.315 -9.191 -4.831 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE3 . . . . . . . . . c25520_2n0c 1 . 1 . 146 . 1 1 10 MET HG2 H 8.325 -6.356 -6.916 . . . 1.0 . . . . . . . . . . . . A . 10 MET HG2 . . . . . . . . . c25520_2n0c 1 . 1 . 147 . 1 1 10 MET HG3 H 8.219 -7.104 -5.309 . . . 1.0 . . . . . . . . . . . . A . 10 MET HG3 . . . . . . . . . c25520_2n0c 1 . 1 . 148 . 1 1 10 MET N N 6.024 -8.515 -5.584 . . . 1.0 . . . . . . . . . . . . A . 10 MET N . . . . . . . . . c25520_2n0c 1 . 1 . 149 . 1 1 10 MET O O 4.908 -10.112 -7.551 . . . 1.0 . . . . . . . . . . . . A . 10 MET O . . . . . . . . . c25520_2n0c 1 . 1 . 150 . 1 1 10 MET SD S 10.433 -7.234 -6.194 . . . 1.0 . . . . . . . . . . . . A . 10 MET SD . . . . . . . . . c25520_2n0c 1 . 2 . 151 . 1 1 1 GLY C C -6.695 1.669 5.423 . . . 1.0 . . . . . . . . . . . . A . 1 GLY C . . . . . . . . . c25520_2n0c 1 . 2 . 152 . 1 1 1 GLY CA C -6.730 0.750 6.628 . . . 1.0 . . . . . . . . . . . . A . 1 GLY CA . . . . . . . . . c25520_2n0c 1 . 2 . 153 . 1 1 1 GLY H1 H -8.476 -0.308 6.788 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H1 . . . . . . . . . c25520_2n0c 1 . 2 . 154 . 1 1 1 GLY H2 H -8.663 1.380 6.859 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H2 . . . . . . . . . c25520_2n0c 1 . 2 . 155 . 1 1 1 GLY H3 H -8.036 0.533 8.192 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H3 . . . . . . . . . c25520_2n0c 1 . 2 . 156 . 1 1 1 GLY HA2 H -6.097 1.171 7.408 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA2 . . . . . . . . . c25520_2n0c 1 . 2 . 157 . 1 1 1 GLY HA3 H -6.335 -0.224 6.340 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA3 . . . . . . . . . c25520_2n0c 1 . 2 . 158 . 1 1 1 GLY N N -8.071 0.576 7.154 . . . 1.0 . . . . . . . . . . . . A . 1 GLY N . . . . . . . . . c25520_2n0c 1 . 2 . 159 . 1 1 1 GLY O O -7.552 1.584 4.545 . . . 1.0 . . . . . . . . . . . . A . 1 GLY O . . . . . . . . . c25520_2n0c 1 . 2 . 160 . 1 1 2 ASN C C -4.896 2.823 3.075 . . . 1.0 . . . . . . . . . . . . A . 2 ASN C . . . . . . . . . c25520_2n0c 1 . 2 . 161 . 1 1 2 ASN CA C -5.560 3.491 4.276 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CA . . . . . . . . . c25520_2n0c 1 . 2 . 162 . 1 1 2 ASN CB C -4.742 4.708 4.715 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CB . . . . . . . . . c25520_2n0c 1 . 2 . 163 . 1 1 2 ASN CG C -5.573 5.718 5.481 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CG . . . . . . . . . c25520_2n0c 1 . 2 . 164 . 1 1 2 ASN H H -5.022 2.571 6.142 . . . 1.0 . . . . . . . . . . . . A . 2 ASN H . . . . . . . . . c25520_2n0c 1 . 2 . 165 . 1 1 2 ASN HA H -6.551 3.835 3.973 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HA . . . . . . . . . c25520_2n0c 1 . 2 . 166 . 1 1 2 ASN HB2 H -3.933 4.368 5.360 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HB2 . . . . . . . . . c25520_2n0c 1 . 2 . 167 . 1 1 2 ASN HB3 H -4.313 5.199 3.838 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HB3 . . . . . . . . . c25520_2n0c 1 . 2 . 168 . 1 1 2 ASN HD21 H -6.808 5.977 3.872 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HD21 . . . . . . . . . c25520_2n0c 1 . 2 . 169 . 1 1 2 ASN HD22 H -7.199 6.926 5.310 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HD22 . . . . . . . . . c25520_2n0c 1 . 2 . 170 . 1 1 2 ASN N N -5.701 2.551 5.382 . . . 1.0 . . . . . . . . . . . . A . 2 ASN N . . . . . . . . . c25520_2n0c 1 . 2 . 171 . 1 1 2 ASN ND2 N -6.606 6.245 4.835 . . . 1.0 . . . . . . . . . . . . A . 2 ASN ND2 . . . . . . . . . c25520_2n0c 1 . 2 . 172 . 1 1 2 ASN O O -4.502 1.658 3.138 . . . 1.0 . . . . . . . . . . . . A . 2 ASN O . . . . . . . . . c25520_2n0c 1 . 2 . 173 . 1 1 2 ASN OD1 O -5.289 6.021 6.640 . . . 1.0 . . . . . . . . . . . . A . 2 ASN OD1 . . . . . . . . . c25520_2n0c 1 . 2 . 174 . 1 1 3 HIS C C -2.711 3.532 0.645 . . . 1.0 . . . . . . . . . . . . A . 3 HIS C . . . . . . . . . c25520_2n0c 1 . 2 . 175 . 1 1 3 HIS CA C -4.155 3.052 0.768 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CA . . . . . . . . . c25520_2n0c 1 . 2 . 176 . 1 1 3 HIS CB C -4.954 3.485 -0.464 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CB . . . . . . . . . c25520_2n0c 1 . 2 . 177 . 1 1 3 HIS CD2 C -4.441 2.648 -2.868 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CD2 . . . . . . . . . c25520_2n0c 1 . 2 . 178 . 1 1 3 HIS CE1 C -5.147 0.590 -2.626 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CE1 . . . . . . . . . c25520_2n0c 1 . 2 . 179 . 1 1 3 HIS CG C -4.896 2.493 -1.592 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CG . . . . . . . . . c25520_2n0c 1 . 2 . 180 . 1 1 3 HIS H H -5.119 4.529 1.993 . . . 1.0 . . . . . . . . . . . . A . 3 HIS H . . . . . . . . . c25520_2n0c 1 . 2 . 181 . 1 1 3 HIS HA H -4.149 1.958 0.807 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HA . . . . . . . . . c25520_2n0c 1 . 2 . 182 . 1 1 3 HIS HB2 H -5.996 3.595 -0.168 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HB2 . . . . . . . . . c25520_2n0c 1 . 2 . 183 . 1 1 3 HIS HB3 H -4.589 4.453 -0.817 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HB3 . . . . . . . . . c25520_2n0c 1 . 2 . 184 . 1 1 3 HIS HD1 H -5.736 0.764 -0.620 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HD1 . . . . . . . . . c25520_2n0c 1 . 2 . 185 . 1 1 3 HIS HD2 H -4.231 3.591 -3.352 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HD2 . . . . . . . . . c25520_2n0c 1 . 2 . 186 . 1 1 3 HIS HE1 H -5.433 -0.426 -2.844 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HE1 . . . . . . . . . c25520_2n0c 1 . 2 . 187 . 1 1 3 HIS N N -4.773 3.570 1.983 . . . 1.0 . . . . . . . . . . . . A . 3 HIS N . . . . . . . . . c25520_2n0c 1 . 2 . 188 . 1 1 3 HIS ND1 N -5.338 1.188 -1.459 . . . 1.0 . . . . . . . . . . . . A . 3 HIS ND1 . . . . . . . . . c25520_2n0c 1 . 2 . 189 . 1 1 3 HIS NE2 N -4.607 1.434 -3.509 . . . 1.0 . . . . . . . . . . . . A . 3 HIS NE2 . . . . . . . . . c25520_2n0c 1 . 2 . 190 . 1 1 3 HIS O O -2.183 3.663 -0.459 . . . 1.0 . . . . . . . . . . . . A . 3 HIS O . . . . . . . . . c25520_2n0c 1 . 2 . 191 . 1 1 4 TRP C C 0.203 3.322 1.006 . . . 1.0 . . . . . . . . . . . . A . 4 TRP C . . . . . . . . . c25520_2n0c 1 . 2 . 192 . 1 1 4 TRP CA C -0.699 4.258 1.803 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CA . . . . . . . . . c25520_2n0c 1 . 2 . 193 . 1 1 4 TRP CB C -0.195 4.366 3.244 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CB . . . . . . . . . c25520_2n0c 1 . 2 . 194 . 1 1 4 TRP CD1 C -0.932 6.131 4.950 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CD1 . . . . . . . . . c25520_2n0c 1 . 2 . 195 . 1 1 4 TRP CD2 C 0.267 6.945 3.241 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CD2 . . . . . . . . . c25520_2n0c 1 . 2 . 196 . 1 1 4 TRP CE2 C -0.073 8.009 4.100 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CE2 . . . . . . . . . c25520_2n0c 1 . 2 . 197 . 1 1 4 TRP CE3 C 1.021 7.218 2.097 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CE3 . . . . . . . . . c25520_2n0c 1 . 2 . 198 . 1 1 4 TRP CG C -0.292 5.753 3.803 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CG . . . . . . . . . c25520_2n0c 1 . 2 . 199 . 1 1 4 TRP CH2 C 1.055 9.561 2.720 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CH2 . . . . . . . . . c25520_2n0c 1 . 2 . 200 . 1 1 4 TRP CZ2 C 0.316 9.322 3.848 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CZ2 . . . . . . . . . c25520_2n0c 1 . 2 . 201 . 1 1 4 TRP CZ3 C 1.407 8.521 1.848 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CZ3 . . . . . . . . . c25520_2n0c 1 . 2 . 202 . 1 1 4 TRP H H -2.573 3.658 2.666 . . . 1.0 . . . . . . . . . . . . A . 4 TRP H . . . . . . . . . c25520_2n0c 1 . 2 . 203 . 1 1 4 TRP HA H -0.670 5.241 1.340 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HA . . . . . . . . . c25520_2n0c 1 . 2 . 204 . 1 1 4 TRP HB2 H -0.797 3.708 3.868 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HB2 . . . . . . . . . c25520_2n0c 1 . 2 . 205 . 1 1 4 TRP HB3 H 0.849 4.043 3.302 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HB3 . . . . . . . . . c25520_2n0c 1 . 2 . 206 . 1 1 4 TRP HD1 H -1.460 5.463 5.614 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HD1 . . . . . . . . . c25520_2n0c 1 . 2 . 207 . 1 1 4 TRP HE1 H -1.187 8.028 5.909 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HE1 . . . . . . . . . c25520_2n0c 1 . 2 . 208 . 1 1 4 TRP HE3 H 1.305 6.423 1.424 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HE3 . . . . . . . . . c25520_2n0c 1 . 2 . 209 . 1 1 4 TRP HH2 H 1.371 10.570 2.501 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HH2 . . . . . . . . . c25520_2n0c 1 . 2 . 210 . 1 1 4 TRP HZ2 H 0.046 10.125 4.517 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HZ2 . . . . . . . . . c25520_2n0c 1 . 2 . 211 . 1 1 4 TRP HZ3 H 1.990 8.737 0.965 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HZ3 . . . . . . . . . c25520_2n0c 1 . 2 . 212 . 1 1 4 TRP N N -2.081 3.791 1.784 . . . 1.0 . . . . . . . . . . . . A . 4 TRP N . . . . . . . . . c25520_2n0c 1 . 2 . 213 . 1 1 4 TRP NE1 N -0.804 7.487 5.133 . . . 1.0 . . . . . . . . . . . . A . 4 TRP NE1 . . . . . . . . . c25520_2n0c 1 . 2 . 214 . 1 1 4 TRP O O 0.625 3.648 -0.103 . . . 1.0 . . . . . . . . . . . . A . 4 TRP O . . . . . . . . . c25520_2n0c 1 . 2 . 215 . 1 1 5 ALA C C 0.560 -0.092 0.585 . . . 1.0 . . . . . . . . . . . . A . 5 ALA C . . . . . . . . . c25520_2n0c 1 . 2 . 216 . 1 1 5 ALA CA C 1.343 1.174 0.918 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CA . . . . . . . . . c25520_2n0c 1 . 2 . 217 . 1 1 5 ALA CB C 2.541 0.840 1.794 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CB . . . . . . . . . c25520_2n0c 1 . 2 . 218 . 1 1 5 ALA H H 0.113 1.947 2.500 . . . 1.0 . . . . . . . . . . . . A . 5 ALA H . . . . . . . . . c25520_2n0c 1 . 2 . 219 . 1 1 5 ALA HA H 1.723 1.585 -0.021 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HA . . . . . . . . . c25520_2n0c 1 . 2 . 220 . 1 1 5 ALA HB1 H 2.191 0.558 2.787 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB1 . . . . . . . . . c25520_2n0c 1 . 2 . 221 . 1 1 5 ALA HB2 H 3.191 1.712 1.872 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB2 . . . . . . . . . c25520_2n0c 1 . 2 . 222 . 1 1 5 ALA HB3 H 3.096 0.010 1.357 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB3 . . . . . . . . . c25520_2n0c 1 . 2 . 223 . 1 1 5 ALA N N 0.493 2.158 1.577 . . . 1.0 . . . . . . . . . . . . A . 5 ALA N . . . . . . . . . c25520_2n0c 1 . 2 . 224 . 1 1 5 ALA O O 0.308 -0.925 1.455 . . . 1.0 . . . . . . . . . . . . A . 5 ALA O . . . . . . . . . c25520_2n0c 1 . 2 . 225 . 1 1 6 VAL C C 0.190 -2.169 -2.194 . . . 1.0 . . . . . . . . . . . . A . 6 VAL C . . . . . . . . . c25520_2n0c 1 . 2 . 226 . 1 1 6 VAL CA C -0.578 -1.395 -1.129 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CA . . . . . . . . . c25520_2n0c 1 . 2 . 227 . 1 1 6 VAL CB C -1.951 -0.990 -1.691 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CB . . . . . . . . . c25520_2n0c 1 . 2 . 228 . 1 1 6 VAL CG1 C -1.787 -0.137 -2.942 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CG1 . . . . . . . . . c25520_2n0c 1 . 2 . 229 . 1 1 6 VAL CG2 C -2.790 -2.225 -1.986 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CG2 . . . . . . . . . c25520_2n0c 1 . 2 . 230 . 1 1 6 VAL H H 0.420 0.493 -1.356 . . . 1.0 . . . . . . . . . . . . A . 6 VAL H . . . . . . . . . c25520_2n0c 1 . 2 . 231 . 1 1 6 VAL HA H -0.746 -2.069 -0.285 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HA . . . . . . . . . c25520_2n0c 1 . 2 . 232 . 1 1 6 VAL HB H -2.468 -0.394 -0.936 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HB . . . . . . . . . c25520_2n0c 1 . 2 . 233 . 1 1 6 VAL HG11 H -2.746 -0.026 -3.427 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG11 . . . . . . . . . c25520_2n0c 1 . 2 . 234 . 1 1 6 VAL HG12 H -1.100 -0.609 -3.638 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG12 . . . . . . . . . c25520_2n0c 1 . 2 . 235 . 1 1 6 VAL HG13 H -1.408 0.847 -2.669 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG13 . . . . . . . . . c25520_2n0c 1 . 2 . 236 . 1 1 6 VAL HG21 H -3.806 -1.933 -2.230 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG21 . . . . . . . . . c25520_2n0c 1 . 2 . 237 . 1 1 6 VAL HG22 H -2.802 -2.877 -1.113 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG22 . . . . . . . . . c25520_2n0c 1 . 2 . 238 . 1 1 6 VAL HG23 H -2.354 -2.758 -2.831 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG23 . . . . . . . . . c25520_2n0c 1 . 2 . 239 . 1 1 6 VAL N N 0.177 -0.230 -0.680 . . . 1.0 . . . . . . . . . . . . A . 6 VAL N . . . . . . . . . c25520_2n0c 1 . 2 . 240 . 1 1 6 VAL O O 0.953 -1.590 -2.969 . . . 1.0 . . . . . . . . . . . . A . 6 VAL O . . . . . . . . . c25520_2n0c 1 . 2 . 241 . 1 1 7 GLY C C 2.050 -4.721 -2.755 . . . 1.0 . . . . . . . . . . . . A . 7 GLY C . . . . . . . . . c25520_2n0c 1 . 2 . 242 . 1 1 7 GLY CA C 0.660 -4.314 -3.207 . . . 1.0 . . . . . . . . . . . . A . 7 GLY CA . . . . . . . . . c25520_2n0c 1 . 2 . 243 . 1 1 7 GLY H H -0.663 -3.906 -1.567 . . . 1.0 . . . . . . . . . . . . A . 7 GLY H . . . . . . . . . c25520_2n0c 1 . 2 . 244 . 1 1 7 GLY HA2 H 0.068 -5.216 -3.364 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA2 . . . . . . . . . c25520_2n0c 1 . 2 . 245 . 1 1 7 GLY HA3 H 0.737 -3.777 -4.154 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA3 . . . . . . . . . c25520_2n0c 1 . 2 . 246 . 1 1 7 GLY N N -0.017 -3.481 -2.231 . . . 1.0 . . . . . . . . . . . . A . 7 GLY N . . . . . . . . . c25520_2n0c 1 . 2 . 247 . 1 1 7 GLY O O 2.957 -4.872 -3.574 . . . 1.0 . . . . . . . . . . . . A . 7 GLY O . . . . . . . . . c25520_2n0c 1 . 2 . 248 . 1 1 8 HIS C C 3.469 -6.731 -0.392 . . . 1.0 . . . . . . . . . . . . A . 8 HIS C . . . . . . . . . c25520_2n0c 1 . 2 . 249 . 1 1 8 HIS CA C 3.507 -5.290 -0.890 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CA . . . . . . . . . c25520_2n0c 1 . 2 . 250 . 1 1 8 HIS CB C 3.898 -4.354 0.253 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CB . . . . . . . . . c25520_2n0c 1 . 2 . 251 . 1 1 8 HIS CD2 C 5.747 -2.921 -0.874 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CD2 . . . . . . . . . c25520_2n0c 1 . 2 . 252 . 1 1 8 HIS CE1 C 4.871 -0.950 -0.495 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CE1 . . . . . . . . . c25520_2n0c 1 . 2 . 253 . 1 1 8 HIS CG C 4.574 -3.090 -0.202 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CG . . . . . . . . . c25520_2n0c 1 . 2 . 254 . 1 1 8 HIS H H 1.427 -4.759 -0.821 . . . 1.0 . . . . . . . . . . . . A . 8 HIS H . . . . . . . . . c25520_2n0c 1 . 2 . 255 . 1 1 8 HIS HA H 4.281 -5.221 -1.661 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HA . . . . . . . . . c25520_2n0c 1 . 2 . 256 . 1 1 8 HIS HB2 H 2.993 -4.077 0.789 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HB2 . . . . . . . . . c25520_2n0c 1 . 2 . 257 . 1 1 8 HIS HB3 H 4.570 -4.867 0.946 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HB3 . . . . . . . . . c25520_2n0c 1 . 2 . 258 . 1 1 8 HIS HD1 H 3.160 -1.629 0.509 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HD1 . . . . . . . . . c25520_2n0c 1 . 2 . 259 . 1 1 8 HIS HD2 H 6.301 -3.696 -1.382 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HD2 . . . . . . . . . c25520_2n0c 1 . 2 . 260 . 1 1 8 HIS HE1 H 4.722 0.120 -0.473 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HE1 . . . . . . . . . c25520_2n0c 1 . 2 . 261 . 1 1 8 HIS N N 2.218 -4.898 -1.449 . . . 1.0 . . . . . . . . . . . . A . 8 HIS N . . . . . . . . . c25520_2n0c 1 . 2 . 262 . 1 1 8 HIS ND1 N 4.035 -1.835 0.028 . . . 1.0 . . . . . . . . . . . . A . 8 HIS ND1 . . . . . . . . . c25520_2n0c 1 . 2 . 263 . 1 1 8 HIS NE2 N 5.921 -1.560 -1.052 . . . 1.0 . . . . . . . . . . . . A . 8 HIS NE2 . . . . . . . . . c25520_2n0c 1 . 2 . 264 . 1 1 8 HIS O O 4.218 -7.109 0.509 . . . 1.0 . . . . . . . . . . . . A . 8 HIS O . . . . . . . . . c25520_2n0c 1 . 2 . 265 . 1 1 9 LEU C C 3.135 -9.846 -1.614 . . . 1.0 . . . . . . . . . . . . A . 9 LEU C . . . . . . . . . c25520_2n0c 1 . 2 . 266 . 1 1 9 LEU CA C 2.452 -8.934 -0.600 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CA . . . . . . . . . c25520_2n0c 1 . 2 . 267 . 1 1 9 LEU CB C 0.974 -9.306 -0.476 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CB . . . . . . . . . c25520_2n0c 1 . 2 . 268 . 1 1 9 LEU CD1 C 0.901 -9.996 1.933 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD1 . . . . . . . . . c25520_2n0c 1 . 2 . 269 . 1 1 9 LEU CD2 C 0.527 -7.603 1.308 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD2 . . . . . . . . . c25520_2n0c 1 . 2 . 270 . 1 1 9 LEU CG C 0.329 -9.052 0.887 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CG . . . . . . . . . c25520_2n0c 1 . 2 . 271 . 1 1 9 LEU H H 1.996 -7.162 -1.726 . . . 1.0 . . . . . . . . . . . . A . 9 LEU H . . . . . . . . . c25520_2n0c 1 . 2 . 272 . 1 1 9 LEU HA H 2.921 -9.094 0.370 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HA . . . . . . . . . c25520_2n0c 1 . 2 . 273 . 1 1 9 LEU HB2 H 0.428 -8.719 -1.211 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB2 . . . . . . . . . c25520_2n0c 1 . 2 . 274 . 1 1 9 LEU HB3 H 0.845 -10.364 -0.723 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB3 . . . . . . . . . c25520_2n0c 1 . 2 . 275 . 1 1 9 LEU HD11 H 0.187 -10.103 2.752 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD11 . . . . . . . . . c25520_2n0c 1 . 2 . 276 . 1 1 9 LEU HD12 H 1.834 -9.594 2.331 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD12 . . . . . . . . . c25520_2n0c 1 . 2 . 277 . 1 1 9 LEU HD13 H 1.087 -10.977 1.495 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD13 . . . . . . . . . c25520_2n0c 1 . 2 . 278 . 1 1 9 LEU HD21 H 0.038 -7.429 2.266 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD21 . . . . . . . . . c25520_2n0c 1 . 2 . 279 . 1 1 9 LEU HD22 H 0.097 -6.942 0.555 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD22 . . . . . . . . . c25520_2n0c 1 . 2 . 280 . 1 1 9 LEU HD23 H 1.593 -7.399 1.403 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD23 . . . . . . . . . c25520_2n0c 1 . 2 . 281 . 1 1 9 LEU HG H -0.744 -9.241 0.803 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HG . . . . . . . . . c25520_2n0c 1 . 2 . 282 . 1 1 9 LEU N N 2.589 -7.533 -0.984 . . . 1.0 . . . . . . . . . . . . A . 9 LEU N . . . . . . . . . c25520_2n0c 1 . 2 . 283 . 1 1 9 LEU O O 2.482 -10.420 -2.484 . . . 1.0 . . . . . . . . . . . . A . 9 LEU O . . . . . . . . . c25520_2n0c 1 . 2 . 284 . 1 1 10 MET C C 4.820 -12.284 -2.250 . . . 1.0 . . . . . . . . . . . . A . 10 MET C . . . . . . . . . c25520_2n0c 1 . 2 . 285 . 1 1 10 MET CA C 5.223 -10.821 -2.397 . . . 1.0 . . . . . . . . . . . . A . 10 MET CA . . . . . . . . . c25520_2n0c 1 . 2 . 286 . 1 1 10 MET CB C 6.720 -10.662 -2.126 . . . 1.0 . . . . . . . . . . . . A . 10 MET CB . . . . . . . . . c25520_2n0c 1 . 2 . 287 . 1 1 10 MET CE C 9.465 -9.495 -4.236 . . . 1.0 . . . . . . . . . . . . A . 10 MET CE . . . . . . . . . c25520_2n0c 1 . 2 . 288 . 1 1 10 MET CG C 7.275 -9.311 -2.547 . . . 1.0 . . . . . . . . . . . . A . 10 MET CG . . . . . . . . . c25520_2n0c 1 . 2 . 289 . 1 1 10 MET H H 4.934 -9.478 -0.744 . . . 1.0 . . . . . . . . . . . . A . 10 MET H . . . . . . . . . c25520_2n0c 1 . 2 . 290 . 1 1 10 MET HA H 5.027 -10.505 -3.421 . . . 1.0 . . . . . . . . . . . . A . 10 MET HA . . . . . . . . . c25520_2n0c 1 . 2 . 291 . 1 1 10 MET HB2 H 6.895 -10.785 -1.058 . . . 1.0 . . . . . . . . . . . . A . 10 MET HB2 . . . . . . . . . c25520_2n0c 1 . 2 . 292 . 1 1 10 MET HB3 H 7.262 -11.441 -2.666 . . . 1.0 . . . . . . . . . . . . A . 10 MET HB3 . . . . . . . . . c25520_2n0c 1 . 2 . 293 . 1 1 10 MET HE1 H 9.336 -8.552 -4.768 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE1 . . . . . . . . . c25520_2n0c 1 . 2 . 294 . 1 1 10 MET HE2 H 8.793 -10.243 -4.656 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE2 . . . . . . . . . c25520_2n0c 1 . 2 . 295 . 1 1 10 MET HE3 H 10.496 -9.833 -4.339 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE3 . . . . . . . . . c25520_2n0c 1 . 2 . 296 . 1 1 10 MET HG2 H 6.948 -9.105 -3.565 . . . 1.0 . . . . . . . . . . . . A . 10 MET HG2 . . . . . . . . . c25520_2n0c 1 . 2 . 297 . 1 1 10 MET HG3 H 6.874 -8.543 -1.883 . . . 1.0 . . . . . . . . . . . . A . 10 MET HG3 . . . . . . . . . c25520_2n0c 1 . 2 . 298 . 1 1 10 MET N N 4.452 -9.975 -1.493 . . . 1.0 . . . . . . . . . . . . A . 10 MET N . . . . . . . . . c25520_2n0c 1 . 2 . 299 . 1 1 10 MET O O 4.634 -12.712 -1.123 . . . 1.0 . . . . . . . . . . . . A . 10 MET O . . . . . . . . . c25520_2n0c 1 . 2 . 300 . 1 1 10 MET SD S 9.077 -9.256 -2.504 . . . 1.0 . . . . . . . . . . . . A . 10 MET SD . . . . . . . . . c25520_2n0c 1 . 3 . 301 . 1 1 1 GLY C C -8.051 0.800 4.262 . . . 1.0 . . . . . . . . . . . . A . 1 GLY C . . . . . . . . . c25520_2n0c 1 . 3 . 302 . 1 1 1 GLY CA C -8.535 -0.587 4.637 . . . 1.0 . . . . . . . . . . . . A . 1 GLY CA . . . . . . . . . c25520_2n0c 1 . 3 . 303 . 1 1 1 GLY H1 H -8.002 -1.740 3.031 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H1 . . . . . . . . . c25520_2n0c 1 . 3 . 304 . 1 1 1 GLY H2 H -7.906 -2.535 4.529 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H2 . . . . . . . . . c25520_2n0c 1 . 3 . 305 . 1 1 1 GLY H3 H -6.730 -1.387 4.092 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H3 . . . . . . . . . c25520_2n0c 1 . 3 . 306 . 1 1 1 GLY HA2 H -9.569 -0.699 4.312 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA2 . . . . . . . . . c25520_2n0c 1 . 3 . 307 . 1 1 1 GLY HA3 H -8.492 -0.693 5.721 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA3 . . . . . . . . . c25520_2n0c 1 . 3 . 308 . 1 1 1 GLY N N -7.737 -1.636 4.030 . . . 1.0 . . . . . . . . . . . . A . 1 GLY N . . . . . . . . . c25520_2n0c 1 . 3 . 309 . 1 1 1 GLY O O -8.849 1.669 3.911 . . . 1.0 . . . . . . . . . . . . A . 1 GLY O . . . . . . . . . c25520_2n0c 1 . 3 . 310 . 1 1 2 ASN C C -5.599 2.296 2.583 . . . 1.0 . . . . . . . . . . . . A . 2 ASN C . . . . . . . . . c25520_2n0c 1 . 3 . 311 . 1 1 2 ASN CA C -6.152 2.301 4.005 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CA . . . . . . . . . c25520_2n0c 1 . 3 . 312 . 1 1 2 ASN CB C -5.039 2.647 4.996 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CB . . . . . . . . . c25520_2n0c 1 . 3 . 313 . 1 1 2 ASN CG C -5.579 3.207 6.298 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CG . . . . . . . . . c25520_2n0c 1 . 3 . 314 . 1 1 2 ASN H H -6.131 0.249 4.638 . . . 1.0 . . . . . . . . . . . . A . 2 ASN H . . . . . . . . . c25520_2n0c 1 . 3 . 315 . 1 1 2 ASN HA H -6.920 3.076 4.070 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HA . . . . . . . . . c25520_2n0c 1 . 3 . 316 . 1 1 2 ASN HB2 H -4.467 1.745 5.206 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HB2 . . . . . . . . . c25520_2n0c 1 . 3 . 317 . 1 1 2 ASN HB3 H -4.375 3.392 4.551 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HB3 . . . . . . . . . c25520_2n0c 1 . 3 . 318 . 1 1 2 ASN HD21 H -4.548 1.802 7.371 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HD21 . . . . . . . . . c25520_2n0c 1 . 3 . 319 . 1 1 2 ASN HD22 H -5.528 2.934 8.312 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HD22 . . . . . . . . . c25520_2n0c 1 . 3 . 320 . 1 1 2 ASN N N -6.741 1.009 4.337 . . . 1.0 . . . . . . . . . . . . A . 2 ASN N . . . . . . . . . c25520_2n0c 1 . 3 . 321 . 1 1 2 ASN ND2 N -5.186 2.598 7.411 . . . 1.0 . . . . . . . . . . . . A . 2 ASN ND2 . . . . . . . . . c25520_2n0c 1 . 3 . 322 . 1 1 2 ASN O O -5.700 1.298 1.868 . . . 1.0 . . . . . . . . . . . . A . 2 ASN O . . . . . . . . . c25520_2n0c 1 . 3 . 323 . 1 1 2 ASN OD1 O -6.338 4.176 6.303 . . . 1.0 . . . . . . . . . . . . A . 2 ASN OD1 . . . . . . . . . c25520_2n0c 1 . 3 . 324 . 1 1 3 HIS C C -3.037 4.136 0.905 . . . 1.0 . . . . . . . . . . . . A . 3 HIS C . . . . . . . . . c25520_2n0c 1 . 3 . 325 . 1 1 3 HIS CA C -4.442 3.545 0.842 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CA . . . . . . . . . c25520_2n0c 1 . 3 . 326 . 1 1 3 HIS CB C -5.336 4.417 -0.037 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CB . . . . . . . . . c25520_2n0c 1 . 3 . 327 . 1 1 3 HIS CD2 C -4.416 3.244 -2.164 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CD2 . . . . . . . . . c25520_2n0c 1 . 3 . 328 . 1 1 3 HIS CE1 C -5.737 4.196 -3.627 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CE1 . . . . . . . . . c25520_2n0c 1 . 3 . 329 . 1 1 3 HIS CG C -5.247 4.099 -1.505 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CG . . . . . . . . . c25520_2n0c 1 . 3 . 330 . 1 1 3 HIS H H -4.960 4.212 2.816 . . . 1.0 . . . . . . . . . . . . A . 3 HIS H . . . . . . . . . c25520_2n0c 1 . 3 . 331 . 1 1 3 HIS HA H -4.372 2.555 0.386 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HA . . . . . . . . . c25520_2n0c 1 . 3 . 332 . 1 1 3 HIS HB2 H -6.368 4.269 0.277 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HB2 . . . . . . . . . c25520_2n0c 1 . 3 . 333 . 1 1 3 HIS HB3 H -5.075 5.468 0.113 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HB3 . . . . . . . . . c25520_2n0c 1 . 3 . 334 . 1 1 3 HIS HD1 H -6.805 5.378 -2.264 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HD1 . . . . . . . . . c25520_2n0c 1 . 3 . 335 . 1 1 3 HIS HD2 H -3.493 2.845 -1.774 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HD2 . . . . . . . . . c25520_2n0c 1 . 3 . 336 . 1 1 3 HIS HE1 H -6.208 4.470 -4.559 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HE1 . . . . . . . . . c25520_2n0c 1 . 3 . 337 . 1 1 3 HIS N N -5.012 3.419 2.178 . . . 1.0 . . . . . . . . . . . . A . 3 HIS N . . . . . . . . . c25520_2n0c 1 . 3 . 338 . 1 1 3 HIS ND1 N -6.074 4.691 -2.445 . . . 1.0 . . . . . . . . . . . . A . 3 HIS ND1 . . . . . . . . . c25520_2n0c 1 . 3 . 339 . 1 1 3 HIS NE2 N -4.739 3.317 -3.507 . . . 1.0 . . . . . . . . . . . . A . 3 HIS NE2 . . . . . . . . . c25520_2n0c 1 . 3 . 340 . 1 1 3 HIS O O -2.592 4.804 -0.028 . . . 1.0 . . . . . . . . . . . . A . 3 HIS O . . . . . . . . . c25520_2n0c 1 . 3 . 341 . 1 1 4 TRP C C -0.009 3.674 1.275 . . . 1.0 . . . . . . . . . . . . A . 4 TRP C . . . . . . . . . c25520_2n0c 1 . 3 . 342 . 1 1 4 TRP CA C -0.990 4.394 2.194 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CA . . . . . . . . . c25520_2n0c 1 . 3 . 343 . 1 1 4 TRP CB C -0.555 4.231 3.652 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CB . . . . . . . . . c25520_2n0c 1 . 3 . 344 . 1 1 4 TRP CD1 C -0.675 5.950 5.548 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CD1 . . . . . . . . . c25520_2n0c 1 . 3 . 345 . 1 1 4 TRP CD2 C 0.592 6.581 3.812 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CD2 . . . . . . . . . c25520_2n0c 1 . 3 . 346 . 1 1 4 TRP CE2 C 0.610 7.606 4.778 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CE2 . . . . . . . . . c25520_2n0c 1 . 3 . 347 . 1 1 4 TRP CE3 C 1.320 6.754 2.632 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CE3 . . . . . . . . . c25520_2n0c 1 . 3 . 348 . 1 1 4 TRP CG C -0.235 5.531 4.325 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CG . . . . . . . . . c25520_2n0c 1 . 3 . 349 . 1 1 4 TRP CH2 C 2.030 8.929 3.433 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CH2 . . . . . . . . . c25520_2n0c 1 . 3 . 350 . 1 1 4 TRP CZ2 C 1.326 8.786 4.597 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CZ2 . . . . . . . . . c25520_2n0c 1 . 3 . 351 . 1 1 4 TRP CZ3 C 2.031 7.925 2.454 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CZ3 . . . . . . . . . c25520_2n0c 1 . 3 . 352 . 1 1 4 TRP H H -2.768 3.321 2.747 . . . 1.0 . . . . . . . . . . . . A . 4 TRP H . . . . . . . . . c25520_2n0c 1 . 3 . 353 . 1 1 4 TRP HA H -0.987 5.453 1.935 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HA . . . . . . . . . c25520_2n0c 1 . 3 . 354 . 1 1 4 TRP HB2 H -1.370 3.764 4.203 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HB2 . . . . . . . . . c25520_2n0c 1 . 3 . 355 . 1 1 4 TRP HB3 H 0.322 3.579 3.718 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HB3 . . . . . . . . . c25520_2n0c 1 . 3 . 356 . 1 1 4 TRP HD1 H -1.324 5.383 6.200 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HD1 . . . . . . . . . c25520_2n0c 1 . 3 . 357 . 1 1 4 TRP HE1 H -0.344 7.741 6.674 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HE1 . . . . . . . . . c25520_2n0c 1 . 3 . 358 . 1 1 4 TRP HE3 H 1.326 5.983 1.876 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HE3 . . . . . . . . . c25520_2n0c 1 . 3 . 359 . 1 1 4 TRP HH2 H 2.596 9.834 3.267 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HH2 . . . . . . . . . c25520_2n0c 1 . 3 . 360 . 1 1 4 TRP HZ2 H 1.327 9.562 5.349 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HZ2 . . . . . . . . . c25520_2n0c 1 . 3 . 361 . 1 1 4 TRP HZ3 H 2.595 8.063 1.544 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HZ3 . . . . . . . . . c25520_2n0c 1 . 3 . 362 . 1 1 4 TRP N N -2.344 3.885 2.010 . . . 1.0 . . . . . . . . . . . . A . 4 TRP N . . . . . . . . . c25520_2n0c 1 . 3 . 363 . 1 1 4 TRP NE1 N -0.172 7.197 5.827 . . . 1.0 . . . . . . . . . . . . A . 4 TRP NE1 . . . . . . . . . c25520_2n0c 1 . 3 . 364 . 1 1 4 TRP O O 0.555 4.276 0.361 . . . 1.0 . . . . . . . . . . . . A . 4 TRP O . . . . . . . . . c25520_2n0c 1 . 3 . 365 . 1 1 5 ALA C C 0.490 0.228 0.377 . . . 1.0 . . . . . . . . . . . . A . 5 ALA C . . . . . . . . . c25520_2n0c 1 . 3 . 366 . 1 1 5 ALA CA C 1.102 1.583 0.715 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CA . . . . . . . . . c25520_2n0c 1 . 3 . 367 . 1 1 5 ALA CB C 2.427 1.399 1.440 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CB . . . . . . . . . c25520_2n0c 1 . 3 . 368 . 1 1 5 ALA H H -0.305 1.941 2.297 . . . 1.0 . . . . . . . . . . . . A . 5 ALA H . . . . . . . . . c25520_2n0c 1 . 3 . 369 . 1 1 5 ALA HA H 1.303 2.101 -0.226 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HA . . . . . . . . . c25520_2n0c 1 . 3 . 370 . 1 1 5 ALA HB1 H 3.058 0.707 0.881 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB1 . . . . . . . . . c25520_2n0c 1 . 3 . 371 . 1 1 5 ALA HB2 H 2.238 0.996 2.435 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB2 . . . . . . . . . c25520_2n0c 1 . 3 . 372 . 1 1 5 ALA HB3 H 2.933 2.360 1.526 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB3 . . . . . . . . . c25520_2n0c 1 . 3 . 373 . 1 1 5 ALA N N 0.190 2.383 1.522 . . . 1.0 . . . . . . . . . . . . A . 5 ALA N . . . . . . . . . c25520_2n0c 1 . 3 . 374 . 1 1 5 ALA O O 0.286 -0.609 1.256 . . . 1.0 . . . . . . . . . . . . A . 5 ALA O . . . . . . . . . c25520_2n0c 1 . 3 . 375 . 1 1 6 VAL C C 0.563 -1.992 -2.272 . . . 1.0 . . . . . . . . . . . . A . 6 VAL C . . . . . . . . . c25520_2n0c 1 . 3 . 376 . 1 1 6 VAL CA C -0.393 -1.237 -1.358 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CA . . . . . . . . . c25520_2n0c 1 . 3 . 377 . 1 1 6 VAL CB C -1.718 -0.996 -2.101 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CB . . . . . . . . . c25520_2n0c 1 . 3 . 378 . 1 1 6 VAL CG1 C -1.479 -0.196 -3.373 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CG1 . . . . . . . . . c25520_2n0c 1 . 3 . 379 . 1 1 6 VAL CG2 C -2.401 -2.318 -2.414 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CG2 . . . . . . . . . c25520_2n0c 1 . 3 . 380 . 1 1 6 VAL H H 0.390 0.752 -1.585 . . . 1.0 . . . . . . . . . . . . A . 6 VAL H . . . . . . . . . c25520_2n0c 1 . 3 . 381 . 1 1 6 VAL HA H -0.604 -1.876 -0.497 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HA . . . . . . . . . c25520_2n0c 1 . 3 . 382 . 1 1 6 VAL HB H -2.372 -0.414 -1.452 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HB . . . . . . . . . c25520_2n0c 1 . 3 . 383 . 1 1 6 VAL HG11 H -0.981 -0.833 -4.104 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG11 . . . . . . . . . c25520_2n0c 1 . 3 . 384 . 1 1 6 VAL HG12 H -0.849 0.665 -3.152 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG12 . . . . . . . . . c25520_2n0c 1 . 3 . 385 . 1 1 6 VAL HG13 H -2.431 0.144 -3.778 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG13 . . . . . . . . . c25520_2n0c 1 . 3 . 386 . 1 1 6 VAL HG21 H -1.805 -2.861 -3.149 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG21 . . . . . . . . . c25520_2n0c 1 . 3 . 387 . 1 1 6 VAL HG22 H -3.395 -2.131 -2.820 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG22 . . . . . . . . . c25520_2n0c 1 . 3 . 388 . 1 1 6 VAL HG23 H -2.486 -2.913 -1.505 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG23 . . . . . . . . . c25520_2n0c 1 . 3 . 389 . 1 1 6 VAL N N 0.197 0.019 -0.903 . . . 1.0 . . . . . . . . . . . . A . 6 VAL N . . . . . . . . . c25520_2n0c 1 . 3 . 390 . 1 1 6 VAL O O 1.334 -1.388 -3.018 . . . 1.0 . . . . . . . . . . . . A . 6 VAL O . . . . . . . . . c25520_2n0c 1 . 3 . 391 . 1 1 7 GLY C C 2.520 -4.743 -2.263 . . . 1.0 . . . . . . . . . . . . A . 7 GLY C . . . . . . . . . c25520_2n0c 1 . 3 . 392 . 1 1 7 GLY CA C 1.370 -4.136 -3.045 . . . 1.0 . . . . . . . . . . . . A . 7 GLY CA . . . . . . . . . c25520_2n0c 1 . 3 . 393 . 1 1 7 GLY H H -0.154 -3.766 -1.579 . . . 1.0 . . . . . . . . . . . . A . 7 GLY H . . . . . . . . . c25520_2n0c 1 . 3 . 394 . 1 1 7 GLY HA2 H 0.774 -4.948 -3.461 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA2 . . . . . . . . . c25520_2n0c 1 . 3 . 395 . 1 1 7 GLY HA3 H 1.776 -3.544 -3.871 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA3 . . . . . . . . . c25520_2n0c 1 . 3 . 396 . 1 1 7 GLY N N 0.506 -3.319 -2.215 . . . 1.0 . . . . . . . . . . . . A . 7 GLY N . . . . . . . . . c25520_2n0c 1 . 3 . 397 . 1 1 7 GLY O O 3.628 -4.207 -2.259 . . . 1.0 . . . . . . . . . . . . A . 7 GLY O . . . . . . . . . c25520_2n0c 1 . 3 . 398 . 1 1 8 HIS C C 3.615 -7.901 -1.413 . . . 1.0 . . . . . . . . . . . . A . 8 HIS C . . . . . . . . . c25520_2n0c 1 . 3 . 399 . 1 1 8 HIS CA C 3.276 -6.543 -0.808 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CA . . . . . . . . . c25520_2n0c 1 . 3 . 400 . 1 1 8 HIS CB C 2.799 -6.718 0.635 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CB . . . . . . . . . c25520_2n0c 1 . 3 . 401 . 1 1 8 HIS CD2 C 1.372 -5.204 2.189 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CD2 . . . . . . . . . c25520_2n0c 1 . 3 . 402 . 1 1 8 HIS CE1 C 2.338 -3.296 1.716 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CE1 . . . . . . . . . c25520_2n0c 1 . 3 . 403 . 1 1 8 HIS CG C 2.359 -5.432 1.276 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CG . . . . . . . . . c25520_2n0c 1 . 3 . 404 . 1 1 8 HIS H H 1.316 -6.259 -1.642 . . . 1.0 . . . . . . . . . . . . A . 8 HIS H . . . . . . . . . c25520_2n0c 1 . 3 . 405 . 1 1 8 HIS HA H 4.190 -5.944 -0.786 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HA . . . . . . . . . c25520_2n0c 1 . 3 . 406 . 1 1 8 HIS HB2 H 1.962 -7.414 0.639 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HB2 . . . . . . . . . c25520_2n0c 1 . 3 . 407 . 1 1 8 HIS HB3 H 3.613 -7.144 1.224 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HB3 . . . . . . . . . c25520_2n0c 1 . 3 . 408 . 1 1 8 HIS HD1 H 3.728 -4.056 0.342 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HD1 . . . . . . . . . c25520_2n0c 1 . 3 . 409 . 1 1 8 HIS HD2 H 0.588 -5.896 2.455 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HD2 . . . . . . . . . c25520_2n0c 1 . 3 . 410 . 1 1 8 HIS HE1 H 2.586 -2.245 1.710 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HE1 . . . . . . . . . c25520_2n0c 1 . 3 . 411 . 1 1 8 HIS N N 2.255 -5.863 -1.598 . . . 1.0 . . . . . . . . . . . . A . 8 HIS N . . . . . . . . . c25520_2n0c 1 . 3 . 412 . 1 1 8 HIS ND1 N 2.957 -4.216 0.990 . . . 1.0 . . . . . . . . . . . . A . 8 HIS ND1 . . . . . . . . . c25520_2n0c 1 . 3 . 413 . 1 1 8 HIS NE2 N 1.372 -3.846 2.457 . . . 1.0 . . . . . . . . . . . . A . 8 HIS NE2 . . . . . . . . . c25520_2n0c 1 . 3 . 414 . 1 1 8 HIS O O 3.609 -8.921 -0.721 . . . 1.0 . . . . . . . . . . . . A . 8 HIS O . . . . . . . . . c25520_2n0c 1 . 3 . 415 . 1 1 9 LEU C C 5.711 -9.518 -3.171 . . . 1.0 . . . . . . . . . . . . A . 9 LEU C . . . . . . . . . c25520_2n0c 1 . 3 . 416 . 1 1 9 LEU CA C 4.252 -9.145 -3.408 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CA . . . . . . . . . c25520_2n0c 1 . 3 . 417 . 1 1 9 LEU CB C 3.988 -8.994 -4.907 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CB . . . . . . . . . c25520_2n0c 1 . 3 . 418 . 1 1 9 LEU CD1 C 2.194 -10.735 -5.079 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD1 . . . . . . . . . c25520_2n0c 1 . 3 . 419 . 1 1 9 LEU CD2 C 1.576 -8.341 -4.702 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD2 . . . . . . . . . c25520_2n0c 1 . 3 . 420 . 1 1 9 LEU CG C 2.561 -9.289 -5.371 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CG . . . . . . . . . c25520_2n0c 1 . 3 . 421 . 1 1 9 LEU H H 3.899 -7.033 -3.228 . . . 1.0 . . . . . . . . . . . . A . 9 LEU H . . . . . . . . . c25520_2n0c 1 . 3 . 422 . 1 1 9 LEU HA H 3.628 -9.948 -3.029 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HA . . . . . . . . . c25520_2n0c 1 . 3 . 423 . 1 1 9 LEU HB2 H 4.220 -7.968 -5.183 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB2 . . . . . . . . . c25520_2n0c 1 . 3 . 424 . 1 1 9 LEU HB3 H 4.663 -9.657 -5.457 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB3 . . . . . . . . . c25520_2n0c 1 . 3 . 425 . 1 1 9 LEU HD11 H 1.776 -10.824 -4.074 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD11 . . . . . . . . . c25520_2n0c 1 . 3 . 426 . 1 1 9 LEU HD12 H 3.078 -11.370 -5.159 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD12 . . . . . . . . . c25520_2n0c 1 . 3 . 427 . 1 1 9 LEU HD13 H 1.448 -11.073 -5.802 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD13 . . . . . . . . . c25520_2n0c 1 . 3 . 428 . 1 1 9 LEU HD21 H 1.590 -8.508 -3.625 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD21 . . . . . . . . . c25520_2n0c 1 . 3 . 429 . 1 1 9 LEU HD22 H 0.572 -8.526 -5.086 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD22 . . . . . . . . . c25520_2n0c 1 . 3 . 430 . 1 1 9 LEU HD23 H 1.862 -7.311 -4.913 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD23 . . . . . . . . . c25520_2n0c 1 . 3 . 431 . 1 1 9 LEU HG H 2.510 -9.130 -6.451 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HG . . . . . . . . . c25520_2n0c 1 . 3 . 432 . 1 1 9 LEU N N 3.910 -7.911 -2.709 . . . 1.0 . . . . . . . . . . . . A . 9 LEU N . . . . . . . . . c25520_2n0c 1 . 3 . 433 . 1 1 9 LEU O O 6.614 -8.719 -3.418 . . . 1.0 . . . . . . . . . . . . A . 9 LEU O . . . . . . . . . c25520_2n0c 1 . 3 . 434 . 1 1 10 MET C C 8.097 -11.300 -3.715 . . . 1.0 . . . . . . . . . . . . A . 10 MET C . . . . . . . . . c25520_2n0c 1 . 3 . 435 . 1 1 10 MET CA C 7.286 -11.219 -2.426 . . . 1.0 . . . . . . . . . . . . A . 10 MET CA . . . . . . . . . c25520_2n0c 1 . 3 . 436 . 1 1 10 MET CB C 7.237 -12.591 -1.751 . . . 1.0 . . . . . . . . . . . . A . 10 MET CB . . . . . . . . . c25520_2n0c 1 . 3 . 437 . 1 1 10 MET CE C 7.208 -14.127 -5.227 . . . 1.0 . . . . . . . . . . . . A . 10 MET CE . . . . . . . . . c25520_2n0c 1 . 3 . 438 . 1 1 10 MET CG C 6.532 -13.652 -2.582 . . . 1.0 . . . . . . . . . . . . A . 10 MET CG . . . . . . . . . c25520_2n0c 1 . 3 . 439 . 1 1 10 MET H H 5.143 -11.356 -2.513 . . . 1.0 . . . . . . . . . . . . A . 10 MET H . . . . . . . . . c25520_2n0c 1 . 3 . 440 . 1 1 10 MET HA H 7.775 -10.515 -1.754 . . . 1.0 . . . . . . . . . . . . A . 10 MET HA . . . . . . . . . c25520_2n0c 1 . 3 . 441 . 1 1 10 MET HB2 H 8.259 -12.922 -1.568 . . . 1.0 . . . . . . . . . . . . A . 10 MET HB2 . . . . . . . . . c25520_2n0c 1 . 3 . 442 . 1 1 10 MET HB3 H 6.727 -12.483 -0.790 . . . 1.0 . . . . . . . . . . . . A . 10 MET HB3 . . . . . . . . . c25520_2n0c 1 . 3 . 443 . 1 1 10 MET HE1 H 7.660 -14.805 -5.951 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE1 . . . . . . . . . c25520_2n0c 1 . 3 . 444 . 1 1 10 MET HE2 H 7.548 -13.117 -5.426 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE2 . . . . . . . . . c25520_2n0c 1 . 3 . 445 . 1 1 10 MET HE3 H 6.122 -14.172 -5.324 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE3 . . . . . . . . . c25520_2n0c 1 . 3 . 446 . 1 1 10 MET HG2 H 5.984 -14.328 -1.920 . . . 1.0 . . . . . . . . . . . . A . 10 MET HG2 . . . . . . . . . c25520_2n0c 1 . 3 . 447 . 1 1 10 MET HG3 H 5.818 -13.161 -3.244 . . . 1.0 . . . . . . . . . . . . A . 10 MET HG3 . . . . . . . . . c25520_2n0c 1 . 3 . 448 . 1 1 10 MET N N 5.934 -10.738 -2.692 . . . 1.0 . . . . . . . . . . . . A . 10 MET N . . . . . . . . . c25520_2n0c 1 . 3 . 449 . 1 1 10 MET O O 7.716 -10.648 -4.674 . . . 1.0 . . . . . . . . . . . . A . 10 MET O . . . . . . . . . c25520_2n0c 1 . 3 . 450 . 1 1 10 MET SD S 7.677 -14.630 -3.574 . . . 1.0 . . . . . . . . . . . . A . 10 MET SD . . . . . . . . . c25520_2n0c 1 . 4 . 451 . 1 1 1 GLY C C -7.536 5.224 0.161 . . . 1.0 . . . . . . . . . . . . A . 1 GLY C . . . . . . . . . c25520_2n0c 1 . 4 . 452 . 1 1 1 GLY CA C -8.018 6.330 -0.757 . . . 1.0 . . . . . . . . . . . . A . 1 GLY CA . . . . . . . . . c25520_2n0c 1 . 4 . 453 . 1 1 1 GLY H1 H -6.553 6.712 -2.135 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H1 . . . . . . . . . c25520_2n0c 1 . 4 . 454 . 1 1 1 GLY H2 H -6.177 7.199 -0.551 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H2 . . . . . . . . . c25520_2n0c 1 . 4 . 455 . 1 1 1 GLY H3 H -7.279 8.097 -1.483 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H3 . . . . . . . . . c25520_2n0c 1 . 4 . 456 . 1 1 1 GLY HA2 H -8.706 6.970 -0.205 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA2 . . . . . . . . . c25520_2n0c 1 . 4 . 457 . 1 1 1 GLY HA3 H -8.548 5.883 -1.599 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA3 . . . . . . . . . c25520_2n0c 1 . 4 . 458 . 1 1 1 GLY N N -6.930 7.142 -1.268 . . . 1.0 . . . . . . . . . . . . A . 1 GLY N . . . . . . . . . c25520_2n0c 1 . 4 . 459 . 1 1 1 GLY O O -7.780 4.047 -0.093 . . . 1.0 . . . . . . . . . . . . A . 1 GLY O . . . . . . . . . c25520_2n0c 1 . 4 . 460 . 1 1 2 ASN C C -5.492 3.572 1.488 . . . 1.0 . . . . . . . . . . . . A . 2 ASN C . . . . . . . . . c25520_2n0c 1 . 4 . 461 . 1 1 2 ASN CA C -6.326 4.638 2.190 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CA . . . . . . . . . c25520_2n0c 1 . 4 . 462 . 1 1 2 ASN CB C -7.476 3.979 2.956 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CB . . . . . . . . . c25520_2n0c 1 . 4 . 463 . 1 1 2 ASN CG C -8.606 4.947 3.250 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CG . . . . . . . . . c25520_2n0c 1 . 4 . 464 . 1 1 2 ASN H H -6.679 6.601 1.386 . . . 1.0 . . . . . . . . . . . . A . 2 ASN H . . . . . . . . . c25520_2n0c 1 . 4 . 465 . 1 1 2 ASN HA H -5.692 5.165 2.905 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HA . . . . . . . . . c25520_2n0c 1 . 4 . 466 . 1 1 2 ASN HB2 H -7.883 3.162 2.357 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HB2 . . . . . . . . . c25520_2n0c 1 . 4 . 467 . 1 1 2 ASN HB3 H -7.097 3.574 3.895 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HB3 . . . . . . . . . c25520_2n0c 1 . 4 . 468 . 1 1 2 ASN HD21 H -7.619 5.654 4.898 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HD21 . . . . . . . . . c25520_2n0c 1 . 4 . 469 . 1 1 2 ASN HD22 H -9.182 6.400 4.550 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HD22 . . . . . . . . . c25520_2n0c 1 . 4 . 470 . 1 1 2 ASN N N -6.847 5.606 1.232 . . . 1.0 . . . . . . . . . . . . A . 2 ASN N . . . . . . . . . c25520_2n0c 1 . 4 . 471 . 1 1 2 ASN ND2 N -8.454 5.726 4.316 . . . 1.0 . . . . . . . . . . . . A . 2 ASN ND2 . . . . . . . . . c25520_2n0c 1 . 4 . 472 . 1 1 2 ASN O O -5.595 2.384 1.796 . . . 1.0 . . . . . . . . . . . . A . 2 ASN O . . . . . . . . . c25520_2n0c 1 . 4 . 473 . 1 1 2 ASN OD1 O -9.601 4.994 2.528 . . . 1.0 . . . . . . . . . . . . A . 2 ASN OD1 . . . . . . . . . c25520_2n0c 1 . 4 . 474 . 1 1 3 HIS C C -2.335 3.428 0.004 . . . 1.0 . . . . . . . . . . . . A . 3 HIS C . . . . . . . . . c25520_2n0c 1 . 4 . 475 . 1 1 3 HIS CA C -3.808 3.087 -0.203 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CA . . . . . . . . . c25520_2n0c 1 . 4 . 476 . 1 1 3 HIS CB C -4.148 3.136 -1.693 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CB . . . . . . . . . c25520_2n0c 1 . 4 . 477 . 1 1 3 HIS CD2 C -2.635 1.434 -2.940 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CD2 . . . . . . . . . c25520_2n0c 1 . 4 . 478 . 1 1 3 HIS CE1 C -4.161 -0.082 -3.348 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CE1 . . . . . . . . . c25520_2n0c 1 . 4 . 479 . 1 1 3 HIS CG C -3.821 1.865 -2.428 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CG . . . . . . . . . c25520_2n0c 1 . 4 . 480 . 1 1 3 HIS H H -4.622 5.002 0.333 . . . 1.0 . . . . . . . . . . . . A . 3 HIS H . . . . . . . . . c25520_2n0c 1 . 4 . 481 . 1 1 3 HIS HA H -3.970 2.065 0.151 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HA . . . . . . . . . c25520_2n0c 1 . 4 . 482 . 1 1 3 HIS HB2 H -5.217 3.316 -1.791 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HB2 . . . . . . . . . c25520_2n0c 1 . 4 . 483 . 1 1 3 HIS HB3 H -3.611 3.966 -2.159 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HB3 . . . . . . . . . c25520_2n0c 1 . 4 . 484 . 1 1 3 HIS HD1 H -5.761 0.926 -2.439 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HD1 . . . . . . . . . c25520_2n0c 1 . 4 . 485 . 1 1 3 HIS HD2 H -1.754 2.042 -3.086 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HD2 . . . . . . . . . c25520_2n0c 1 . 4 . 486 . 1 1 3 HIS HE1 H -4.646 -0.982 -3.694 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HE1 . . . . . . . . . c25520_2n0c 1 . 4 . 487 . 1 1 3 HIS N N -4.663 4.005 0.543 . . . 1.0 . . . . . . . . . . . . A . 3 HIS N . . . . . . . . . c25520_2n0c 1 . 4 . 488 . 1 1 3 HIS ND1 N -4.773 0.894 -2.695 . . . 1.0 . . . . . . . . . . . . A . 3 HIS ND1 . . . . . . . . . c25520_2n0c 1 . 4 . 489 . 1 1 3 HIS NE2 N -2.866 0.199 -3.520 . . . 1.0 . . . . . . . . . . . . A . 3 HIS NE2 . . . . . . . . . c25520_2n0c 1 . 4 . 490 . 1 1 3 HIS O O -1.513 3.237 -0.891 . . . 1.0 . . . . . . . . . . . . A . 3 HIS O . . . . . . . . . c25520_2n0c 1 . 4 . 491 . 1 1 4 TRP C C 0.313 3.137 1.252 . . . 1.0 . . . . . . . . . . . . A . 4 TRP C . . . . . . . . . c25520_2n0c 1 . 4 . 492 . 1 1 4 TRP CA C -0.638 4.300 1.513 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CA . . . . . . . . . c25520_2n0c 1 . 4 . 493 . 1 1 4 TRP CB C -0.536 4.739 2.975 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CB . . . . . . . . . c25520_2n0c 1 . 4 . 494 . 1 1 4 TRP CD1 C -1.350 6.980 3.912 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CD1 . . . . . . . . . c25520_2n0c 1 . 4 . 495 . 1 1 4 TRP CD2 C 0.412 7.143 2.540 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CD2 . . . . . . . . . c25520_2n0c 1 . 4 . 496 . 1 1 4 TRP CE2 C 0.066 8.435 2.982 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CE2 . . . . . . . . . c25520_2n0c 1 . 4 . 497 . 1 1 4 TRP CE3 C 1.493 6.997 1.667 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CE3 . . . . . . . . . c25520_2n0c 1 . 4 . 498 . 1 1 4 TRP CG C -0.506 6.228 3.147 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CG . . . . . . . . . c25520_2n0c 1 . 4 . 499 . 1 1 4 TRP CH2 C 1.817 9.398 1.724 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CH2 . . . . . . . . . c25520_2n0c 1 . 4 . 500 . 1 1 4 TRP CZ2 C 0.764 9.571 2.579 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CZ2 . . . . . . . . . c25520_2n0c 1 . 4 . 501 . 1 1 4 TRP CZ3 C 2.184 8.125 1.267 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CZ3 . . . . . . . . . c25520_2n0c 1 . 4 . 502 . 1 1 4 TRP H H -2.740 4.063 1.892 . . . 1.0 . . . . . . . . . . . . A . 4 TRP H . . . . . . . . . c25520_2n0c 1 . 4 . 503 . 1 1 4 TRP HA H -0.347 5.131 0.871 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HA . . . . . . . . . c25520_2n0c 1 . 4 . 504 . 1 1 4 TRP HB2 H -1.405 4.356 3.507 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HB2 . . . . . . . . . c25520_2n0c 1 . 4 . 505 . 1 1 4 TRP HB3 H 0.365 4.319 3.434 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HB3 . . . . . . . . . c25520_2n0c 1 . 4 . 506 . 1 1 4 TRP HD1 H -2.164 6.589 4.505 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HD1 . . . . . . . . . c25520_2n0c 1 . 4 . 507 . 1 1 4 TRP HE1 H -1.479 9.085 4.287 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HE1 . . . . . . . . . c25520_2n0c 1 . 4 . 508 . 1 1 4 TRP HE3 H 1.784 6.019 1.315 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HE3 . . . . . . . . . c25520_2n0c 1 . 4 . 509 . 1 1 4 TRP HH2 H 2.376 10.262 1.396 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HH2 . . . . . . . . . c25520_2n0c 1 . 4 . 510 . 1 1 4 TRP HZ2 H 0.482 10.553 2.927 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HZ2 . . . . . . . . . c25520_2n0c 1 . 4 . 511 . 1 1 4 TRP HZ3 H 3.020 8.018 0.592 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HZ3 . . . . . . . . . c25520_2n0c 1 . 4 . 512 . 1 1 4 TRP N N -2.011 3.933 1.189 . . . 1.0 . . . . . . . . . . . . A . 4 TRP N . . . . . . . . . c25520_2n0c 1 . 4 . 513 . 1 1 4 TRP NE1 N -1.012 8.309 3.817 . . . 1.0 . . . . . . . . . . . . A . 4 TRP NE1 . . . . . . . . . c25520_2n0c 1 . 4 . 514 . 1 1 4 TRP O O 1.083 3.156 0.291 . . . 1.0 . . . . . . . . . . . . A . 4 TRP O . . . . . . . . . c25520_2n0c 1 . 4 . 515 . 1 1 5 ALA C C 0.282 -0.302 1.721 . . . 1.0 . . . . . . . . . . . . A . 5 ALA C . . . . . . . . . c25520_2n0c 1 . 4 . 516 . 1 1 5 ALA CA C 1.110 0.953 1.971 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CA . . . . . . . . . c25520_2n0c 1 . 4 . 517 . 1 1 5 ALA CB C 1.975 0.780 3.211 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CB . . . . . . . . . c25520_2n0c 1 . 4 . 518 . 1 1 5 ALA H H -0.402 2.171 2.890 . . . 1.0 . . . . . . . . . . . . A . 5 ALA H . . . . . . . . . c25520_2n0c 1 . 4 . 519 . 1 1 5 ALA HA H 1.779 1.085 1.117 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HA . . . . . . . . . c25520_2n0c 1 . 4 . 520 . 1 1 5 ALA HB1 H 2.532 -0.154 3.143 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB1 . . . . . . . . . c25520_2n0c 1 . 4 . 521 . 1 1 5 ALA HB2 H 1.334 0.758 4.093 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB2 . . . . . . . . . c25520_2n0c 1 . 4 . 522 . 1 1 5 ALA HB3 H 2.673 1.613 3.290 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB3 . . . . . . . . . c25520_2n0c 1 . 4 . 523 . 1 1 5 ALA N N 0.255 2.126 2.111 . . . 1.0 . . . . . . . . . . . . A . 5 ALA N . . . . . . . . . c25520_2n0c 1 . 4 . 524 . 1 1 5 ALA O O -0.095 -1.007 2.658 . . . 1.0 . . . . . . . . . . . . A . 5 ALA O . . . . . . . . . c25520_2n0c 1 . 4 . 525 . 1 1 6 VAL C C -0.364 -2.276 -1.290 . . . 1.0 . . . . . . . . . . . . A . 6 VAL C . . . . . . . . . c25520_2n0c 1 . 4 . 526 . 1 1 6 VAL CA C -0.782 -1.750 0.076 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CA . . . . . . . . . c25520_2n0c 1 . 4 . 527 . 1 1 6 VAL CB C -2.289 -1.433 0.056 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CB . . . . . . . . . c25520_2n0c 1 . 4 . 528 . 1 1 6 VAL CG1 C -3.086 -2.661 -0.357 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CG1 . . . . . . . . . c25520_2n0c 1 . 4 . 529 . 1 1 6 VAL CG2 C -2.745 -0.922 1.413 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CG2 . . . . . . . . . c25520_2n0c 1 . 4 . 530 . 1 1 6 VAL H H 0.347 0.043 -0.282 . . . 1.0 . . . . . . . . . . . . A . 6 VAL H . . . . . . . . . c25520_2n0c 1 . 4 . 531 . 1 1 6 VAL HA H -0.618 -2.541 0.812 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HA . . . . . . . . . c25520_2n0c 1 . 4 . 532 . 1 1 6 VAL HB H -2.462 -0.649 -0.684 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HB . . . . . . . . . c25520_2n0c 1 . 4 . 533 . 1 1 6 VAL HG11 H -4.149 -2.481 -0.201 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG11 . . . . . . . . . c25520_2n0c 1 . 4 . 534 . 1 1 6 VAL HG12 H -2.770 -3.510 0.250 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG12 . . . . . . . . . c25520_2n0c 1 . 4 . 535 . 1 1 6 VAL HG13 H -2.911 -2.883 -1.410 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG13 . . . . . . . . . c25520_2n0c 1 . 4 . 536 . 1 1 6 VAL HG21 H -2.406 -1.614 2.184 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG21 . . . . . . . . . c25520_2n0c 1 . 4 . 537 . 1 1 6 VAL HG22 H -3.833 -0.854 1.438 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG22 . . . . . . . . . c25520_2n0c 1 . 4 . 538 . 1 1 6 VAL HG23 H -2.320 0.065 1.597 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG23 . . . . . . . . . c25520_2n0c 1 . 4 . 539 . 1 1 6 VAL N N 0.002 -0.577 0.451 . . . 1.0 . . . . . . . . . . . . A . 6 VAL N . . . . . . . . . c25520_2n0c 1 . 4 . 540 . 1 1 6 VAL O O -0.240 -1.515 -2.250 . . . 1.0 . . . . . . . . . . . . A . 6 VAL O . . . . . . . . . c25520_2n0c 1 . 4 . 541 . 1 1 7 GLY C C 1.758 -4.225 -2.803 . . . 1.0 . . . . . . . . . . . . A . 7 GLY C . . . . . . . . . c25520_2n0c 1 . 4 . 542 . 1 1 7 GLY CA C 0.253 -4.192 -2.630 . . . 1.0 . . . . . . . . . . . . A . 7 GLY CA . . . . . . . . . c25520_2n0c 1 . 4 . 543 . 1 1 7 GLY H H -0.269 -4.168 -0.548 . . . 1.0 . . . . . . . . . . . . A . 7 GLY H . . . . . . . . . c25520_2n0c 1 . 4 . 544 . 1 1 7 GLY HA2 H -0.118 -5.216 -2.652 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA2 . . . . . . . . . c25520_2n0c 1 . 4 . 545 . 1 1 7 GLY HA3 H -0.188 -3.642 -3.465 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA3 . . . . . . . . . c25520_2n0c 1 . 4 . 546 . 1 1 7 GLY N N -0.148 -3.584 -1.375 . . . 1.0 . . . . . . . . . . . . A . 7 GLY N . . . . . . . . . c25520_2n0c 1 . 4 . 547 . 1 1 7 GLY O O 2.300 -3.587 -3.705 . . . 1.0 . . . . . . . . . . . . A . 7 GLY O . . . . . . . . . c25520_2n0c 1 . 4 . 548 . 1 1 8 HIS C C 4.308 -6.475 -2.457 . . . 1.0 . . . . . . . . . . . . A . 8 HIS C . . . . . . . . . c25520_2n0c 1 . 4 . 549 . 1 1 8 HIS CA C 3.889 -5.082 -1.995 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CA . . . . . . . . . c25520_2n0c 1 . 4 . 550 . 1 1 8 HIS CB C 4.501 -4.779 -0.628 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CB . . . . . . . . . c25520_2n0c 1 . 4 . 551 . 1 1 8 HIS CD2 C 3.404 -2.585 0.227 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CD2 . . . . . . . . . c25520_2n0c 1 . 4 . 552 . 1 1 8 HIS CE1 C 5.157 -1.285 0.051 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CE1 . . . . . . . . . c25520_2n0c 1 . 4 . 553 . 1 1 8 HIS CG C 4.445 -3.324 -0.251 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CG . . . . . . . . . c25520_2n0c 1 . 4 . 554 . 1 1 8 HIS H H 1.929 -5.477 -1.210 . . . 1.0 . . . . . . . . . . . . A . 8 HIS H . . . . . . . . . c25520_2n0c 1 . 4 . 555 . 1 1 8 HIS HA H 4.287 -4.353 -2.705 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HA . . . . . . . . . c25520_2n0c 1 . 4 . 556 . 1 1 8 HIS HB2 H 3.963 -5.352 0.125 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HB2 . . . . . . . . . c25520_2n0c 1 . 4 . 557 . 1 1 8 HIS HB3 H 5.548 -5.093 -0.628 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HB3 . . . . . . . . . c25520_2n0c 1 . 4 . 558 . 1 1 8 HIS HD1 H 6.475 -2.744 -0.680 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HD1 . . . . . . . . . c25520_2n0c 1 . 4 . 559 . 1 1 8 HIS HD2 H 2.366 -2.883 0.228 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HD2 . . . . . . . . . c25520_2n0c 1 . 4 . 560 . 1 1 8 HIS HE1 H 5.798 -0.417 0.086 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HE1 . . . . . . . . . c25520_2n0c 1 . 4 . 561 . 1 1 8 HIS N N 2.436 -4.970 -1.935 . . . 1.0 . . . . . . . . . . . . A . 8 HIS N . . . . . . . . . c25520_2n0c 1 . 4 . 562 . 1 1 8 HIS ND1 N 5.543 -2.486 -0.355 . . . 1.0 . . . . . . . . . . . . A . 8 HIS ND1 . . . . . . . . . c25520_2n0c 1 . 4 . 563 . 1 1 8 HIS NE2 N 3.871 -1.297 0.413 . . . 1.0 . . . . . . . . . . . . A . 8 HIS NE2 . . . . . . . . . c25520_2n0c 1 . 4 . 564 . 1 1 8 HIS O O 5.371 -6.971 -2.081 . . . 1.0 . . . . . . . . . . . . A . 8 HIS O . . . . . . . . . c25520_2n0c 1 . 4 . 565 . 1 1 9 LEU C C 3.836 -8.431 -5.305 . . . 1.0 . . . . . . . . . . . . A . 9 LEU C . . . . . . . . . c25520_2n0c 1 . 4 . 566 . 1 1 9 LEU CA C 3.748 -8.439 -3.782 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CA . . . . . . . . . c25520_2n0c 1 . 4 . 567 . 1 1 9 LEU CB C 2.665 -9.419 -3.327 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CB . . . . . . . . . c25520_2n0c 1 . 4 . 568 . 1 1 9 LEU CD1 C 3.942 -11.575 -3.265 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD1 . . . . . . . . . c25520_2n0c 1 . 4 . 569 . 1 1 9 LEU CD2 C 1.470 -11.599 -3.649 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD2 . . . . . . . . . c25520_2n0c 1 . 4 . 570 . 1 1 9 LEU CG C 2.766 -10.838 -3.887 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CG . . . . . . . . . c25520_2n0c 1 . 4 . 571 . 1 1 9 LEU H H 2.600 -6.637 -3.547 . . . 1.0 . . . . . . . . . . . . A . 9 LEU H . . . . . . . . . c25520_2n0c 1 . 4 . 572 . 1 1 9 LEU HA H 4.705 -8.791 -3.389 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HA . . . . . . . . . c25520_2n0c 1 . 4 . 573 . 1 1 9 LEU HB2 H 2.696 -9.483 -2.241 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB2 . . . . . . . . . c25520_2n0c 1 . 4 . 574 . 1 1 9 LEU HB3 H 1.700 -8.999 -3.619 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB3 . . . . . . . . . c25520_2n0c 1 . 4 . 575 . 1 1 9 LEU HD11 H 4.879 -11.141 -3.610 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD11 . . . . . . . . . c25520_2n0c 1 . 4 . 576 . 1 1 9 LEU HD12 H 3.903 -12.626 -3.551 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD12 . . . . . . . . . c25520_2n0c 1 . 4 . 577 . 1 1 9 LEU HD13 H 3.882 -11.494 -2.180 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD13 . . . . . . . . . c25520_2n0c 1 . 4 . 578 . 1 1 9 LEU HD21 H 1.298 -11.678 -2.575 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD21 . . . . . . . . . c25520_2n0c 1 . 4 . 579 . 1 1 9 LEU HD22 H 1.547 -12.598 -4.079 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD22 . . . . . . . . . c25520_2n0c 1 . 4 . 580 . 1 1 9 LEU HD23 H 0.639 -11.068 -4.112 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD23 . . . . . . . . . c25520_2n0c 1 . 4 . 581 . 1 1 9 LEU HG H 2.931 -10.783 -4.962 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HG . . . . . . . . . c25520_2n0c 1 . 4 . 582 . 1 1 9 LEU N N 3.465 -7.102 -3.270 . . . 1.0 . . . . . . . . . . . . A . 9 LEU N . . . . . . . . . c25520_2n0c 1 . 4 . 583 . 1 1 9 LEU O O 2.828 -8.573 -5.995 . . . 1.0 . . . . . . . . . . . . A . 9 LEU O . . . . . . . . . c25520_2n0c 1 . 4 . 584 . 1 1 10 MET C C 4.692 -9.494 -7.920 . . . 1.0 . . . . . . . . . . . . A . 10 MET C . . . . . . . . . c25520_2n0c 1 . 4 . 585 . 1 1 10 MET CA C 5.270 -8.246 -7.262 . . . 1.0 . . . . . . . . . . . . A . 10 MET CA . . . . . . . . . c25520_2n0c 1 . 4 . 586 . 1 1 10 MET CB C 6.765 -8.139 -7.570 . . . 1.0 . . . . . . . . . . . . A . 10 MET CB . . . . . . . . . c25520_2n0c 1 . 4 . 587 . 1 1 10 MET CE C 9.757 -7.053 -8.938 . . . 1.0 . . . . . . . . . . . . A . 10 MET CE . . . . . . . . . c25520_2n0c 1 . 4 . 588 . 1 1 10 MET CG C 7.063 -7.699 -8.993 . . . 1.0 . . . . . . . . . . . . A . 10 MET CG . . . . . . . . . c25520_2n0c 1 . 4 . 589 . 1 1 10 MET H H 5.848 -8.167 -5.194 . . . 1.0 . . . . . . . . . . . . A . 10 MET H . . . . . . . . . c25520_2n0c 1 . 4 . 590 . 1 1 10 MET HA H 4.774 -7.369 -7.679 . . . 1.0 . . . . . . . . . . . . A . 10 MET HA . . . . . . . . . c25520_2n0c 1 . 4 . 591 . 1 1 10 MET HB2 H 7.215 -7.428 -6.876 . . . 1.0 . . . . . . . . . . . . A . 10 MET HB2 . . . . . . . . . c25520_2n0c 1 . 4 . 592 . 1 1 10 MET HB3 H 7.223 -9.118 -7.413 . . . 1.0 . . . . . . . . . . . . A . 10 MET HB3 . . . . . . . . . c25520_2n0c 1 . 4 . 593 . 1 1 10 MET HE1 H 10.793 -7.352 -9.102 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE1 . . . . . . . . . c25520_2n0c 1 . 4 . 594 . 1 1 10 MET HE2 H 9.578 -6.934 -7.869 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE2 . . . . . . . . . c25520_2n0c 1 . 4 . 595 . 1 1 10 MET HE3 H 9.567 -6.107 -9.444 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE3 . . . . . . . . . c25520_2n0c 1 . 4 . 596 . 1 1 10 MET HG2 H 6.278 -8.072 -9.651 . . . 1.0 . . . . . . . . . . . . A . 10 MET HG2 . . . . . . . . . c25520_2n0c 1 . 4 . 597 . 1 1 10 MET HG3 H 7.068 -6.608 -9.032 . . . 1.0 . . . . . . . . . . . . A . 10 MET HG3 . . . . . . . . . c25520_2n0c 1 . 4 . 598 . 1 1 10 MET N N 5.050 -8.268 -5.821 . . . 1.0 . . . . . . . . . . . . A . 10 MET N . . . . . . . . . c25520_2n0c 1 . 4 . 599 . 1 1 10 MET O O 3.649 -9.384 -8.543 . . . 1.0 . . . . . . . . . . . . A . 10 MET O . . . . . . . . . c25520_2n0c 1 . 4 . 600 . 1 1 10 MET SD S 8.653 -8.303 -9.590 . . . 1.0 . . . . . . . . . . . . A . 10 MET SD . . . . . . . . . c25520_2n0c 1 . 5 . 601 . 1 1 1 GLY C C -4.864 7.679 1.662 . . . 1.0 . . . . . . . . . . . . A . 1 GLY C . . . . . . . . . c25520_2n0c 1 . 5 . 602 . 1 1 1 GLY CA C -4.351 8.835 0.825 . . . 1.0 . . . . . . . . . . . . A . 1 GLY CA . . . . . . . . . c25520_2n0c 1 . 5 . 603 . 1 1 1 GLY H1 H -4.656 8.596 -1.186 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H1 . . . . . . . . . c25520_2n0c 1 . 5 . 604 . 1 1 1 GLY H2 H -3.691 7.394 -0.471 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H2 . . . . . . . . . c25520_2n0c 1 . 5 . 605 . 1 1 1 GLY H3 H -3.054 8.943 -0.756 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H3 . . . . . . . . . c25520_2n0c 1 . 5 . 606 . 1 1 1 GLY HA2 H -3.517 9.305 1.345 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA2 . . . . . . . . . c25520_2n0c 1 . 5 . 607 . 1 1 1 GLY HA3 H -5.151 9.567 0.708 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA3 . . . . . . . . . c25520_2n0c 1 . 5 . 608 . 1 1 1 GLY N N -3.906 8.413 -0.490 . . . 1.0 . . . . . . . . . . . . A . 1 GLY N . . . . . . . . . c25520_2n0c 1 . 5 . 609 . 1 1 1 GLY O O -4.719 7.675 2.883 . . . 1.0 . . . . . . . . . . . . A . 1 GLY O . . . . . . . . . c25520_2n0c 1 . 5 . 610 . 1 1 2 ASN C C -5.177 4.285 1.387 . . . 1.0 . . . . . . . . . . . . A . 2 ASN C . . . . . . . . . c25520_2n0c 1 . 5 . 611 . 1 1 2 ASN CA C -6.004 5.528 1.694 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CA . . . . . . . . . c25520_2n0c 1 . 5 . 612 . 1 1 2 ASN CB C -7.462 5.298 1.290 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CB . . . . . . . . . c25520_2n0c 1 . 5 . 613 . 1 1 2 ASN CG C -8.426 6.155 2.087 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CG . . . . . . . . . c25520_2n0c 1 . 5 . 614 . 1 1 2 ASN H H -5.559 6.757 -0.012 . . . 1.0 . . . . . . . . . . . . A . 2 ASN H . . . . . . . . . c25520_2n0c 1 . 5 . 615 . 1 1 2 ASN HA H -5.973 5.693 2.775 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HA . . . . . . . . . c25520_2n0c 1 . 5 . 616 . 1 1 2 ASN HB2 H -7.573 5.533 0.232 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HB2 . . . . . . . . . c25520_2n0c 1 . 5 . 617 . 1 1 2 ASN HB3 H -7.726 4.249 1.450 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HB3 . . . . . . . . . c25520_2n0c 1 . 5 . 618 . 1 1 2 ASN HD21 H -7.436 7.855 1.524 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HD21 . . . . . . . . . c25520_2n0c 1 . 5 . 619 . 1 1 2 ASN HD22 H -8.829 8.083 2.588 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HD22 . . . . . . . . . c25520_2n0c 1 . 5 . 620 . 1 1 2 ASN N N -5.467 6.695 1.002 . . . 1.0 . . . . . . . . . . . . A . 2 ASN N . . . . . . . . . c25520_2n0c 1 . 5 . 621 . 1 1 2 ASN ND2 N -8.211 7.465 2.062 . . . 1.0 . . . . . . . . . . . . A . 2 ASN ND2 . . . . . . . . . c25520_2n0c 1 . 5 . 622 . 1 1 2 ASN O O -5.075 3.374 2.210 . . . 1.0 . . . . . . . . . . . . A . 2 ASN O . . . . . . . . . c25520_2n0c 1 . 5 . 623 . 1 1 2 ASN OD1 O -9.352 5.645 2.717 . . . 1.0 . . . . . . . . . . . . A . 2 ASN OD1 . . . . . . . . . c25520_2n0c 1 . 5 . 624 . 1 1 3 HIS C C -2.284 3.414 -0.002 . . . 1.0 . . . . . . . . . . . . A . 3 HIS C . . . . . . . . . c25520_2n0c 1 . 5 . 625 . 1 1 3 HIS CA C -3.765 3.120 -0.219 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CA . . . . . . . . . c25520_2n0c 1 . 5 . 626 . 1 1 3 HIS CB C -4.020 2.790 -1.691 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CB . . . . . . . . . c25520_2n0c 1 . 5 . 627 . 1 1 3 HIS CD2 C -2.757 4.378 -3.312 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CD2 . . . . . . . . . c25520_2n0c 1 . 5 . 628 . 1 1 3 HIS CE1 C -4.400 5.768 -3.710 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CE1 . . . . . . . . . c25520_2n0c 1 . 5 . 629 . 1 1 3 HIS CG C -3.850 3.969 -2.609 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CG . . . . . . . . . c25520_2n0c 1 . 5 . 630 . 1 1 3 HIS H H -4.709 5.037 -0.443 . . . 1.0 . . . . . . . . . . . . A . 3 HIS H . . . . . . . . . c25520_2n0c 1 . 5 . 631 . 1 1 3 HIS HA H -4.029 2.244 0.382 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HA . . . . . . . . . c25520_2n0c 1 . 5 . 632 . 1 1 3 HIS HB2 H -3.330 2.007 -2.000 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HB2 . . . . . . . . . c25520_2n0c 1 . 5 . 633 . 1 1 3 HIS HB3 H -5.040 2.417 -1.789 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HB3 . . . . . . . . . c25520_2n0c 1 . 5 . 634 . 1 1 3 HIS HD1 H -5.825 4.822 -2.496 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HD1 . . . . . . . . . c25520_2n0c 1 . 5 . 635 . 1 1 3 HIS HD2 H -1.746 4.028 -3.167 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HD2 . . . . . . . . . c25520_2n0c 1 . 5 . 636 . 1 1 3 HIS HE1 H -4.971 6.596 -4.102 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HE1 . . . . . . . . . c25520_2n0c 1 . 5 . 637 . 1 1 3 HIS N N -4.586 4.252 0.196 . . . 1.0 . . . . . . . . . . . . A . 3 HIS N . . . . . . . . . c25520_2n0c 1 . 5 . 638 . 1 1 3 HIS ND1 N -4.878 4.859 -2.873 . . . 1.0 . . . . . . . . . . . . A . 3 HIS ND1 . . . . . . . . . c25520_2n0c 1 . 5 . 639 . 1 1 3 HIS NE2 N -3.122 5.519 -4.004 . . . 1.0 . . . . . . . . . . . . A . 3 HIS NE2 . . . . . . . . . c25520_2n0c 1 . 5 . 640 . 1 1 3 HIS O O -1.459 3.182 -0.886 . . . 1.0 . . . . . . . . . . . . A . 3 HIS O . . . . . . . . . c25520_2n0c 1 . 5 . 641 . 1 1 4 TRP C C 0.343 3.057 1.264 . . . 1.0 . . . . . . . . . . . . A . 4 TRP C . . . . . . . . . c25520_2n0c 1 . 5 . 642 . 1 1 4 TRP CA C -0.573 4.251 1.511 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CA . . . . . . . . . c25520_2n0c 1 . 5 . 643 . 1 1 4 TRP CB C -0.469 4.696 2.971 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CB . . . . . . . . . c25520_2n0c 1 . 5 . 644 . 1 1 4 TRP CD1 C -1.339 6.924 3.891 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CD1 . . . . . . . . . c25520_2n0c 1 . 5 . 645 . 1 1 4 TRP CD2 C 0.436 7.117 2.540 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CD2 . . . . . . . . . c25520_2n0c 1 . 5 . 646 . 1 1 4 TRP CE2 C 0.059 8.403 2.974 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CE2 . . . . . . . . . c25520_2n0c 1 . 5 . 647 . 1 1 4 TRP CE3 C 1.531 6.990 1.680 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CE3 . . . . . . . . . c25520_2n0c 1 . 5 . 648 . 1 1 4 TRP CG C -0.472 6.186 3.138 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CG . . . . . . . . . c25520_2n0c 1 . 5 . 649 . 1 1 4 TRP CH2 C 1.806 9.398 1.734 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CH2 . . . . . . . . . c25520_2n0c 1 . 5 . 650 . 1 1 4 TRP CZ2 C 0.738 9.552 2.576 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CZ2 . . . . . . . . . c25520_2n0c 1 . 5 . 651 . 1 1 4 TRP CZ3 C 2.203 8.131 1.286 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CZ3 . . . . . . . . . c25520_2n0c 1 . 5 . 652 . 1 1 4 TRP H H -2.685 4.092 1.870 . . . 1.0 . . . . . . . . . . . . A . 4 TRP H . . . . . . . . . c25520_2n0c 1 . 5 . 653 . 1 1 4 TRP HA H -0.251 5.069 0.867 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HA . . . . . . . . . c25520_2n0c 1 . 5 . 654 . 1 1 4 TRP HB2 H -1.323 4.294 3.512 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HB2 . . . . . . . . . c25520_2n0c 1 . 5 . 655 . 1 1 4 TRP HB3 H 0.446 4.300 3.421 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HB3 . . . . . . . . . c25520_2n0c 1 . 5 . 656 . 1 1 4 TRP HD1 H -2.152 6.519 4.475 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HD1 . . . . . . . . . c25520_2n0c 1 . 5 . 657 . 1 1 4 TRP HE1 H -1.514 9.026 4.257 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HE1 . . . . . . . . . c25520_2n0c 1 . 5 . 658 . 1 1 4 TRP HE3 H 1.846 6.016 1.334 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HE3 . . . . . . . . . c25520_2n0c 1 . 5 . 659 . 1 1 4 TRP HH2 H 2.351 10.271 1.410 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HH2 . . . . . . . . . c25520_2n0c 1 . 5 . 660 . 1 1 4 TRP HZ2 H 0.435 10.530 2.920 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HZ2 . . . . . . . . . c25520_2n0c 1 . 5 . 661 . 1 1 4 TRP HZ3 H 3.050 8.039 0.622 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HZ3 . . . . . . . . . c25520_2n0c 1 . 5 . 662 . 1 1 4 TRP N N -1.954 3.925 1.179 . . . 1.0 . . . . . . . . . . . . A . 4 TRP N . . . . . . . . . c25520_2n0c 1 . 5 . 663 . 1 1 4 TRP NE1 N -1.026 8.258 3.796 . . . 1.0 . . . . . . . . . . . . A . 4 TRP NE1 . . . . . . . . . c25520_2n0c 1 . 5 . 664 . 1 1 4 TRP O O 1.102 3.034 0.295 . . . 1.0 . . . . . . . . . . . . A . 4 TRP O . . . . . . . . . c25520_2n0c 1 . 5 . 665 . 1 1 5 ALA C C 0.225 -0.366 1.778 . . . 1.0 . . . . . . . . . . . . A . 5 ALA C . . . . . . . . . c25520_2n0c 1 . 5 . 666 . 1 1 5 ALA CA C 1.088 0.868 2.023 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CA . . . . . . . . . c25520_2n0c 1 . 5 . 667 . 1 1 5 ALA CB C 1.939 0.680 3.270 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CB . . . . . . . . . c25520_2n0c 1 . 5 . 668 . 1 1 5 ALA H H -0.379 2.146 2.932 . . . 1.0 . . . . . . . . . . . . A . 5 ALA H . . . . . . . . . c25520_2n0c 1 . 5 . 669 . 1 1 5 ALA HA H 1.767 0.973 1.172 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HA . . . . . . . . . c25520_2n0c 1 . 5 . 670 . 1 1 5 ALA HB1 H 1.293 0.688 4.148 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB1 . . . . . . . . . c25520_2n0c 1 . 5 . 671 . 1 1 5 ALA HB2 H 2.663 1.491 3.343 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB2 . . . . . . . . . c25520_2n0c 1 . 5 . 672 . 1 1 5 ALA HB3 H 2.465 -0.273 3.216 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB3 . . . . . . . . . c25520_2n0c 1 . 5 . 673 . 1 1 5 ALA N N 0.267 2.066 2.147 . . . 1.0 . . . . . . . . . . . . A . 5 ALA N . . . . . . . . . c25520_2n0c 1 . 5 . 674 . 1 1 5 ALA O O -0.212 -1.027 2.719 . . . 1.0 . . . . . . . . . . . . A . 5 ALA O . . . . . . . . . c25520_2n0c 1 . 5 . 675 . 1 1 6 VAL C C -0.373 -2.410 -1.193 . . . 1.0 . . . . . . . . . . . . A . 6 VAL C . . . . . . . . . c25520_2n0c 1 . 5 . 676 . 1 1 6 VAL CA C -0.829 -1.823 0.137 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CA . . . . . . . . . c25520_2n0c 1 . 5 . 677 . 1 1 6 VAL CB C -2.319 -1.453 0.041 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CB . . . . . . . . . c25520_2n0c 1 . 5 . 678 . 1 1 6 VAL CG1 C -3.145 -2.666 -0.359 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CG1 . . . . . . . . . c25520_2n0c 1 . 5 . 679 . 1 1 6 VAL CG2 C -2.811 -0.875 1.360 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CG2 . . . . . . . . . c25520_2n0c 1 . 5 . 680 . 1 1 6 VAL H H 0.375 -0.083 -0.230 . . . 1.0 . . . . . . . . . . . . A . 6 VAL H . . . . . . . . . c25520_2n0c 1 . 5 . 681 . 1 1 6 VAL HA H -0.725 -2.594 0.903 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HA . . . . . . . . . c25520_2n0c 1 . 5 . 682 . 1 1 6 VAL HB H -2.432 -0.693 -0.734 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HB . . . . . . . . . c25520_2n0c 1 . 5 . 683 . 1 1 6 VAL HG11 H -2.884 -3.502 0.291 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG11 . . . . . . . . . c25520_2n0c 1 . 5 . 684 . 1 1 6 VAL HG12 H -2.937 -2.932 -1.395 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG12 . . . . . . . . . c25520_2n0c 1 . 5 . 685 . 1 1 6 VAL HG13 H -4.205 -2.442 -0.252 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG13 . . . . . . . . . c25520_2n0c 1 . 5 . 686 . 1 1 6 VAL HG21 H -3.895 -0.762 1.335 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG21 . . . . . . . . . c25520_2n0c 1 . 5 . 687 . 1 1 6 VAL HG22 H -2.352 0.100 1.529 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG22 . . . . . . . . . c25520_2n0c 1 . 5 . 688 . 1 1 6 VAL HG23 H -2.534 -1.551 2.170 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG23 . . . . . . . . . c25520_2n0c 1 . 5 . 689 . 1 1 6 VAL N N -0.018 -0.669 0.507 . . . 1.0 . . . . . . . . . . . . A . 6 VAL N . . . . . . . . . c25520_2n0c 1 . 5 . 690 . 1 1 6 VAL O O -0.113 -1.681 -2.149 . . . 1.0 . . . . . . . . . . . . A . 6 VAL O . . . . . . . . . c25520_2n0c 1 . 5 . 691 . 1 1 7 GLY C C 1.617 -4.213 -2.748 . . . 1.0 . . . . . . . . . . . . A . 7 GLY C . . . . . . . . . c25520_2n0c 1 . 5 . 692 . 1 1 7 GLY CA C 0.140 -4.400 -2.469 . . . 1.0 . . . . . . . . . . . . A . 7 GLY CA . . . . . . . . . c25520_2n0c 1 . 5 . 693 . 1 1 7 GLY H H -0.514 -4.292 -0.426 . . . 1.0 . . . . . . . . . . . . A . 7 GLY H . . . . . . . . . c25520_2n0c 1 . 5 . 694 . 1 1 7 GLY HA2 H -0.068 -5.467 -2.378 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA2 . . . . . . . . . c25520_2n0c 1 . 5 . 695 . 1 1 7 GLY HA3 H -0.432 -3.999 -3.306 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA3 . . . . . . . . . c25520_2n0c 1 . 5 . 696 . 1 1 7 GLY N N -0.283 -3.737 -1.250 . . . 1.0 . . . . . . . . . . . . A . 7 GLY N . . . . . . . . . c25520_2n0c 1 . 5 . 697 . 1 1 7 GLY O O 1.998 -3.470 -3.654 . . . 1.0 . . . . . . . . . . . . A . 7 GLY O . . . . . . . . . c25520_2n0c 1 . 5 . 698 . 1 1 8 HIS C C 4.481 -6.121 -2.616 . . . 1.0 . . . . . . . . . . . . A . 8 HIS C . . . . . . . . . c25520_2n0c 1 . 5 . 699 . 1 1 8 HIS CA C 3.901 -4.794 -2.135 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CA . . . . . . . . . c25520_2n0c 1 . 5 . 700 . 1 1 8 HIS CB C 4.561 -4.383 -0.817 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CB . . . . . . . . . c25520_2n0c 1 . 5 . 701 . 1 1 8 HIS CD2 C 3.490 -2.525 0.647 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CD2 . . . . . . . . . c25520_2n0c 1 . 5 . 702 . 1 1 8 HIS CE1 C 4.243 -0.796 -0.468 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CE1 . . . . . . . . . c25520_2n0c 1 . 5 . 703 . 1 1 8 HIS CG C 4.238 -2.975 -0.400 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CG . . . . . . . . . c25520_2n0c 1 . 5 . 704 . 1 1 8 HIS H H 2.080 -5.489 -1.233 . . . 1.0 . . . . . . . . . . . . A . 8 HIS H . . . . . . . . . c25520_2n0c 1 . 5 . 705 . 1 1 8 HIS HA H 4.140 -4.030 -2.879 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HA . . . . . . . . . c25520_2n0c 1 . 5 . 706 . 1 1 8 HIS HB2 H 4.227 -5.063 -0.035 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HB2 . . . . . . . . . c25520_2n0c 1 . 5 . 707 . 1 1 8 HIS HB3 H 5.644 -4.473 -0.923 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HB3 . . . . . . . . . c25520_2n0c 1 . 5 . 708 . 1 1 8 HIS HD1 H 5.292 -1.877 -1.925 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HD1 . . . . . . . . . c25520_2n0c 1 . 5 . 709 . 1 1 8 HIS HD2 H 2.819 -3.122 1.247 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HD2 . . . . . . . . . c25520_2n0c 1 . 5 . 710 . 1 1 8 HIS HE1 H 4.444 0.220 -0.773 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HE1 . . . . . . . . . c25520_2n0c 1 . 5 . 711 . 1 1 8 HIS N N 2.456 -4.889 -1.967 . . . 1.0 . . . . . . . . . . . . A . 8 HIS N . . . . . . . . . c25520_2n0c 1 . 5 . 712 . 1 1 8 HIS ND1 N 4.704 -1.869 -1.091 . . . 1.0 . . . . . . . . . . . . A . 8 HIS ND1 . . . . . . . . . c25520_2n0c 1 . 5 . 713 . 1 1 8 HIS NE2 N 3.503 -1.141 0.589 . . . 1.0 . . . . . . . . . . . . A . 8 HIS NE2 . . . . . . . . . c25520_2n0c 1 . 5 . 714 . 1 1 8 HIS O O 5.325 -6.720 -1.949 . . . 1.0 . . . . . . . . . . . . A . 8 HIS O . . . . . . . . . c25520_2n0c 1 . 5 . 715 . 1 1 9 LEU C C 5.249 -7.587 -5.652 . . . 1.0 . . . . . . . . . . . . A . 9 LEU C . . . . . . . . . c25520_2n0c 1 . 5 . 716 . 1 1 9 LEU CA C 4.495 -7.830 -4.349 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CA . . . . . . . . . c25520_2n0c 1 . 5 . 717 . 1 1 9 LEU CB C 3.318 -8.775 -4.596 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CB . . . . . . . . . c25520_2n0c 1 . 5 . 718 . 1 1 9 LEU CD1 C 2.467 -8.514 -6.941 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD1 . . . . . . . . . c25520_2n0c 1 . 5 . 719 . 1 1 9 LEU CD2 C 0.853 -8.822 -5.054 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD2 . . . . . . . . . c25520_2n0c 1 . 5 . 720 . 1 1 9 LEU CG C 2.190 -8.227 -5.473 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CG . . . . . . . . . c25520_2n0c 1 . 5 . 721 . 1 1 9 LEU H H 3.326 -6.028 -4.285 . . . 1.0 . . . . . . . . . . . . A . 9 LEU H . . . . . . . . . c25520_2n0c 1 . 5 . 722 . 1 1 9 LEU HA H 5.186 -8.312 -3.652 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HA . . . . . . . . . c25520_2n0c 1 . 5 . 723 . 1 1 9 LEU HB2 H 3.704 -9.686 -5.057 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB2 . . . . . . . . . c25520_2n0c 1 . 5 . 724 . 1 1 9 LEU HB3 H 2.908 -9.039 -3.616 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB3 . . . . . . . . . c25520_2n0c 1 . 5 . 725 . 1 1 9 LEU HD11 H 1.931 -7.792 -7.560 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD11 . . . . . . . . . c25520_2n0c 1 . 5 . 726 . 1 1 9 LEU HD12 H 2.113 -9.519 -7.180 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD12 . . . . . . . . . c25520_2n0c 1 . 5 . 727 . 1 1 9 LEU HD13 H 3.521 -8.459 -7.165 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD13 . . . . . . . . . c25520_2n0c 1 . 5 . 728 . 1 1 9 LEU HD21 H 0.569 -8.441 -4.072 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD21 . . . . . . . . . c25520_2n0c 1 . 5 . 729 . 1 1 9 LEU HD22 H 0.941 -9.907 -5.011 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD22 . . . . . . . . . c25520_2n0c 1 . 5 . 730 . 1 1 9 LEU HD23 H 0.090 -8.548 -5.783 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD23 . . . . . . . . . c25520_2n0c 1 . 5 . 731 . 1 1 9 LEU HG H 2.150 -7.146 -5.331 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HG . . . . . . . . . c25520_2n0c 1 . 5 . 732 . 1 1 9 LEU N N 4.022 -6.574 -3.778 . . . 1.0 . . . . . . . . . . . . A . 9 LEU N . . . . . . . . . c25520_2n0c 1 . 5 . 733 . 1 1 9 LEU O O 6.163 -8.334 -6.001 . . . 1.0 . . . . . . . . . . . . A . 9 LEU O . . . . . . . . . c25520_2n0c 1 . 5 . 734 . 1 1 10 MET C C 5.322 -7.305 -8.653 . . . 1.0 . . . . . . . . . . . . A . 10 MET C . . . . . . . . . c25520_2n0c 1 . 5 . 735 . 1 1 10 MET CA C 5.505 -6.191 -7.629 . . . 1.0 . . . . . . . . . . . . A . 10 MET CA . . . . . . . . . c25520_2n0c 1 . 5 . 736 . 1 1 10 MET CB C 6.995 -5.922 -7.410 . . . 1.0 . . . . . . . . . . . . A . 10 MET CB . . . . . . . . . c25520_2n0c 1 . 5 . 737 . 1 1 10 MET CE C 7.511 -2.280 -5.507 . . . 1.0 . . . . . . . . . . . . A . 10 MET CE . . . . . . . . . c25520_2n0c 1 . 5 . 738 . 1 1 10 MET CG C 7.277 -4.927 -6.297 . . . 1.0 . . . . . . . . . . . . A . 10 MET CG . . . . . . . . . c25520_2n0c 1 . 5 . 739 . 1 1 10 MET H H 4.099 -5.954 -6.021 . . . 1.0 . . . . . . . . . . . . A . 10 MET H . . . . . . . . . c25520_2n0c 1 . 5 . 740 . 1 1 10 MET HA H 5.043 -5.283 -8.017 . . . 1.0 . . . . . . . . . . . . A . 10 MET HA . . . . . . . . . c25520_2n0c 1 . 5 . 741 . 1 1 10 MET HB2 H 7.499 -6.859 -7.188 . . . 1.0 . . . . . . . . . . . . A . 10 MET HB2 . . . . . . . . . c25520_2n0c 1 . 5 . 742 . 1 1 10 MET HB3 H 7.406 -5.517 -8.335 . . . 1.0 . . . . . . . . . . . . A . 10 MET HB3 . . . . . . . . . c25520_2n0c 1 . 5 . 743 . 1 1 10 MET HE1 H 7.530 -2.735 -4.517 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE1 . . . . . . . . . c25520_2n0c 1 . 5 . 744 . 1 1 10 MET HE2 H 7.065 -1.288 -5.443 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE2 . . . . . . . . . c25520_2n0c 1 . 5 . 745 . 1 1 10 MET HE3 H 8.530 -2.197 -5.888 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE3 . . . . . . . . . c25520_2n0c 1 . 5 . 746 . 1 1 10 MET HG2 H 6.861 -5.320 -5.371 . . . 1.0 . . . . . . . . . . . . A . 10 MET HG2 . . . . . . . . . c25520_2n0c 1 . 5 . 747 . 1 1 10 MET HG3 H 8.355 -4.811 -6.180 . . . 1.0 . . . . . . . . . . . . A . 10 MET HG3 . . . . . . . . . c25520_2n0c 1 . 5 . 748 . 1 1 10 MET N N 4.863 -6.534 -6.366 . . . 1.0 . . . . . . . . . . . . A . 10 MET N . . . . . . . . . c25520_2n0c 1 . 5 . 749 . 1 1 10 MET O O 6.088 -8.253 -8.606 . . . 1.0 . . . . . . . . . . . . A . 10 MET O . . . . . . . . . c25520_2n0c 1 . 5 . 750 . 1 1 10 MET SD S 6.545 -3.309 -6.611 . . . 1.0 . . . . . . . . . . . . A . 10 MET SD . . . . . . . . . c25520_2n0c 1 . 6 . 751 . 1 1 1 GLY C C -5.110 6.371 3.719 . . . 1.0 . . . . . . . . . . . . A . 1 GLY C . . . . . . . . . c25520_2n0c 1 . 6 . 752 . 1 1 1 GLY CA C -5.363 7.838 3.438 . . . 1.0 . . . . . . . . . . . . A . 1 GLY CA . . . . . . . . . c25520_2n0c 1 . 6 . 753 . 1 1 1 GLY H1 H -4.739 9.118 1.966 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H1 . . . . . . . . . c25520_2n0c 1 . 6 . 754 . 1 1 1 GLY H2 H -6.092 8.177 1.554 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H2 . . . . . . . . . c25520_2n0c 1 . 6 . 755 . 1 1 1 GLY H3 H -4.545 7.476 1.595 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H3 . . . . . . . . . c25520_2n0c 1 . 6 . 756 . 1 1 1 GLY HA2 H -4.680 8.436 4.042 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA2 . . . . . . . . . c25520_2n0c 1 . 6 . 757 . 1 1 1 GLY HA3 H -6.388 8.079 3.721 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA3 . . . . . . . . . c25520_2n0c 1 . 6 . 758 . 1 1 1 GLY N N -5.171 8.177 2.039 . . . 1.0 . . . . . . . . . . . . A . 1 GLY N . . . . . . . . . c25520_2n0c 1 . 6 . 759 . 1 1 1 GLY O O -4.002 5.984 4.087 . . . 1.0 . . . . . . . . . . . . A . 1 GLY O . . . . . . . . . c25520_2n0c 1 . 6 . 760 . 1 1 2 ASN C C -5.121 3.462 2.748 . . . 1.0 . . . . . . . . . . . . A . 2 ASN C . . . . . . . . . c25520_2n0c 1 . 6 . 761 . 1 1 2 ASN CA C -6.026 4.117 3.787 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CA . . . . . . . . . c25520_2n0c 1 . 6 . 762 . 1 1 2 ASN CB C -7.410 3.462 3.760 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CB . . . . . . . . . c25520_2n0c 1 . 6 . 763 . 1 1 2 ASN CG C -8.346 4.046 4.800 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CG . . . . . . . . . c25520_2n0c 1 . 6 . 764 . 1 1 2 ASN H H -7.037 5.934 3.241 . . . 1.0 . . . . . . . . . . . . A . 2 ASN H . . . . . . . . . c25520_2n0c 1 . 6 . 765 . 1 1 2 ASN HA H -5.592 3.964 4.775 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HA . . . . . . . . . c25520_2n0c 1 . 6 . 766 . 1 1 2 ASN HB2 H -7.844 3.599 2.770 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HB2 . . . . . . . . . c25520_2n0c 1 . 6 . 767 . 1 1 2 ASN HB3 H -7.296 2.395 3.954 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HB3 . . . . . . . . . c25520_2n0c 1 . 6 . 768 . 1 1 2 ASN HD21 H -9.586 4.761 3.338 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HD21 . . . . . . . . . c25520_2n0c 1 . 6 . 769 . 1 1 2 ASN HD22 H -10.073 5.098 5.002 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HD22 . . . . . . . . . c25520_2n0c 1 . 6 . 770 . 1 1 2 ASN N N -6.142 5.551 3.546 . . . 1.0 . . . . . . . . . . . . A . 2 ASN N . . . . . . . . . c25520_2n0c 1 . 6 . 771 . 1 1 2 ASN ND2 N -9.416 4.685 4.340 . . . 1.0 . . . . . . . . . . . . A . 2 ASN ND2 . . . . . . . . . c25520_2n0c 1 . 6 . 772 . 1 1 2 ASN O O -4.423 2.490 3.040 . . . 1.0 . . . . . . . . . . . . A . 2 ASN O . . . . . . . . . c25520_2n0c 1 . 6 . 773 . 1 1 2 ASN OD1 O -8.111 3.925 6.002 . . . 1.0 . . . . . . . . . . . . A . 2 ASN OD1 . . . . . . . . . c25520_2n0c 1 . 6 . 774 . 1 1 3 HIS C C -2.902 4.039 0.511 . . . 1.0 . . . . . . . . . . . . A . 3 HIS C . . . . . . . . . c25520_2n0c 1 . 6 . 775 . 1 1 3 HIS CA C -4.317 3.470 0.451 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CA . . . . . . . . . c25520_2n0c 1 . 6 . 776 . 1 1 3 HIS CB C -4.949 3.791 -0.904 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CB . . . . . . . . . c25520_2n0c 1 . 6 . 777 . 1 1 3 HIS CD2 C -6.352 1.670 -1.431 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CD2 . . . . . . . . . c25520_2n0c 1 . 6 . 778 . 1 1 3 HIS CE1 C -8.321 2.626 -1.519 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CE1 . . . . . . . . . c25520_2n0c 1 . 6 . 779 . 1 1 3 HIS CG C -6.198 3.002 -1.191 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CG . . . . . . . . . c25520_2n0c 1 . 6 . 780 . 1 1 3 HIS H H -5.738 4.806 1.353 . . . 1.0 . . . . . . . . . . . . A . 3 HIS H . . . . . . . . . c25520_2n0c 1 . 6 . 781 . 1 1 3 HIS HA H -4.261 2.383 0.547 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HA . . . . . . . . . c25520_2n0c 1 . 6 . 782 . 1 1 3 HIS HB2 H -5.203 4.850 -0.921 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HB2 . . . . . . . . . c25520_2n0c 1 . 6 . 783 . 1 1 3 HIS HB3 H -4.220 3.592 -1.693 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HB3 . . . . . . . . . c25520_2n0c 1 . 6 . 784 . 1 1 3 HIS HD1 H -7.666 4.578 -1.114 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HD1 . . . . . . . . . c25520_2n0c 1 . 6 . 785 . 1 1 3 HIS HD2 H -5.613 0.906 -1.245 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HD2 . . . . . . . . . c25520_2n0c 1 . 6 . 786 . 1 1 3 HIS HE1 H -9.385 2.778 -1.630 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HE1 . . . . . . . . . c25520_2n0c 1 . 6 . 787 . 1 1 3 HIS N N -5.138 4.001 1.533 . . . 1.0 . . . . . . . . . . . . A . 3 HIS N . . . . . . . . . c25520_2n0c 1 . 6 . 788 . 1 1 3 HIS ND1 N -7.451 3.590 -1.250 . . . 1.0 . . . . . . . . . . . . A . 3 HIS ND1 . . . . . . . . . c25520_2n0c 1 . 6 . 789 . 1 1 3 HIS NE2 N -7.703 1.448 -1.637 . . . 1.0 . . . . . . . . . . . . A . 3 HIS NE2 . . . . . . . . . c25520_2n0c 1 . 6 . 790 . 1 1 3 HIS O O -2.431 4.660 -0.441 . . . 1.0 . . . . . . . . . . . . A . 3 HIS O . . . . . . . . . c25520_2n0c 1 . 6 . 791 . 1 1 4 TRP C C 0.142 3.369 1.185 . . . 1.0 . . . . . . . . . . . . A . 4 TRP C . . . . . . . . . c25520_2n0c 1 . 6 . 792 . 1 1 4 TRP CA C -0.871 4.315 1.822 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CA . . . . . . . . . c25520_2n0c 1 . 6 . 793 . 1 1 4 TRP CB C -0.566 4.481 3.311 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CB . . . . . . . . . c25520_2n0c 1 . 6 . 794 . 1 1 4 TRP CD1 C -0.951 6.520 4.815 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CD1 . . . . . . . . . c25520_2n0c 1 . 6 . 795 . 1 1 4 TRP CD2 C 0.381 6.912 3.059 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CD2 . . . . . . . . . c25520_2n0c 1 . 6 . 796 . 1 1 4 TRP CE2 C 0.252 8.103 3.798 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CE2 . . . . . . . . . c25520_2n0c 1 . 6 . 797 . 1 1 4 TRP CE3 C 1.175 6.916 1.908 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CE3 . . . . . . . . . c25520_2n0c 1 . 6 . 798 . 1 1 4 TRP CG C -0.396 5.911 3.727 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CG . . . . . . . . . c25520_2n0c 1 . 6 . 799 . 1 1 4 TRP CH2 C 1.656 9.260 2.293 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CH2 . . . . . . . . . c25520_2n0c 1 . 6 . 800 . 1 1 4 TRP CZ2 C 0.885 9.284 3.424 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CZ2 . . . . . . . . . c25520_2n0c 1 . 6 . 801 . 1 1 4 TRP CZ3 C 1.803 8.089 1.538 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CZ3 . . . . . . . . . c25520_2n0c 1 . 6 . 802 . 1 1 4 TRP H H -2.677 3.299 2.391 . . . 1.0 . . . . . . . . . . . . A . 4 TRP H . . . . . . . . . c25520_2n0c 1 . 6 . 803 . 1 1 4 TRP HA H -0.800 5.284 1.332 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HA . . . . . . . . . c25520_2n0c 1 . 6 . 804 . 1 1 4 TRP HB2 H -1.396 4.065 3.880 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HB2 . . . . . . . . . c25520_2n0c 1 . 6 . 805 . 1 1 4 TRP HB3 H 0.343 3.932 3.575 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HB3 . . . . . . . . . c25520_2n0c 1 . 6 . 806 . 1 1 4 TRP HD1 H -1.599 6.037 5.532 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HD1 . . . . . . . . . c25520_2n0c 1 . 6 . 807 . 1 1 4 TRP HE1 H -0.840 8.518 5.574 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HE1 . . . . . . . . . c25520_2n0c 1 . 6 . 808 . 1 1 4 TRP HE3 H 1.311 6.019 1.325 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HE3 . . . . . . . . . c25520_2n0c 1 . 6 . 809 . 1 1 4 TRP HH2 H 2.159 10.163 1.978 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HH2 . . . . . . . . . c25520_2n0c 1 . 6 . 810 . 1 1 4 TRP HZ2 H 0.772 10.189 4.003 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HZ2 . . . . . . . . . c25520_2n0c 1 . 6 . 811 . 1 1 4 TRP HZ3 H 2.417 8.099 0.650 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HZ3 . . . . . . . . . c25520_2n0c 1 . 6 . 812 . 1 1 4 TRP N N -2.232 3.823 1.637 . . . 1.0 . . . . . . . . . . . . A . 4 TRP N . . . . . . . . . c25520_2n0c 1 . 6 . 813 . 1 1 4 TRP NE1 N -0.567 7.838 4.865 . . . 1.0 . . . . . . . . . . . . A . 4 TRP NE1 . . . . . . . . . c25520_2n0c 1 . 6 . 814 . 1 1 4 TRP O O 0.736 3.684 0.155 . . . 1.0 . . . . . . . . . . . . A . 4 TRP O . . . . . . . . . c25520_2n0c 1 . 6 . 815 . 1 1 5 ALA C C 0.563 -0.095 0.973 . . . 1.0 . . . . . . . . . . . . A . 5 ALA C . . . . . . . . . c25520_2n0c 1 . 6 . 816 . 1 1 5 ALA CA C 1.271 1.217 1.296 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CA . . . . . . . . . c25520_2n0c 1 . 6 . 817 . 1 1 5 ALA CB C 2.387 0.982 2.302 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CB . . . . . . . . . c25520_2n0c 1 . 6 . 818 . 1 1 5 ALA H H -0.190 2.008 2.656 . . . 1.0 . . . . . . . . . . . . A . 5 ALA H . . . . . . . . . c25520_2n0c 1 . 6 . 819 . 1 1 5 ALA HA H 1.721 1.584 0.367 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HA . . . . . . . . . c25520_2n0c 1 . 6 . 820 . 1 1 5 ALA HB1 H 2.123 0.171 2.983 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB1 . . . . . . . . . c25520_2n0c 1 . 6 . 821 . 1 1 5 ALA HB2 H 2.533 1.896 2.878 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB2 . . . . . . . . . c25520_2n0c 1 . 6 . 822 . 1 1 5 ALA HB3 H 3.317 0.735 1.788 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB3 . . . . . . . . . c25520_2n0c 1 . 6 . 823 . 1 1 5 ALA N N 0.332 2.209 1.804 . . . 1.0 . . . . . . . . . . . . A . 5 ALA N . . . . . . . . . c25520_2n0c 1 . 6 . 824 . 1 1 5 ALA O O 0.388 -0.948 1.843 . . . 1.0 . . . . . . . . . . . . A . 5 ALA O . . . . . . . . . c25520_2n0c 1 . 6 . 825 . 1 1 6 VAL C C 0.203 -2.120 -1.878 . . . 1.0 . . . . . . . . . . . . A . 6 VAL C . . . . . . . . . c25520_2n0c 1 . 6 . 826 . 1 1 6 VAL CA C -0.535 -1.456 -0.722 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CA . . . . . . . . . c25520_2n0c 1 . 6 . 827 . 1 1 6 VAL CB C -1.979 -1.151 -1.154 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CB . . . . . . . . . c25520_2n0c 1 . 6 . 828 . 1 1 6 VAL CG1 C -1.992 -0.237 -2.371 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CG1 . . . . . . . . . c25520_2n0c 1 . 6 . 829 . 1 1 6 VAL CG2 C -2.734 -2.441 -1.440 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CG2 . . . . . . . . . c25520_2n0c 1 . 6 . 830 . 1 1 6 VAL H H 0.333 0.495 -0.959 . . . 1.0 . . . . . . . . . . . . A . 6 VAL H . . . . . . . . . c25520_2n0c 1 . 6 . 831 . 1 1 6 VAL HA H -0.575 -2.175 0.100 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HA . . . . . . . . . c25520_2n0c 1 . 6 . 832 . 1 1 6 VAL HB H -2.478 -0.632 -0.334 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HB . . . . . . . . . c25520_2n0c 1 . 6 . 833 . 1 1 6 VAL HG11 H -1.650 -0.798 -3.240 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG11 . . . . . . . . . c25520_2n0c 1 . 6 . 834 . 1 1 6 VAL HG12 H -1.327 0.610 -2.201 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG12 . . . . . . . . . c25520_2n0c 1 . 6 . 835 . 1 1 6 VAL HG13 H -3.004 0.125 -2.549 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG13 . . . . . . . . . c25520_2n0c 1 . 6 . 836 . 1 1 6 VAL HG21 H -3.783 -2.217 -1.633 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG21 . . . . . . . . . c25520_2n0c 1 . 6 . 837 . 1 1 6 VAL HG22 H -2.657 -3.109 -0.582 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG22 . . . . . . . . . c25520_2n0c 1 . 6 . 838 . 1 1 6 VAL HG23 H -2.299 -2.922 -2.316 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG23 . . . . . . . . . c25520_2n0c 1 . 6 . 839 . 1 1 6 VAL N N 0.155 -0.248 -0.283 . . . 1.0 . . . . . . . . . . . . A . 6 VAL N . . . . . . . . . c25520_2n0c 1 . 6 . 840 . 1 1 6 VAL O O 0.808 -1.447 -2.711 . . . 1.0 . . . . . . . . . . . . A . 6 VAL O . . . . . . . . . c25520_2n0c 1 . 6 . 841 . 1 1 7 GLY C C 2.228 -4.576 -2.616 . . . 1.0 . . . . . . . . . . . . A . 7 GLY C . . . . . . . . . c25520_2n0c 1 . 6 . 842 . 1 1 7 GLY CA C 0.812 -4.182 -2.985 . . . 1.0 . . . . . . . . . . . . A . 7 GLY CA . . . . . . . . . c25520_2n0c 1 . 6 . 843 . 1 1 7 GLY H H -0.371 -3.956 -1.208 . . . 1.0 . . . . . . . . . . . . A . 7 GLY H . . . . . . . . . c25520_2n0c 1 . 6 . 844 . 1 1 7 GLY HA2 H 0.243 -5.090 -3.185 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA2 . . . . . . . . . c25520_2n0c 1 . 6 . 845 . 1 1 7 GLY HA3 H 0.837 -3.578 -3.896 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA3 . . . . . . . . . c25520_2n0c 1 . 6 . 846 . 1 1 7 GLY N N 0.147 -3.448 -1.926 . . . 1.0 . . . . . . . . . . . . A . 7 GLY N . . . . . . . . . c25520_2n0c 1 . 6 . 847 . 1 1 7 GLY O O 3.192 -4.059 -3.183 . . . 1.0 . . . . . . . . . . . . A . 7 GLY O . . . . . . . . . c25520_2n0c 1 . 6 . 848 . 1 1 8 HIS C C 3.974 -7.339 -1.778 . . . 1.0 . . . . . . . . . . . . A . 8 HIS C . . . . . . . . . c25520_2n0c 1 . 6 . 849 . 1 1 8 HIS CA C 3.667 -5.954 -1.217 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CA . . . . . . . . . c25520_2n0c 1 . 6 . 850 . 1 1 8 HIS CB C 3.727 -5.985 0.311 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CB . . . . . . . . . c25520_2n0c 1 . 6 . 851 . 1 1 8 HIS CD2 C 2.634 -4.417 2.069 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CD2 . . . . . . . . . c25520_2n0c 1 . 6 . 852 . 1 1 8 HIS CE1 C 3.286 -2.509 1.215 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CE1 . . . . . . . . . c25520_2n0c 1 . 6 . 853 . 1 1 8 HIS CG C 3.365 -4.672 0.948 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CG . . . . . . . . . c25520_2n0c 1 . 6 . 854 . 1 1 8 HIS H H 1.521 -5.884 -1.231 . . . 1.0 . . . . . . . . . . . . A . 8 HIS H . . . . . . . . . c25520_2n0c 1 . 6 . 855 . 1 1 8 HIS HA H 4.438 -5.263 -1.568 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HA . . . . . . . . . c25520_2n0c 1 . 6 . 856 . 1 1 8 HIS HB2 H 3.037 -6.747 0.668 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HB2 . . . . . . . . . c25520_2n0c 1 . 6 . 857 . 1 1 8 HIS HB3 H 4.739 -6.256 0.616 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HB3 . . . . . . . . . c25520_2n0c 1 . 6 . 858 . 1 1 8 HIS HD1 H 4.331 -3.312 -0.418 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HD1 . . . . . . . . . c25520_2n0c 1 . 6 . 859 . 1 1 8 HIS HD2 H 2.005 -5.126 2.587 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HD2 . . . . . . . . . c25520_2n0c 1 . 6 . 860 . 1 1 8 HIS HE1 H 3.433 -1.456 1.058 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HE1 . . . . . . . . . c25520_2n0c 1 . 6 . 861 . 1 1 8 HIS N N 2.357 -5.492 -1.662 . . . 1.0 . . . . . . . . . . . . A . 8 HIS N . . . . . . . . . c25520_2n0c 1 . 6 . 862 . 1 1 8 HIS ND1 N 3.768 -3.455 0.422 . . . 1.0 . . . . . . . . . . . . A . 8 HIS ND1 . . . . . . . . . c25520_2n0c 1 . 6 . 863 . 1 1 8 HIS NE2 N 2.593 -3.044 2.224 . . . 1.0 . . . . . . . . . . . . A . 8 HIS NE2 . . . . . . . . . c25520_2n0c 1 . 6 . 864 . 1 1 8 HIS O O 4.666 -8.138 -1.146 . . . 1.0 . . . . . . . . . . . . A . 8 HIS O . . . . . . . . . c25520_2n0c 1 . 6 . 865 . 1 1 9 LEU C C 4.682 -8.783 -4.753 . . . 1.0 . . . . . . . . . . . . A . 9 LEU C . . . . . . . . . c25520_2n0c 1 . 6 . 866 . 1 1 9 LEU CA C 3.673 -8.908 -3.616 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CA . . . . . . . . . c25520_2n0c 1 . 6 . 867 . 1 1 9 LEU CB C 2.351 -9.463 -4.150 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CB . . . . . . . . . c25520_2n0c 1 . 6 . 868 . 1 1 9 LEU CD1 C 2.182 -11.342 -2.500 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD1 . . . . . . . . . c25520_2n0c 1 . 6 . 869 . 1 1 9 LEU CD2 C 0.999 -9.182 -2.058 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD2 . . . . . . . . . c25520_2n0c 1 . 6 . 870 . 1 1 9 LEU CG C 1.456 -10.163 -3.128 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CG . . . . . . . . . c25520_2n0c 1 . 6 . 871 . 1 1 9 LEU H H 2.889 -6.915 -3.445 . . . 1.0 . . . . . . . . . . . . A . 9 LEU H . . . . . . . . . c25520_2n0c 1 . 6 . 872 . 1 1 9 LEU HA H 4.073 -9.615 -2.895 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HA . . . . . . . . . c25520_2n0c 1 . 6 . 873 . 1 1 9 LEU HB2 H 1.787 -8.632 -4.567 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB2 . . . . . . . . . c25520_2n0c 1 . 6 . 874 . 1 1 9 LEU HB3 H 2.554 -10.174 -4.954 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB3 . . . . . . . . . c25520_2n0c 1 . 6 . 875 . 1 1 9 LEU HD11 H 2.854 -11.799 -3.228 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD11 . . . . . . . . . c25520_2n0c 1 . 6 . 876 . 1 1 9 LEU HD12 H 1.451 -12.085 -2.176 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD12 . . . . . . . . . c25520_2n0c 1 . 6 . 877 . 1 1 9 LEU HD13 H 2.759 -11.016 -1.633 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD13 . . . . . . . . . c25520_2n0c 1 . 6 . 878 . 1 1 9 LEU HD21 H 0.540 -8.314 -2.532 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD21 . . . . . . . . . c25520_2n0c 1 . 6 . 879 . 1 1 9 LEU HD22 H 1.855 -8.862 -1.468 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD22 . . . . . . . . . c25520_2n0c 1 . 6 . 880 . 1 1 9 LEU HD23 H 0.270 -9.665 -1.408 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD23 . . . . . . . . . c25520_2n0c 1 . 6 . 881 . 1 1 9 LEU HG H 0.570 -10.538 -3.647 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HG . . . . . . . . . c25520_2n0c 1 . 6 . 882 . 1 1 9 LEU N N 3.454 -7.618 -2.969 . . . 1.0 . . . . . . . . . . . . A . 9 LEU N . . . . . . . . . c25520_2n0c 1 . 6 . 883 . 1 1 9 LEU O O 4.665 -9.569 -5.700 . . . 1.0 . . . . . . . . . . . . A . 9 LEU O . . . . . . . . . c25520_2n0c 1 . 6 . 884 . 1 1 10 MET C C 7.521 -8.764 -5.772 . . . 1.0 . . . . . . . . . . . . A . 10 MET C . . . . . . . . . c25520_2n0c 1 . 6 . 885 . 1 1 10 MET CA C 6.581 -7.567 -5.669 . . . 1.0 . . . . . . . . . . . . A . 10 MET CA . . . . . . . . . c25520_2n0c 1 . 6 . 886 . 1 1 10 MET CB C 7.379 -6.302 -5.351 . . . 1.0 . . . . . . . . . . . . A . 10 MET CB . . . . . . . . . c25520_2n0c 1 . 6 . 887 . 1 1 10 MET CE C 10.601 -4.833 -6.677 . . . 1.0 . . . . . . . . . . . . A . 10 MET CE . . . . . . . . . c25520_2n0c 1 . 6 . 888 . 1 1 10 MET CG C 7.942 -5.611 -6.583 . . . 1.0 . . . . . . . . . . . . A . 10 MET CG . . . . . . . . . c25520_2n0c 1 . 6 . 889 . 1 1 10 MET H H 5.527 -7.178 -3.838 . . . 1.0 . . . . . . . . . . . . A . 10 MET H . . . . . . . . . c25520_2n0c 1 . 6 . 890 . 1 1 10 MET HA H 6.077 -7.441 -6.625 . . . 1.0 . . . . . . . . . . . . A . 10 MET HA . . . . . . . . . c25520_2n0c 1 . 6 . 891 . 1 1 10 MET HB2 H 6.718 -5.610 -4.826 . . . 1.0 . . . . . . . . . . . . A . 10 MET HB2 . . . . . . . . . c25520_2n0c 1 . 6 . 892 . 1 1 10 MET HB3 H 8.208 -6.557 -4.686 . . . 1.0 . . . . . . . . . . . . A . 10 MET HB3 . . . . . . . . . c25520_2n0c 1 . 6 . 893 . 1 1 10 MET HE1 H 10.360 -4.018 -7.360 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE1 . . . . . . . . . c25520_2n0c 1 . 6 . 894 . 1 1 10 MET HE2 H 11.651 -5.104 -6.791 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE2 . . . . . . . . . c25520_2n0c 1 . 6 . 895 . 1 1 10 MET HE3 H 10.419 -4.513 -5.651 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE3 . . . . . . . . . c25520_2n0c 1 . 6 . 896 . 1 1 10 MET HG2 H 7.260 -5.738 -7.421 . . . 1.0 . . . . . . . . . . . . A . 10 MET HG2 . . . . . . . . . c25520_2n0c 1 . 6 . 897 . 1 1 10 MET HG3 H 8.037 -4.542 -6.378 . . . 1.0 . . . . . . . . . . . . A . 10 MET HG3 . . . . . . . . . c25520_2n0c 1 . 6 . 898 . 1 1 10 MET N N 5.561 -7.792 -4.651 . . . 1.0 . . . . . . . . . . . . A . 10 MET N . . . . . . . . . c25520_2n0c 1 . 6 . 899 . 1 1 10 MET O O 8.314 -8.945 -4.864 . . . 1.0 . . . . . . . . . . . . A . 10 MET O . . . . . . . . . c25520_2n0c 1 . 6 . 900 . 1 1 10 MET SD S 9.564 -6.245 -7.054 . . . 1.0 . . . . . . . . . . . . A . 10 MET SD . . . . . . . . . c25520_2n0c 1 . 7 . 901 . 1 1 1 GLY C C -7.402 0.708 3.284 . . . 1.0 . . . . . . . . . . . . A . 1 GLY C . . . . . . . . . c25520_2n0c 1 . 7 . 902 . 1 1 1 GLY CA C -7.786 -0.622 3.901 . . . 1.0 . . . . . . . . . . . . A . 1 GLY CA . . . . . . . . . c25520_2n0c 1 . 7 . 903 . 1 1 1 GLY H1 H -7.535 -0.374 5.918 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H1 . . . . . . . . . c25520_2n0c 1 . 7 . 904 . 1 1 1 GLY H2 H -8.878 -1.323 5.486 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H2 . . . . . . . . . c25520_2n0c 1 . 7 . 905 . 1 1 1 GLY H3 H -8.924 0.364 5.287 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H3 . . . . . . . . . c25520_2n0c 1 . 7 . 906 . 1 1 1 GLY HA2 H -6.904 -1.259 3.939 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA2 . . . . . . . . . c25520_2n0c 1 . 7 . 907 . 1 1 1 GLY HA3 H -8.538 -1.098 3.272 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA3 . . . . . . . . . c25520_2n0c 1 . 7 . 908 . 1 1 1 GLY N N -8.319 -0.479 5.243 . . . 1.0 . . . . . . . . . . . . A . 1 GLY N . . . . . . . . . c25520_2n0c 1 . 7 . 909 . 1 1 1 GLY O O -8.084 1.205 2.389 . . . 1.0 . . . . . . . . . . . . A . 1 GLY O . . . . . . . . . c25520_2n0c 1 . 7 . 910 . 1 1 2 ASN C C -5.020 2.382 1.980 . . . 1.0 . . . . . . . . . . . . A . 2 ASN C . . . . . . . . . c25520_2n0c 1 . 7 . 911 . 1 1 2 ASN CA C -5.833 2.569 3.257 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CA . . . . . . . . . c25520_2n0c 1 . 7 . 912 . 1 1 2 ASN CB C -4.986 3.280 4.315 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CB . . . . . . . . . c25520_2n0c 1 . 7 . 913 . 1 1 2 ASN CG C -4.862 4.768 4.052 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CG . . . . . . . . . c25520_2n0c 1 . 7 . 914 . 1 1 2 ASN H H -5.783 0.822 4.508 . . . 1.0 . . . . . . . . . . . . A . 2 ASN H . . . . . . . . . c25520_2n0c 1 . 7 . 915 . 1 1 2 ASN HA H -6.695 3.199 3.031 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HA . . . . . . . . . c25520_2n0c 1 . 7 . 916 . 1 1 2 ASN HB2 H -5.446 3.132 5.292 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HB2 . . . . . . . . . c25520_2n0c 1 . 7 . 917 . 1 1 2 ASN HB3 H -3.986 2.842 4.325 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HB3 . . . . . . . . . c25520_2n0c 1 . 7 . 918 . 1 1 2 ASN HD21 H -6.893 4.994 4.146 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HD21 . . . . . . . . . c25520_2n0c 1 . 7 . 919 . 1 1 2 ASN HD22 H -5.964 6.461 3.822 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HD22 . . . . . . . . . c25520_2n0c 1 . 7 . 920 . 1 1 2 ASN N N -6.306 1.286 3.765 . . . 1.0 . . . . . . . . . . . . A . 2 ASN N . . . . . . . . . c25520_2n0c 1 . 7 . 921 . 1 1 2 ASN ND2 N -5.996 5.458 4.004 . . . 1.0 . . . . . . . . . . . . A . 2 ASN ND2 . . . . . . . . . c25520_2n0c 1 . 7 . 922 . 1 1 2 ASN O O -4.605 1.269 1.653 . . . 1.0 . . . . . . . . . . . . A . 2 ASN O . . . . . . . . . c25520_2n0c 1 . 7 . 923 . 1 1 2 ASN OD1 O -3.759 5.292 3.894 . . . 1.0 . . . . . . . . . . . . A . 2 ASN OD1 . . . . . . . . . c25520_2n0c 1 . 7 . 924 . 1 1 3 HIS C C -2.619 3.974 0.233 . . . 1.0 . . . . . . . . . . . . A . 3 HIS C . . . . . . . . . c25520_2n0c 1 . 7 . 925 . 1 1 3 HIS CA C -4.030 3.435 0.020 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CA . . . . . . . . . c25520_2n0c 1 . 7 . 926 . 1 1 3 HIS CB C -4.738 4.240 -1.070 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CB . . . . . . . . . c25520_2n0c 1 . 7 . 927 . 1 1 3 HIS CD2 C -6.232 2.589 -2.406 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CD2 . . . . . . . . . c25520_2n0c 1 . 7 . 928 . 1 1 3 HIS CE1 C -8.177 3.311 -1.705 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CE1 . . . . . . . . . c25520_2n0c 1 . 7 . 929 . 1 1 3 HIS CG C -6.025 3.620 -1.539 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CG . . . . . . . . . c25520_2n0c 1 . 7 . 930 . 1 1 3 HIS H H -5.167 4.370 1.584 . . . 1.0 . . . . . . . . . . . . A . 3 HIS H . . . . . . . . . c25520_2n0c 1 . 7 . 931 . 1 1 3 HIS HA H -3.955 2.402 -0.329 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HA . . . . . . . . . c25520_2n0c 1 . 7 . 932 . 1 1 3 HIS HB2 H -4.962 5.229 -0.673 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HB2 . . . . . . . . . c25520_2n0c 1 . 7 . 933 . 1 1 3 HIS HB3 H -4.066 4.348 -1.924 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HB3 . . . . . . . . . c25520_2n0c 1 . 7 . 934 . 1 1 3 HIS HD1 H -7.444 4.826 -0.454 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HD1 . . . . . . . . . c25520_2n0c 1 . 7 . 935 . 1 1 3 HIS HD2 H -5.494 2.169 -3.074 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HD2 . . . . . . . . . c25520_2n0c 1 . 7 . 936 . 1 1 3 HIS HE1 H -9.243 3.418 -1.566 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HE1 . . . . . . . . . c25520_2n0c 1 . 7 . 937 . 1 1 3 HIS N N -4.795 3.477 1.262 . . . 1.0 . . . . . . . . . . . . A . 3 HIS N . . . . . . . . . c25520_2n0c 1 . 7 . 938 . 1 1 3 HIS ND1 N -7.265 4.063 -1.107 . . . 1.0 . . . . . . . . . . . . A . 3 HIS ND1 . . . . . . . . . c25520_2n0c 1 . 7 . 939 . 1 1 3 HIS NE2 N -7.601 2.406 -2.500 . . . 1.0 . . . . . . . . . . . . A . 3 HIS NE2 . . . . . . . . . c25520_2n0c 1 . 7 . 940 . 1 1 3 HIS O O -2.038 4.591 -0.660 . . . 1.0 . . . . . . . . . . . . A . 3 HIS O . . . . . . . . . c25520_2n0c 1 . 7 . 941 . 1 1 4 TRP C C 0.324 3.234 1.223 . . . 1.0 . . . . . . . . . . . . A . 4 TRP C . . . . . . . . . c25520_2n0c 1 . 7 . 942 . 1 1 4 TRP CA C -0.731 4.201 1.751 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CA . . . . . . . . . c25520_2n0c 1 . 7 . 943 . 1 1 4 TRP CB C -0.581 4.360 3.264 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CB . . . . . . . . . c25520_2n0c 1 . 7 . 944 . 1 1 4 TRP CD1 C -1.128 6.388 4.735 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CD1 . . . . . . . . . c25520_2n0c 1 . 7 . 945 . 1 1 4 TRP CD2 C 0.366 6.799 3.118 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CD2 . . . . . . . . . c25520_2n0c 1 . 7 . 946 . 1 1 4 TRP CE2 C 0.155 7.985 3.848 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CE2 . . . . . . . . . c25520_2n0c 1 . 7 . 947 . 1 1 4 TRP CE3 C 1.267 6.817 2.050 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CE3 . . . . . . . . . c25520_2n0c 1 . 7 . 948 . 1 1 4 TRP CG C -0.464 5.789 3.702 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CG . . . . . . . . . c25520_2n0c 1 . 7 . 949 . 1 1 4 TRP CH2 C 1.690 9.163 2.492 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CH2 . . . . . . . . . c25520_2n0c 1 . 7 . 950 . 1 1 4 TRP CZ2 C 0.813 9.174 3.542 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CZ2 . . . . . . . . . c25520_2n0c 1 . 7 . 951 . 1 1 4 TRP CZ3 C 1.919 7.997 1.748 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CZ3 . . . . . . . . . c25520_2n0c 1 . 7 . 952 . 1 1 4 TRP H H -2.605 3.216 2.118 . . . 1.0 . . . . . . . . . . . . A . 4 TRP H . . . . . . . . . c25520_2n0c 1 . 7 . 953 . 1 1 4 TRP HA H -0.592 5.166 1.272 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HA . . . . . . . . . c25520_2n0c 1 . 7 . 954 . 1 1 4 TRP HB2 H -1.461 3.935 3.743 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HB2 . . . . . . . . . c25520_2n0c 1 . 7 . 955 . 1 1 4 TRP HB3 H 0.300 3.816 3.618 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HB3 . . . . . . . . . c25520_2n0c 1 . 7 . 956 . 1 1 4 TRP HD1 H -1.837 5.895 5.383 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HD1 . . . . . . . . . c25520_2n0c 1 . 7 . 957 . 1 1 4 TRP HE1 H -1.106 8.384 5.510 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HE1 . . . . . . . . . c25520_2n0c 1 . 7 . 958 . 1 1 4 TRP HE3 H 1.469 5.926 1.480 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HE3 . . . . . . . . . c25520_2n0c 1 . 7 . 959 . 1 1 4 TRP HH2 H 2.213 10.072 2.233 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HH2 . . . . . . . . . c25520_2n0c 1 . 7 . 960 . 1 1 4 TRP HZ2 H 0.637 10.075 4.111 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HZ2 . . . . . . . . . c25520_2n0c 1 . 7 . 961 . 1 1 4 TRP HZ3 H 2.616 8.017 0.924 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HZ3 . . . . . . . . . c25520_2n0c 1 . 7 . 962 . 1 1 4 TRP N N -2.073 3.737 1.421 . . . 1.0 . . . . . . . . . . . . A . 4 TRP N . . . . . . . . . c25520_2n0c 1 . 7 . 963 . 1 1 4 TRP NE1 N -0.760 7.709 4.828 . . . 1.0 . . . . . . . . . . . . A . 4 TRP NE1 . . . . . . . . . c25520_2n0c 1 . 7 . 964 . 1 1 4 TRP O O 1.064 3.555 0.293 . . . 1.0 . . . . . . . . . . . . A . 4 TRP O . . . . . . . . . c25520_2n0c 1 . 7 . 965 . 1 1 5 ALA C C 0.667 -0.310 1.185 . . . 1.0 . . . . . . . . . . . . A . 5 ALA C . . . . . . . . . c25520_2n0c 1 . 7 . 966 . 1 1 5 ALA CA C 1.350 1.035 1.410 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CA . . . . . . . . . c25520_2n0c 1 . 7 . 967 . 1 1 5 ALA CB C 2.453 0.902 2.448 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CB . . . . . . . . . c25520_2n0c 1 . 7 . 968 . 1 1 5 ALA H H -0.253 1.844 2.589 . . . 1.0 . . . . . . . . . . . . A . 5 ALA H . . . . . . . . . c25520_2n0c 1 . 7 . 969 . 1 1 5 ALA HA H 1.814 1.332 0.465 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HA . . . . . . . . . c25520_2n0c 1 . 7 . 970 . 1 1 5 ALA HB1 H 2.015 0.605 3.400 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB1 . . . . . . . . . c25520_2n0c 1 . 7 . 971 . 1 1 5 ALA HB2 H 2.961 1.860 2.563 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB2 . . . . . . . . . c25520_2n0c 1 . 7 . 972 . 1 1 5 ALA HB3 H 3.171 0.147 2.127 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB3 . . . . . . . . . c25520_2n0c 1 . 7 . 973 . 1 1 5 ALA N N 0.387 2.049 1.822 . . . 1.0 . . . . . . . . . . . . A . 5 ALA N . . . . . . . . . c25520_2n0c 1 . 7 . 974 . 1 1 5 ALA O O 0.721 -1.195 2.039 . . . 1.0 . . . . . . . . . . . . A . 5 ALA O . . . . . . . . . c25520_2n0c 1 . 7 . 975 . 1 1 6 VAL C C -0.204 -2.233 -1.656 . . . 1.0 . . . . . . . . . . . . A . 6 VAL C . . . . . . . . . c25520_2n0c 1 . 7 . 976 . 1 1 6 VAL CA C -0.667 -1.696 -0.308 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CA . . . . . . . . . c25520_2n0c 1 . 7 . 977 . 1 1 6 VAL CB C -2.192 -1.493 -0.342 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CB . . . . . . . . . c25520_2n0c 1 . 7 . 978 . 1 1 6 VAL CG1 C -2.569 -0.447 -1.381 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CG1 . . . . . . . . . c25520_2n0c 1 . 7 . 979 . 1 1 6 VAL CG2 C -2.898 -2.811 -0.621 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CG2 . . . . . . . . . c25520_2n0c 1 . 7 . 980 . 1 1 6 VAL H H 0.022 0.311 -0.640 . . . 1.0 . . . . . . . . . . . . A . 6 VAL H . . . . . . . . . c25520_2n0c 1 . 7 . 981 . 1 1 6 VAL HA H -0.445 -2.457 0.444 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HA . . . . . . . . . c25520_2n0c 1 . 7 . 982 . 1 1 6 VAL HB H -2.510 -1.131 0.636 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HB . . . . . . . . . c25520_2n0c 1 . 7 . 983 . 1 1 6 VAL HG11 H -2.384 -0.852 -2.376 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG11 . . . . . . . . . c25520_2n0c 1 . 7 . 984 . 1 1 6 VAL HG12 H -1.965 0.449 -1.236 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG12 . . . . . . . . . c25520_2n0c 1 . 7 . 985 . 1 1 6 VAL HG13 H -3.624 -0.195 -1.282 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG13 . . . . . . . . . c25520_2n0c 1 . 7 . 986 . 1 1 6 VAL HG21 H -2.723 -3.096 -1.659 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG21 . . . . . . . . . c25520_2n0c 1 . 7 . 987 . 1 1 6 VAL HG22 H -3.968 -2.698 -0.450 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG22 . . . . . . . . . c25520_2n0c 1 . 7 . 988 . 1 1 6 VAL HG23 H -2.504 -3.585 0.039 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG23 . . . . . . . . . c25520_2n0c 1 . 7 . 989 . 1 1 6 VAL N N 0.026 -0.458 0.030 . . . 1.0 . . . . . . . . . . . . A . 6 VAL N . . . . . . . . . c25520_2n0c 1 . 7 . 990 . 1 1 6 VAL O O 0.002 -1.473 -2.602 . . . 1.0 . . . . . . . . . . . . A . 6 VAL O . . . . . . . . . c25520_2n0c 1 . 7 . 991 . 1 1 7 GLY C C 1.850 -4.580 -2.939 . . . 1.0 . . . . . . . . . . . . A . 7 GLY C . . . . . . . . . c25520_2n0c 1 . 7 . 992 . 1 1 7 GLY CA C 0.391 -4.168 -2.979 . . . 1.0 . . . . . . . . . . . . A . 7 GLY CA . . . . . . . . . c25520_2n0c 1 . 7 . 993 . 1 1 7 GLY H H -0.232 -4.132 -0.924 . . . 1.0 . . . . . . . . . . . . A . 7 GLY H . . . . . . . . . c25520_2n0c 1 . 7 . 994 . 1 1 7 GLY HA2 H -0.211 -5.061 -3.145 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA2 . . . . . . . . . c25520_2n0c 1 . 7 . 995 . 1 1 7 GLY HA3 H 0.239 -3.486 -3.819 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA3 . . . . . . . . . c25520_2n0c 1 . 7 . 996 . 1 1 7 GLY N N -0.045 -3.550 -1.741 . . . 1.0 . . . . . . . . . . . . A . 7 GLY N . . . . . . . . . c25520_2n0c 1 . 7 . 997 . 1 1 7 GLY O O 2.492 -4.717 -3.981 . . . 1.0 . . . . . . . . . . . . A . 7 GLY O . . . . . . . . . c25520_2n0c 1 . 7 . 998 . 1 1 8 HIS C C 3.878 -6.669 -1.293 . . . 1.0 . . . . . . . . . . . . A . 8 HIS C . . . . . . . . . c25520_2n0c 1 . 7 . 999 . 1 1 8 HIS CA C 3.769 -5.172 -1.563 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CA . . . . . . . . . c25520_2n0c 1 . 7 . 1000 . 1 1 8 HIS CB C 4.410 -4.386 -0.419 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CB . . . . . . . . . c25520_2n0c 1 . 7 . 1001 . 1 1 8 HIS CD2 C 5.923 -2.670 -1.648 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CD2 . . . . . . . . . c25520_2n0c 1 . 7 . 1002 . 1 1 8 HIS CE1 C 4.980 -0.845 -0.892 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CE1 . . . . . . . . . c25520_2n0c 1 . 7 . 1003 . 1 1 8 HIS CG C 4.900 -3.022 -0.819 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CG . . . . . . . . . c25520_2n0c 1 . 7 . 1004 . 1 1 8 HIS H H 1.792 -4.647 -0.907 . . . 1.0 . . . . . . . . . . . . A . 8 HIS H . . . . . . . . . c25520_2n0c 1 . 7 . 1005 . 1 1 8 HIS HA H 4.326 -4.952 -2.478 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HA . . . . . . . . . c25520_2n0c 1 . 7 . 1006 . 1 1 8 HIS HB2 H 3.666 -4.260 0.364 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HB2 . . . . . . . . . c25520_2n0c 1 . 7 . 1007 . 1 1 8 HIS HB3 H 5.255 -4.945 -0.011 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HB3 . . . . . . . . . c25520_2n0c 1 . 7 . 1008 . 1 1 8 HIS HD1 H 3.525 -1.789 0.289 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HD1 . . . . . . . . . c25520_2n0c 1 . 7 . 1009 . 1 1 8 HIS HD2 H 6.431 -3.328 -2.337 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HD2 . . . . . . . . . c25520_2n0c 1 . 7 . 1010 . 1 1 8 HIS HE1 H 4.756 0.196 -0.713 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HE1 . . . . . . . . . c25520_2n0c 1 . 7 . 1011 . 1 1 8 HIS N N 2.376 -4.775 -1.734 . . . 1.0 . . . . . . . . . . . . A . 8 HIS N . . . . . . . . . c25520_2n0c 1 . 7 . 1012 . 1 1 8 HIS ND1 N 4.316 -1.857 -0.351 . . . 1.0 . . . . . . . . . . . . A . 8 HIS ND1 . . . . . . . . . c25520_2n0c 1 . 7 . 1013 . 1 1 8 HIS NE2 N 5.961 -1.288 -1.683 . . . 1.0 . . . . . . . . . . . . A . 8 HIS NE2 . . . . . . . . . c25520_2n0c 1 . 7 . 1014 . 1 1 8 HIS O O 4.831 -7.129 -0.663 . . . 1.0 . . . . . . . . . . . . A . 8 HIS O . . . . . . . . . c25520_2n0c 1 . 7 . 1015 . 1 1 9 LEU C C 2.345 -9.579 -2.820 . . . 1.0 . . . . . . . . . . . . A . 9 LEU C . . . . . . . . . c25520_2n0c 1 . 7 . 1016 . 1 1 9 LEU CA C 2.880 -8.871 -1.580 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CA . . . . . . . . . c25520_2n0c 1 . 7 . 1017 . 1 1 9 LEU CB C 2.029 -9.235 -0.363 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CB . . . . . . . . . c25520_2n0c 1 . 7 . 1018 . 1 1 9 LEU CD1 C -0.332 -9.517 0.432 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD1 . . . . . . . . . c25520_2n0c 1 . 7 . 1019 . 1 1 9 LEU CD2 C 0.698 -7.239 0.362 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD2 . . . . . . . . . c25520_2n0c 1 . 7 . 1020 . 1 1 9 LEU CG C 0.637 -8.605 -0.305 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CG . . . . . . . . . c25520_2n0c 1 . 7 . 1021 . 1 1 9 LEU H H 2.135 -6.982 -2.289 . . . 1.0 . . . . . . . . . . . . A . 9 LEU H . . . . . . . . . c25520_2n0c 1 . 7 . 1022 . 1 1 9 LEU HA H 3.903 -9.220 -1.413 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HA . . . . . . . . . c25520_2n0c 1 . 7 . 1023 . 1 1 9 LEU HB2 H 1.921 -10.322 -0.356 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB2 . . . . . . . . . c25520_2n0c 1 . 7 . 1024 . 1 1 9 LEU HB3 H 2.584 -8.946 0.532 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB3 . . . . . . . . . c25520_2n0c 1 . 7 . 1025 . 1 1 9 LEU HD11 H 0.100 -9.792 1.394 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD11 . . . . . . . . . c25520_2n0c 1 . 7 . 1026 . 1 1 9 LEU HD12 H -0.515 -10.417 -0.155 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD12 . . . . . . . . . c25520_2n0c 1 . 7 . 1027 . 1 1 9 LEU HD13 H -1.272 -8.991 0.594 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD13 . . . . . . . . . c25520_2n0c 1 . 7 . 1028 . 1 1 9 LEU HD21 H -0.309 -6.827 0.425 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD21 . . . . . . . . . c25520_2n0c 1 . 7 . 1029 . 1 1 9 LEU HD22 H 1.327 -6.562 -0.211 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD22 . . . . . . . . . c25520_2n0c 1 . 7 . 1030 . 1 1 9 LEU HD23 H 1.104 -7.349 1.367 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD23 . . . . . . . . . c25520_2n0c 1 . 7 . 1031 . 1 1 9 LEU HG H 0.280 -8.479 -1.328 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HG . . . . . . . . . c25520_2n0c 1 . 7 . 1032 . 1 1 9 LEU N N 2.895 -7.424 -1.771 . . . 1.0 . . . . . . . . . . . . A . 9 LEU N . . . . . . . . . c25520_2n0c 1 . 7 . 1033 . 1 1 9 LEU O O 1.634 -8.982 -3.628 . . . 1.0 . . . . . . . . . . . . A . 9 LEU O . . . . . . . . . c25520_2n0c 1 . 7 . 1034 . 1 1 10 MET C C 2.084 -13.113 -3.719 . . . 1.0 . . . . . . . . . . . . A . 10 MET C . . . . . . . . . c25520_2n0c 1 . 7 . 1035 . 1 1 10 MET CA C 2.239 -11.644 -4.103 . . . 1.0 . . . . . . . . . . . . A . 10 MET CA . . . . . . . . . c25520_2n0c 1 . 7 . 1036 . 1 1 10 MET CB C 3.227 -11.509 -5.264 . . . 1.0 . . . . . . . . . . . . A . 10 MET CB . . . . . . . . . c25520_2n0c 1 . 7 . 1037 . 1 1 10 MET CE C 7.274 -11.757 -4.990 . . . 1.0 . . . . . . . . . . . . A . 10 MET CE . . . . . . . . . c25520_2n0c 1 . 7 . 1038 . 1 1 10 MET CG C 4.544 -12.232 -5.029 . . . 1.0 . . . . . . . . . . . . A . 10 MET CG . . . . . . . . . c25520_2n0c 1 . 7 . 1039 . 1 1 10 MET H H 3.281 -11.291 -2.257 . . . 1.0 . . . . . . . . . . . . A . 10 MET H . . . . . . . . . c25520_2n0c 1 . 7 . 1040 . 1 1 10 MET HA H 1.264 -11.276 -4.430 . . . 1.0 . . . . . . . . . . . . A . 10 MET HA . . . . . . . . . c25520_2n0c 1 . 7 . 1041 . 1 1 10 MET HB2 H 2.767 -11.913 -6.166 . . . 1.0 . . . . . . . . . . . . A . 10 MET HB2 . . . . . . . . . c25520_2n0c 1 . 7 . 1042 . 1 1 10 MET HB3 H 3.436 -10.450 -5.420 . . . 1.0 . . . . . . . . . . . . A . 10 MET HB3 . . . . . . . . . c25520_2n0c 1 . 7 . 1043 . 1 1 10 MET HE1 H 7.137 -11.083 -4.144 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE1 . . . . . . . . . c25520_2n0c 1 . 7 . 1044 . 1 1 10 MET HE2 H 7.350 -12.782 -4.630 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE2 . . . . . . . . . c25520_2n0c 1 . 7 . 1045 . 1 1 10 MET HE3 H 8.186 -11.490 -5.524 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE3 . . . . . . . . . c25520_2n0c 1 . 7 . 1046 . 1 1 10 MET HG2 H 4.841 -12.082 -3.991 . . . 1.0 . . . . . . . . . . . . A . 10 MET HG2 . . . . . . . . . c25520_2n0c 1 . 7 . 1047 . 1 1 10 MET HG3 H 4.402 -13.299 -5.209 . . . 1.0 . . . . . . . . . . . . A . 10 MET HG3 . . . . . . . . . c25520_2n0c 1 . 7 . 1048 . 1 1 10 MET N N 2.689 -10.854 -2.963 . . . 1.0 . . . . . . . . . . . . A . 10 MET N . . . . . . . . . c25520_2n0c 1 . 7 . 1049 . 1 1 10 MET O O 2.770 -13.539 -2.804 . . . 1.0 . . . . . . . . . . . . A . 10 MET O . . . . . . . . . c25520_2n0c 1 . 7 . 1050 . 1 1 10 MET SD S 5.868 -11.623 -6.092 . . . 1.0 . . . . . . . . . . . . A . 10 MET SD . . . . . . . . . c25520_2n0c 1 . 8 . 1051 . 1 1 1 GLY C C -7.745 5.614 0.003 . . . 1.0 . . . . . . . . . . . . A . 1 GLY C . . . . . . . . . c25520_2n0c 1 . 8 . 1052 . 1 1 1 GLY CA C -8.267 6.662 -0.959 . . . 1.0 . . . . . . . . . . . . A . 1 GLY CA . . . . . . . . . c25520_2n0c 1 . 8 . 1053 . 1 1 1 GLY H1 H -10.109 5.999 -0.363 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H1 . . . . . . . . . c25520_2n0c 1 . 8 . 1054 . 1 1 1 GLY H2 H -9.967 6.278 -2.034 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H2 . . . . . . . . . c25520_2n0c 1 . 8 . 1055 . 1 1 1 GLY H3 H -10.095 7.586 -0.956 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H3 . . . . . . . . . c25520_2n0c 1 . 8 . 1056 . 1 1 1 GLY HA2 H -7.822 6.492 -1.939 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA2 . . . . . . . . . c25520_2n0c 1 . 8 . 1057 . 1 1 1 GLY HA3 H -7.967 7.647 -0.602 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA3 . . . . . . . . . c25520_2n0c 1 . 8 . 1058 . 1 1 1 GLY N N -9.712 6.629 -1.087 . . . 1.0 . . . . . . . . . . . . A . 1 GLY N . . . . . . . . . c25520_2n0c 1 . 8 . 1059 . 1 1 1 GLY O O -8.015 4.425 -0.159 . . . 1.0 . . . . . . . . . . . . A . 1 GLY O . . . . . . . . . c25520_2n0c 1 . 8 . 1060 . 1 1 2 ASN C C -5.501 4.130 1.339 . . . 1.0 . . . . . . . . . . . . A . 2 ASN C . . . . . . . . . c25520_2n0c 1 . 8 . 1061 . 1 1 2 ASN CA C -6.431 5.145 1.998 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CA . . . . . . . . . c25520_2n0c 1 . 8 . 1062 . 1 1 2 ASN CB C -7.550 4.418 2.747 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CB . . . . . . . . . c25520_2n0c 1 . 8 . 1063 . 1 1 2 ASN CG C -8.691 5.344 3.123 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CG . . . . . . . . . c25520_2n0c 1 . 8 . 1064 . 1 1 2 ASN H H -6.805 7.055 1.084 . . . 1.0 . . . . . . . . . . . . A . 2 ASN H . . . . . . . . . c25520_2n0c 1 . 8 . 1065 . 1 1 2 ASN HA H -5.859 5.727 2.721 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HA . . . . . . . . . c25520_2n0c 1 . 8 . 1066 . 1 1 2 ASN HB2 H -7.948 3.629 2.107 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HB2 . . . . . . . . . c25520_2n0c 1 . 8 . 1067 . 1 1 2 ASN HB3 H -7.140 3.969 3.652 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HB3 . . . . . . . . . c25520_2n0c 1 . 8 . 1068 . 1 1 2 ASN HD21 H -7.508 6.311 4.483 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HD21 . . . . . . . . . c25520_2n0c 1 . 8 . 1069 . 1 1 2 ASN HD22 H -9.165 6.906 4.333 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HD22 . . . . . . . . . c25520_2n0c 1 . 8 . 1070 . 1 1 2 ASN N N -6.994 6.055 1.007 . . . 1.0 . . . . . . . . . . . . A . 2 ASN N . . . . . . . . . c25520_2n0c 1 . 8 . 1071 . 1 1 2 ASN ND2 N -8.431 6.257 4.051 . . . 1.0 . . . . . . . . . . . . A . 2 ASN ND2 . . . . . . . . . c25520_2n0c 1 . 8 . 1072 . 1 1 2 ASN O O -5.468 2.961 1.725 . . . 1.0 . . . . . . . . . . . . A . 2 ASN O . . . . . . . . . c25520_2n0c 1 . 8 . 1073 . 1 1 2 ASN OD1 O -9.793 5.239 2.583 . . . 1.0 . . . . . . . . . . . . A . 2 ASN OD1 . . . . . . . . . c25520_2n0c 1 . 8 . 1074 . 1 1 3 HIS C C -2.372 4.086 -0.042 . . . 1.0 . . . . . . . . . . . . A . 3 HIS C . . . . . . . . . c25520_2n0c 1 . 8 . 1075 . 1 1 3 HIS CA C -3.817 3.718 -0.369 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CA . . . . . . . . . c25520_2n0c 1 . 8 . 1076 . 1 1 3 HIS CB C -4.051 3.814 -1.878 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CB . . . . . . . . . c25520_2n0c 1 . 8 . 1077 . 1 1 3 HIS CD2 C -6.105 3.403 -3.414 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CD2 . . . . . . . . . c25520_2n0c 1 . 8 . 1078 . 1 1 3 HIS CE1 C -7.010 1.767 -2.273 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CE1 . . . . . . . . . c25520_2n0c 1 . 8 . 1079 . 1 1 3 HIS CG C -5.327 3.152 -2.325 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CG . . . . . . . . . c25520_2n0c 1 . 8 . 1080 . 1 1 3 HIS H H -4.822 5.566 0.068 . . . 1.0 . . . . . . . . . . . . A . 3 HIS H . . . . . . . . . c25520_2n0c 1 . 8 . 1081 . 1 1 3 HIS HA H -3.980 2.678 -0.074 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HA . . . . . . . . . c25520_2n0c 1 . 8 . 1082 . 1 1 3 HIS HB2 H -4.088 4.866 -2.154 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HB2 . . . . . . . . . c25520_2n0c 1 . 8 . 1083 . 1 1 3 HIS HB3 H -3.214 3.343 -2.398 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HB3 . . . . . . . . . c25520_2n0c 1 . 8 . 1084 . 1 1 3 HIS HD1 H -5.568 1.700 -0.752 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HD1 . . . . . . . . . c25520_2n0c 1 . 8 . 1085 . 1 1 3 HIS HD2 H -6.041 4.274 -4.049 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HD2 . . . . . . . . . c25520_2n0c 1 . 8 . 1086 . 1 1 3 HIS HE1 H -7.684 0.982 -1.963 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HE1 . . . . . . . . . c25520_2n0c 1 . 8 . 1087 . 1 1 3 HIS N N -4.748 4.586 0.343 . . . 1.0 . . . . . . . . . . . . A . 3 HIS N . . . . . . . . . c25520_2n0c 1 . 8 . 1088 . 1 1 3 HIS ND1 N -5.913 2.117 -1.616 . . . 1.0 . . . . . . . . . . . . A . 3 HIS ND1 . . . . . . . . . c25520_2n0c 1 . 8 . 1089 . 1 1 3 HIS NE2 N -7.168 2.517 -3.367 . . . 1.0 . . . . . . . . . . . . A . 3 HIS NE2 . . . . . . . . . c25520_2n0c 1 . 8 . 1090 . 1 1 3 HIS O O -1.618 4.513 -0.916 . . . 1.0 . . . . . . . . . . . . A . 3 HIS O . . . . . . . . . c25520_2n0c 1 . 8 . 1091 . 1 1 4 TRP C C 0.312 3.087 1.354 . . . 1.0 . . . . . . . . . . . . A . 4 TRP C . . . . . . . . . c25520_2n0c 1 . 8 . 1092 . 1 1 4 TRP CA C -0.643 4.235 1.662 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CA . . . . . . . . . c25520_2n0c 1 . 8 . 1093 . 1 1 4 TRP CB C -0.631 4.536 3.162 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CB . . . . . . . . . c25520_2n0c 1 . 8 . 1094 . 1 1 4 TRP CD1 C -1.111 6.768 4.326 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CD1 . . . . . . . . . c25520_2n0c 1 . 8 . 1095 . 1 1 4 TRP CD2 C 0.648 6.812 2.940 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CD2 . . . . . . . . . c25520_2n0c 1 . 8 . 1096 . 1 1 4 TRP CE2 C 0.493 8.091 3.511 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CE2 . . . . . . . . . c25520_2n0c 1 . 8 . 1097 . 1 1 4 TRP CE3 C 1.691 6.601 2.034 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CE3 . . . . . . . . . c25520_2n0c 1 . 8 . 1098 . 1 1 4 TRP CG C -0.388 5.982 3.475 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CG . . . . . . . . . c25520_2n0c 1 . 8 . 1099 . 1 1 4 TRP CH2 C 2.357 8.915 2.314 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CH2 . . . . . . . . . c25520_2n0c 1 . 8 . 1100 . 1 1 4 TRP CZ2 C 1.343 9.150 3.204 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CZ2 . . . . . . . . . c25520_2n0c 1 . 8 . 1101 . 1 1 4 TRP CZ3 C 2.534 7.653 1.731 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CZ3 . . . . . . . . . c25520_2n0c 1 . 8 . 1102 . 1 1 4 TRP H H -2.668 3.560 1.898 . . . 1.0 . . . . . . . . . . . . A . 4 TRP H . . . . . . . . . c25520_2n0c 1 . 8 . 1103 . 1 1 4 TRP HA H -0.308 5.118 1.119 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HA . . . . . . . . . c25520_2n0c 1 . 8 . 1104 . 1 1 4 TRP HB2 H -1.601 4.263 3.573 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HB2 . . . . . . . . . c25520_2n0c 1 . 8 . 1105 . 1 1 4 TRP HB3 H 0.137 3.939 3.663 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HB3 . . . . . . . . . c25520_2n0c 1 . 8 . 1106 . 1 1 4 TRP HD1 H -1.969 6.440 4.894 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HD1 . . . . . . . . . c25520_2n0c 1 . 8 . 1107 . 1 1 4 TRP HE1 H -0.935 8.822 4.904 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HE1 . . . . . . . . . c25520_2n0c 1 . 8 . 1108 . 1 1 4 TRP HE3 H 1.847 5.632 1.587 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HE3 . . . . . . . . . c25520_2n0c 1 . 8 . 1109 . 1 1 4 TRP HH2 H 3.031 9.719 2.057 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HH2 . . . . . . . . . c25520_2n0c 1 . 8 . 1110 . 1 1 4 TRP HZ2 H 1.208 10.125 3.651 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HZ2 . . . . . . . . . c25520_2n0c 1 . 8 . 1111 . 1 1 4 TRP HZ3 H 3.342 7.495 1.033 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HZ3 . . . . . . . . . c25520_2n0c 1 . 8 . 1112 . 1 1 4 TRP N N -1.996 3.920 1.220 . . . 1.0 . . . . . . . . . . . . A . 4 TRP N . . . . . . . . . c25520_2n0c 1 . 8 . 1113 . 1 1 4 TRP NE1 N -0.587 8.038 4.353 . . . 1.0 . . . . . . . . . . . . A . 4 TRP NE1 . . . . . . . . . c25520_2n0c 1 . 8 . 1114 . 1 1 4 TRP O O 1.165 3.196 0.473 . . . 1.0 . . . . . . . . . . . . A . 4 TRP O . . . . . . . . . c25520_2n0c 1 . 8 . 1115 . 1 1 5 ALA C C 0.175 -0.444 1.709 . . . 1.0 . . . . . . . . . . . . A . 5 ALA C . . . . . . . . . c25520_2n0c 1 . 8 . 1116 . 1 1 5 ALA CA C 1.012 0.818 1.887 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CA . . . . . . . . . c25520_2n0c 1 . 8 . 1117 . 1 1 5 ALA CB C 1.970 0.658 3.058 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CB . . . . . . . . . c25520_2n0c 1 . 8 . 1118 . 1 1 5 ALA H H -0.562 1.960 2.801 . . . 1.0 . . . . . . . . . . . . A . 5 ALA H . . . . . . . . . c25520_2n0c 1 . 8 . 1119 . 1 1 5 ALA HA H 1.610 0.948 0.980 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HA . . . . . . . . . c25520_2n0c 1 . 8 . 1120 . 1 1 5 ALA HB1 H 2.558 1.568 3.176 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB1 . . . . . . . . . c25520_2n0c 1 . 8 . 1121 . 1 1 5 ALA HB2 H 2.638 -0.184 2.873 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB2 . . . . . . . . . c25520_2n0c 1 . 8 . 1122 . 1 1 5 ALA HB3 H 1.398 0.476 3.967 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB3 . . . . . . . . . c25520_2n0c 1 . 8 . 1123 . 1 1 5 ALA N N 0.163 1.987 2.084 . . . 1.0 . . . . . . . . . . . . A . 5 ALA N . . . . . . . . . c25520_2n0c 1 . 8 . 1124 . 1 1 5 ALA O O -0.213 -1.087 2.685 . . . 1.0 . . . . . . . . . . . . A . 5 ALA O . . . . . . . . . c25520_2n0c 1 . 8 . 1125 . 1 1 6 VAL C C -0.411 -2.647 -1.129 . . . 1.0 . . . . . . . . . . . . A . 6 VAL C . . . . . . . . . c25520_2n0c 1 . 8 . 1126 . 1 1 6 VAL CA C -0.895 -1.981 0.151 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CA . . . . . . . . . c25520_2n0c 1 . 8 . 1127 . 1 1 6 VAL CB C -2.388 -1.636 0.008 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CB . . . . . . . . . c25520_2n0c 1 . 8 . 1128 . 1 1 6 VAL CG1 C -3.193 -2.881 -0.332 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CG1 . . . . . . . . . c25520_2n0c 1 . 8 . 1129 . 1 1 6 VAL CG2 C -2.910 -0.983 1.278 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CG2 . . . . . . . . . c25520_2n0c 1 . 8 . 1130 . 1 1 6 VAL H H 0.251 -0.222 -0.311 . . . 1.0 . . . . . . . . . . . . A . 6 VAL H . . . . . . . . . c25520_2n0c 1 . 8 . 1131 . 1 1 6 VAL HA H -0.796 -2.700 0.967 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HA . . . . . . . . . c25520_2n0c 1 . 8 . 1132 . 1 1 6 VAL HB H -2.495 -0.927 -0.815 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HB . . . . . . . . . c25520_2n0c 1 . 8 . 1133 . 1 1 6 VAL HG11 H -4.259 -2.667 -0.240 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG11 . . . . . . . . . c25520_2n0c 1 . 8 . 1134 . 1 1 6 VAL HG12 H -2.922 -3.678 0.360 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG12 . . . . . . . . . c25520_2n0c 1 . 8 . 1135 . 1 1 6 VAL HG13 H -2.976 -3.197 -1.352 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG13 . . . . . . . . . c25520_2n0c 1 . 8 . 1136 . 1 1 6 VAL HG21 H -2.412 -0.025 1.433 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG21 . . . . . . . . . c25520_2n0c 1 . 8 . 1137 . 1 1 6 VAL HG22 H -2.705 -1.639 2.123 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG22 . . . . . . . . . c25520_2n0c 1 . 8 . 1138 . 1 1 6 VAL HG23 H -3.984 -0.822 1.196 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG23 . . . . . . . . . c25520_2n0c 1 . 8 . 1139 . 1 1 6 VAL N N -0.102 -0.794 0.457 . . . 1.0 . . . . . . . . . . . . A . 6 VAL N . . . . . . . . . c25520_2n0c 1 . 8 . 1140 . 1 1 6 VAL O O -0.242 -1.993 -2.158 . . . 1.0 . . . . . . . . . . . . A . 6 VAL O . . . . . . . . . c25520_2n0c 1 . 8 . 1141 . 1 1 7 GLY C C 1.703 -4.357 -2.593 . . . 1.0 . . . . . . . . . . . . A . 7 GLY C . . . . . . . . . c25520_2n0c 1 . 8 . 1142 . 1 1 7 GLY CA C 0.272 -4.693 -2.224 . . . 1.0 . . . . . . . . . . . . A . 7 GLY CA . . . . . . . . . c25520_2n0c 1 . 8 . 1143 . 1 1 7 GLY H H -0.348 -4.450 -0.183 . . . 1.0 . . . . . . . . . . . . A . 7 GLY H . . . . . . . . . c25520_2n0c 1 . 8 . 1144 . 1 1 7 GLY HA2 H 0.207 -5.760 -2.011 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA2 . . . . . . . . . c25520_2n0c 1 . 8 . 1145 . 1 1 7 GLY HA3 H -0.375 -4.461 -3.070 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA3 . . . . . . . . . c25520_2n0c 1 . 8 . 1146 . 1 1 7 GLY N N -0.190 -3.957 -1.062 . . . 1.0 . . . . . . . . . . . . A . 7 GLY N . . . . . . . . . c25520_2n0c 1 . 8 . 1147 . 1 1 7 GLY O O 1.952 -3.446 -3.383 . . . 1.0 . . . . . . . . . . . . A . 7 GLY O . . . . . . . . . c25520_2n0c 1 . 8 . 1148 . 1 1 8 HIS C C 4.680 -6.070 -3.000 . . . 1.0 . . . . . . . . . . . . A . 8 HIS C . . . . . . . . . c25520_2n0c 1 . 8 . 1149 . 1 1 8 HIS CA C 4.064 -4.867 -2.289 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CA . . . . . . . . . c25520_2n0c 1 . 8 . 1150 . 1 1 8 HIS CB C 4.815 -4.590 -0.986 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CB . . . . . . . . . c25520_2n0c 1 . 8 . 1151 . 1 1 8 HIS CD2 C 3.941 -2.773 0.652 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CD2 . . . . . . . . . c25520_2n0c 1 . 8 . 1152 . 1 1 8 HIS CE1 C 4.749 -1.022 -0.383 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CE1 . . . . . . . . . c25520_2n0c 1 . 8 . 1153 . 1 1 8 HIS CG C 4.606 -3.196 -0.460 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CG . . . . . . . . . c25520_2n0c 1 . 8 . 1154 . 1 1 8 HIS H H 2.381 -5.835 -1.371 . . . 1.0 . . . . . . . . . . . . A . 8 HIS H . . . . . . . . . c25520_2n0c 1 . 8 . 1155 . 1 1 8 HIS HA H 4.184 -3.993 -2.937 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HA . . . . . . . . . c25520_2n0c 1 . 8 . 1156 . 1 1 8 HIS HB2 H 4.476 -5.300 -0.234 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HB2 . . . . . . . . . c25520_2n0c 1 . 8 . 1157 . 1 1 8 HIS HB3 H 5.886 -4.734 -1.145 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HB3 . . . . . . . . . c25520_2n0c 1 . 8 . 1158 . 1 1 8 HIS HD1 H 5.654 -2.064 -1.963 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HD1 . . . . . . . . . c25520_2n0c 1 . 8 . 1159 . 1 1 8 HIS HD2 H 3.266 -3.369 1.249 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HD2 . . . . . . . . . c25520_2n0c 1 . 8 . 1160 . 1 1 8 HIS HE1 H 4.997 -0.001 -0.633 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HE1 . . . . . . . . . c25520_2n0c 1 . 8 . 1161 . 1 1 8 HIS N N 2.649 -5.093 -2.018 . . . 1.0 . . . . . . . . . . . . A . 8 HIS N . . . . . . . . . c25520_2n0c 1 . 8 . 1162 . 1 1 8 HIS ND1 N 5.109 -2.077 -1.101 . . . 1.0 . . . . . . . . . . . . A . 8 HIS ND1 . . . . . . . . . c25520_2n0c 1 . 8 . 1163 . 1 1 8 HIS NE2 N 4.041 -1.395 0.686 . . . 1.0 . . . . . . . . . . . . A . 8 HIS NE2 . . . . . . . . . c25520_2n0c 1 . 8 . 1164 . 1 1 8 HIS O O 5.840 -6.413 -2.769 . . . 1.0 . . . . . . . . . . . . A . 8 HIS O . . . . . . . . . c25520_2n0c 1 . 8 . 1165 . 1 1 9 LEU C C 5.192 -7.447 -5.816 . . . 1.0 . . . . . . . . . . . . A . 9 LEU C . . . . . . . . . c25520_2n0c 1 . 8 . 1166 . 1 1 9 LEU CA C 4.363 -7.869 -4.608 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CA . . . . . . . . . c25520_2n0c 1 . 8 . 1167 . 1 1 9 LEU CB C 3.175 -8.719 -5.061 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CB . . . . . . . . . c25520_2n0c 1 . 8 . 1168 . 1 1 9 LEU CD1 C 2.215 -11.010 -5.402 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD1 . . . . . . . . . c25520_2n0c 1 . 8 . 1169 . 1 1 9 LEU CD2 C 4.176 -10.265 -6.764 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD2 . . . . . . . . . c25520_2n0c 1 . 8 . 1170 . 1 1 9 LEU CG C 3.487 -10.176 -5.410 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CG . . . . . . . . . c25520_2n0c 1 . 8 . 1171 . 1 1 9 LEU H H 2.944 -6.368 -4.014 . . . 1.0 . . . . . . . . . . . . A . 9 LEU H . . . . . . . . . c25520_2n0c 1 . 8 . 1172 . 1 1 9 LEU HA H 4.986 -8.480 -3.955 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HA . . . . . . . . . c25520_2n0c 1 . 8 . 1173 . 1 1 9 LEU HB2 H 2.445 -8.711 -4.251 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB2 . . . . . . . . . c25520_2n0c 1 . 8 . 1174 . 1 1 9 LEU HB3 H 2.722 -8.241 -5.932 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB3 . . . . . . . . . c25520_2n0c 1 . 8 . 1175 . 1 1 9 LEU HD11 H 1.753 -10.972 -4.415 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD11 . . . . . . . . . c25520_2n0c 1 . 8 . 1176 . 1 1 9 LEU HD12 H 2.454 -12.043 -5.652 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD12 . . . . . . . . . c25520_2n0c 1 . 8 . 1177 . 1 1 9 LEU HD13 H 1.522 -10.609 -6.142 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD13 . . . . . . . . . c25520_2n0c 1 . 8 . 1178 . 1 1 9 LEU HD21 H 4.190 -11.305 -7.094 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD21 . . . . . . . . . c25520_2n0c 1 . 8 . 1179 . 1 1 9 LEU HD22 H 5.200 -9.902 -6.687 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD22 . . . . . . . . . c25520_2n0c 1 . 8 . 1180 . 1 1 9 LEU HD23 H 3.631 -9.665 -7.492 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD23 . . . . . . . . . c25520_2n0c 1 . 8 . 1181 . 1 1 9 LEU HG H 4.160 -10.573 -4.649 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HG . . . . . . . . . c25520_2n0c 1 . 8 . 1182 . 1 1 9 LEU N N 3.895 -6.705 -3.863 . . . 1.0 . . . . . . . . . . . . A . 9 LEU N . . . . . . . . . c25520_2n0c 1 . 8 . 1183 . 1 1 9 LEU O O 4.717 -6.709 -6.679 . . . 1.0 . . . . . . . . . . . . A . 9 LEU O . . . . . . . . . c25520_2n0c 1 . 8 . 1184 . 1 1 10 MET C C 6.980 -8.414 -8.217 . . . 1.0 . . . . . . . . . . . . A . 10 MET C . . . . . . . . . c25520_2n0c 1 . 8 . 1185 . 1 1 10 MET CA C 7.325 -7.594 -6.978 . . . 1.0 . . . . . . . . . . . . A . 10 MET CA . . . . . . . . . c25520_2n0c 1 . 8 . 1186 . 1 1 10 MET CB C 8.780 -7.845 -6.577 . . . 1.0 . . . . . . . . . . . . A . 10 MET CB . . . . . . . . . c25520_2n0c 1 . 8 . 1187 . 1 1 10 MET CE C 11.254 -5.193 -5.761 . . . 1.0 . . . . . . . . . . . . A . 10 MET CE . . . . . . . . . c25520_2n0c 1 . 8 . 1188 . 1 1 10 MET CG C 9.225 -7.039 -5.367 . . . 1.0 . . . . . . . . . . . . A . 10 MET CG . . . . . . . . . c25520_2n0c 1 . 8 . 1189 . 1 1 10 MET H H 6.767 -8.532 -5.128 . . . 1.0 . . . . . . . . . . . . A . 10 MET H . . . . . . . . . c25520_2n0c 1 . 8 . 1190 . 1 1 10 MET HA H 7.213 -6.537 -7.218 . . . 1.0 . . . . . . . . . . . . A . 10 MET HA . . . . . . . . . c25520_2n0c 1 . 8 . 1191 . 1 1 10 MET HB2 H 8.901 -8.906 -6.359 . . . 1.0 . . . . . . . . . . . . A . 10 MET HB2 . . . . . . . . . c25520_2n0c 1 . 8 . 1192 . 1 1 10 MET HB3 H 9.421 -7.583 -7.419 . . . 1.0 . . . . . . . . . . . . A . 10 MET HB3 . . . . . . . . . c25520_2n0c 1 . 8 . 1193 . 1 1 10 MET HE1 H 11.619 -5.149 -4.734 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE1 . . . . . . . . . c25520_2n0c 1 . 8 . 1194 . 1 1 10 MET HE2 H 11.662 -6.076 -6.254 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE2 . . . . . . . . . c25520_2n0c 1 . 8 . 1195 . 1 1 10 MET HE3 H 11.571 -4.299 -6.297 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE3 . . . . . . . . . c25520_2n0c 1 . 8 . 1196 . 1 1 10 MET HG2 H 8.461 -7.126 -4.596 . . . 1.0 . . . . . . . . . . . . A . 10 MET HG2 . . . . . . . . . c25520_2n0c 1 . 8 . 1197 . 1 1 10 MET HG3 H 10.161 -7.450 -4.986 . . . 1.0 . . . . . . . . . . . . A . 10 MET HG3 . . . . . . . . . c25520_2n0c 1 . 8 . 1198 . 1 1 10 MET N N 6.432 -7.921 -5.873 . . . 1.0 . . . . . . . . . . . . A . 10 MET N . . . . . . . . . c25520_2n0c 1 . 8 . 1199 . 1 1 10 MET O O 7.480 -9.522 -8.325 . . . 1.0 . . . . . . . . . . . . A . 10 MET O . . . . . . . . . c25520_2n0c 1 . 8 . 1200 . 1 1 10 MET SD S 9.466 -5.293 -5.748 . . . 1.0 . . . . . . . . . . . . A . 10 MET SD . . . . . . . . . c25520_2n0c 1 . 9 . 1201 . 1 1 1 GLY C C -8.411 4.818 1.461 . . . 1.0 . . . . . . . . . . . . A . 1 GLY C . . . . . . . . . c25520_2n0c 1 . 9 . 1202 . 1 1 1 GLY CA C -9.760 4.632 2.127 . . . 1.0 . . . . . . . . . . . . A . 1 GLY CA . . . . . . . . . c25520_2n0c 1 . 9 . 1203 . 1 1 1 GLY H1 H -10.720 3.094 1.174 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H1 . . . . . . . . . c25520_2n0c 1 . 9 . 1204 . 1 1 1 GLY H2 H -10.593 4.522 0.262 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H2 . . . . . . . . . c25520_2n0c 1 . 9 . 1205 . 1 1 1 GLY H3 H -11.710 4.422 1.538 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H3 . . . . . . . . . c25520_2n0c 1 . 9 . 1206 . 1 1 1 GLY HA2 H -10.092 5.591 2.526 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA2 . . . . . . . . . c25520_2n0c 1 . 9 . 1207 . 1 1 1 GLY HA3 H -9.653 3.925 2.950 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA3 . . . . . . . . . c25520_2n0c 1 . 9 . 1208 . 1 1 1 GLY N N -10.767 4.132 1.211 . . . 1.0 . . . . . . . . . . . . A . 1 GLY N . . . . . . . . . c25520_2n0c 1 . 9 . 1209 . 1 1 1 GLY O O -8.165 4.278 0.383 . . . 1.0 . . . . . . . . . . . . A . 1 GLY O . . . . . . . . . c25520_2n0c 1 . 9 . 1210 . 1 1 2 ASN C C -5.426 4.540 1.395 . . . 1.0 . . . . . . . . . . . . A . 2 ASN C . . . . . . . . . c25520_2n0c 1 . 9 . 1211 . 1 1 2 ASN CA C -6.205 5.841 1.565 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CA . . . . . . . . . c25520_2n0c 1 . 9 . 1212 . 1 1 2 ASN CB C -5.436 6.793 2.483 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CB . . . . . . . . . c25520_2n0c 1 . 9 . 1213 . 1 1 2 ASN CG C -5.850 8.239 2.294 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CG . . . . . . . . . c25520_2n0c 1 . 9 . 1214 . 1 1 2 ASN H H -7.802 6.004 2.995 . . . 1.0 . . . . . . . . . . . . A . 2 ASN H . . . . . . . . . c25520_2n0c 1 . 9 . 1215 . 1 1 2 ASN HA H -6.307 6.314 0.587 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HA . . . . . . . . . c25520_2n0c 1 . 9 . 1216 . 1 1 2 ASN HB2 H -5.633 6.512 3.517 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HB2 . . . . . . . . . c25520_2n0c 1 . 9 . 1217 . 1 1 2 ASN HB3 H -4.364 6.704 2.290 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HB3 . . . . . . . . . c25520_2n0c 1 . 9 . 1218 . 1 1 2 ASN HD21 H -4.123 8.640 1.271 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HD21 . . . . . . . . . c25520_2n0c 1 . 9 . 1219 . 1 1 2 ASN HD22 H -5.242 9.993 1.463 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HD22 . . . . . . . . . c25520_2n0c 1 . 9 . 1220 . 1 1 2 ASN N N -7.536 5.584 2.104 . . . 1.0 . . . . . . . . . . . . A . 2 ASN N . . . . . . . . . c25520_2n0c 1 . 9 . 1221 . 1 1 2 ASN ND2 N -5.004 9.014 1.623 . . . 1.0 . . . . . . . . . . . . A . 2 ASN ND2 . . . . . . . . . c25520_2n0c 1 . 9 . 1222 . 1 1 2 ASN O O -5.484 3.653 2.247 . . . 1.0 . . . . . . . . . . . . A . 2 ASN O . . . . . . . . . c25520_2n0c 1 . 9 . 1223 . 1 1 2 ASN OD1 O -6.918 8.655 2.744 . . . 1.0 . . . . . . . . . . . . A . 2 ASN OD1 . . . . . . . . . c25520_2n0c 1 . 9 . 1224 . 1 1 3 HIS C C -2.415 3.533 0.147 . . . 1.0 . . . . . . . . . . . . A . 3 HIS C . . . . . . . . . c25520_2n0c 1 . 9 . 1225 . 1 1 3 HIS CA C -3.905 3.241 0.007 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CA . . . . . . . . . c25520_2n0c 1 . 9 . 1226 . 1 1 3 HIS CB C -4.205 2.722 -1.400 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CB . . . . . . . . . c25520_2n0c 1 . 9 . 1227 . 1 1 3 HIS CD2 C -5.650 0.605 -1.816 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CD2 . . . . . . . . . c25520_2n0c 1 . 9 . 1228 . 1 1 3 HIS CE1 C -7.605 1.485 -1.372 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CE1 . . . . . . . . . c25520_2n0c 1 . 9 . 1229 . 1 1 3 HIS CG C -5.471 1.914 -1.483 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CG . . . . . . . . . c25520_2n0c 1 . 9 . 1230 . 1 1 3 HIS H H -4.689 5.203 -0.381 . . . 1.0 . . . . . . . . . . . . A . 3 HIS H . . . . . . . . . c25520_2n0c 1 . 9 . 1231 . 1 1 3 HIS HA H -4.160 2.451 0.718 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HA . . . . . . . . . c25520_2n0c 1 . 9 . 1232 . 1 1 3 HIS HB2 H -4.303 3.577 -2.067 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HB2 . . . . . . . . . c25520_2n0c 1 . 9 . 1233 . 1 1 3 HIS HB3 H -3.377 2.099 -1.748 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HB3 . . . . . . . . . c25520_2n0c 1 . 9 . 1234 . 1 1 3 HIS HD1 H -6.914 3.414 -0.927 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HD1 . . . . . . . . . c25520_2n0c 1 . 9 . 1235 . 1 1 3 HIS HD2 H -4.872 -0.142 -1.876 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HD2 . . . . . . . . . c25520_2n0c 1 . 9 . 1236 . 1 1 3 HIS HE1 H -8.669 1.603 -1.228 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HE1 . . . . . . . . . c25520_2n0c 1 . 9 . 1237 . 1 1 3 HIS N N -4.697 4.434 0.289 . . . 1.0 . . . . . . . . . . . . A . 3 HIS N . . . . . . . . . c25520_2n0c 1 . 9 . 1238 . 1 1 3 HIS ND1 N -6.716 2.453 -1.206 . . . 1.0 . . . . . . . . . . . . A . 3 HIS ND1 . . . . . . . . . c25520_2n0c 1 . 9 . 1239 . 1 1 3 HIS NE2 N -7.008 0.349 -1.740 . . . 1.0 . . . . . . . . . . . . A . 3 HIS NE2 . . . . . . . . . c25520_2n0c 1 . 9 . 1240 . 1 1 3 HIS O O -1.645 3.345 -0.795 . . . 1.0 . . . . . . . . . . . . A . 3 HIS O . . . . . . . . . c25520_2n0c 1 . 9 . 1241 . 1 1 4 TRP C C 0.285 3.136 1.243 . . . 1.0 . . . . . . . . . . . . A . 4 TRP C . . . . . . . . . c25520_2n0c 1 . 9 . 1242 . 1 1 4 TRP CA C -0.617 4.315 1.588 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CA . . . . . . . . . c25520_2n0c 1 . 9 . 1243 . 1 1 4 TRP CB C -0.428 4.707 3.055 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CB . . . . . . . . . c25520_2n0c 1 . 9 . 1244 . 1 1 4 TRP CD1 C -1.246 6.895 4.109 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CD1 . . . . . . . . . c25520_2n0c 1 . 9 . 1245 . 1 1 4 TRP CD2 C 0.447 7.145 2.663 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CD2 . . . . . . . . . c25520_2n0c 1 . 9 . 1246 . 1 1 4 TRP CE2 C 0.094 8.412 3.167 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CE2 . . . . . . . . . c25520_2n0c 1 . 9 . 1247 . 1 1 4 TRP CE3 C 1.489 7.054 1.737 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CE3 . . . . . . . . . c25520_2n0c 1 . 9 . 1248 . 1 1 4 TRP CG C -0.423 6.189 3.279 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CG . . . . . . . . . c25520_2n0c 1 . 9 . 1249 . 1 1 4 TRP CH2 C 1.765 9.459 1.864 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CH2 . . . . . . . . . c25520_2n0c 1 . 9 . 1250 . 1 1 4 TRP CZ2 C 0.748 9.577 2.773 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CZ2 . . . . . . . . . c25520_2n0c 1 . 9 . 1251 . 1 1 4 TRP CZ3 C 2.136 8.211 1.347 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CZ3 . . . . . . . . . c25520_2n0c 1 . 9 . 1252 . 1 1 4 TRP H H -2.702 4.127 2.068 . . . 1.0 . . . . . . . . . . . . A . 4 TRP H . . . . . . . . . c25520_2n0c 1 . 9 . 1253 . 1 1 4 TRP HA H -0.335 5.157 0.956 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HA . . . . . . . . . c25520_2n0c 1 . 9 . 1254 . 1 1 4 TRP HB2 H -1.249 4.282 3.629 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HB2 . . . . . . . . . c25520_2n0c 1 . 9 . 1255 . 1 1 4 TRP HB3 H 0.512 4.297 3.437 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HB3 . . . . . . . . . c25520_2n0c 1 . 9 . 1256 . 1 1 4 TRP HD1 H -2.022 6.466 4.725 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HD1 . . . . . . . . . c25520_2n0c 1 . 9 . 1257 . 1 1 4 TRP HE1 H -1.400 8.981 4.564 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HE1 . . . . . . . . . c25520_2n0c 1 . 9 . 1258 . 1 1 4 TRP HE3 H 1.783 6.096 1.337 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HE3 . . . . . . . . . c25520_2n0c 1 . 9 . 1259 . 1 1 4 TRP HH2 H 2.289 10.346 1.542 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HH2 . . . . . . . . . c25520_2n0c 1 . 9 . 1260 . 1 1 4 TRP HZ2 H 0.464 10.540 3.170 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HZ2 . . . . . . . . . c25520_2n0c 1 . 9 . 1261 . 1 1 4 TRP HZ3 H 2.943 8.147 0.632 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HZ3 . . . . . . . . . c25520_2n0c 1 . 9 . 1262 . 1 1 4 TRP N N -2.015 3.997 1.326 . . . 1.0 . . . . . . . . . . . . A . 4 TRP N . . . . . . . . . c25520_2n0c 1 . 9 . 1263 . 1 1 4 TRP NE1 N -0.940 8.233 4.046 . . . 1.0 . . . . . . . . . . . . A . 4 TRP NE1 . . . . . . . . . c25520_2n0c 1 . 9 . 1264 . 1 1 4 TRP O O 0.991 3.155 0.235 . . . 1.0 . . . . . . . . . . . . A . 4 TRP O . . . . . . . . . c25520_2n0c 1 . 9 . 1265 . 1 1 5 ALA C C 0.196 -0.307 1.629 . . . 1.0 . . . . . . . . . . . . A . 5 ALA C . . . . . . . . . c25520_2n0c 1 . 9 . 1266 . 1 1 5 ALA CA C 1.071 0.919 1.869 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CA . . . . . . . . . c25520_2n0c 1 . 9 . 1267 . 1 1 5 ALA CB C 1.996 0.688 3.054 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CB . . . . . . . . . c25520_2n0c 1 . 9 . 1268 . 1 1 5 ALA H H -0.348 2.155 2.906 . . . 1.0 . . . . . . . . . . . . A . 5 ALA H . . . . . . . . . c25520_2n0c 1 . 9 . 1269 . 1 1 5 ALA HA H 1.688 1.059 0.973 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HA . . . . . . . . . c25520_2n0c 1 . 9 . 1270 . 1 1 5 ALA HB1 H 3.018 0.518 2.709 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB1 . . . . . . . . . c25520_2n0c 1 . 9 . 1271 . 1 1 5 ALA HB2 H 1.670 -0.171 3.646 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB2 . . . . . . . . . c25520_2n0c 1 . 9 . 1272 . 1 1 5 ALA HB3 H 1.983 1.576 3.685 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB3 . . . . . . . . . c25520_2n0c 1 . 9 . 1273 . 1 1 5 ALA N N 0.257 2.109 2.086 . . . 1.0 . . . . . . . . . . . . A . 5 ALA N . . . . . . . . . c25520_2n0c 1 . 9 . 1274 . 1 1 5 ALA O O -0.271 -0.942 2.575 . . . 1.0 . . . . . . . . . . . . A . 5 ALA O . . . . . . . . . c25520_2n0c 1 . 9 . 1275 . 1 1 6 VAL C C -0.364 -2.406 -1.312 . . . 1.0 . . . . . . . . . . . . A . 6 VAL C . . . . . . . . . c25520_2n0c 1 . 9 . 1276 . 1 1 6 VAL CA C -0.839 -1.787 -0.004 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CA . . . . . . . . . c25520_2n0c 1 . 9 . 1277 . 1 1 6 VAL CB C -2.322 -1.400 -0.138 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CB . . . . . . . . . c25520_2n0c 1 . 9 . 1278 . 1 1 6 VAL CG1 C -3.156 -2.610 -0.531 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CG1 . . . . . . . . . c25520_2n0c 1 . 9 . 1279 . 1 1 6 VAL CG2 C -2.833 -0.788 1.157 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CG2 . . . . . . . . . c25520_2n0c 1 . 9 . 1280 . 1 1 6 VAL H H 0.401 -0.071 -0.380 . . . 1.0 . . . . . . . . . . . . A . 6 VAL H . . . . . . . . . c25520_2n0c 1 . 9 . 1281 . 1 1 6 VAL HA H -0.761 -2.544 0.779 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HA . . . . . . . . . c25520_2n0c 1 . 9 . 1282 . 1 1 6 VAL HB H -2.408 -0.655 -0.931 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HB . . . . . . . . . c25520_2n0c 1 . 9 . 1283 . 1 1 6 VAL HG11 H -2.921 -3.436 0.141 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG11 . . . . . . . . . c25520_2n0c 1 . 9 . 1284 . 1 1 6 VAL HG12 H -2.929 -2.901 -1.557 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG12 . . . . . . . . . c25520_2n0c 1 . 9 . 1285 . 1 1 6 VAL HG13 H -4.217 -2.371 -0.453 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG13 . . . . . . . . . c25520_2n0c 1 . 9 . 1286 . 1 1 6 VAL HG21 H -3.915 -0.666 1.109 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG21 . . . . . . . . . c25520_2n0c 1 . 9 . 1287 . 1 1 6 VAL HG22 H -2.369 0.185 1.313 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG22 . . . . . . . . . c25520_2n0c 1 . 9 . 1288 . 1 1 6 VAL HG23 H -2.579 -1.449 1.986 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG23 . . . . . . . . . c25520_2n0c 1 . 9 . 1289 . 1 1 6 VAL N N -0.020 -0.634 0.360 . . . 1.0 . . . . . . . . . . . . A . 6 VAL N . . . . . . . . . c25520_2n0c 1 . 9 . 1290 . 1 1 6 VAL O O -0.188 -1.711 -2.312 . . . 1.0 . . . . . . . . . . . . A . 6 VAL O . . . . . . . . . c25520_2n0c 1 . 9 . 1291 . 1 1 7 GLY C C 1.794 -4.329 -2.678 . . . 1.0 . . . . . . . . . . . . A . 7 GLY C . . . . . . . . . c25520_2n0c 1 . 9 . 1292 . 1 1 7 GLY CA C 0.292 -4.412 -2.492 . . . 1.0 . . . . . . . . . . . . A . 7 GLY CA . . . . . . . . . c25520_2n0c 1 . 9 . 1293 . 1 1 7 GLY H H -0.326 -4.247 -0.444 . . . 1.0 . . . . . . . . . . . . A . 7 GLY H . . . . . . . . . c25520_2n0c 1 . 9 . 1294 . 1 1 7 GLY HA2 H 0.011 -5.461 -2.411 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA2 . . . . . . . . . c25520_2n0c 1 . 9 . 1295 . 1 1 7 GLY HA3 H -0.198 -3.983 -3.370 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA3 . . . . . . . . . c25520_2n0c 1 . 9 . 1296 . 1 1 7 GLY N N -0.160 -3.720 -1.301 . . . 1.0 . . . . . . . . . . . . A . 7 GLY N . . . . . . . . . c25520_2n0c 1 . 9 . 1297 . 1 1 7 GLY O O 2.283 -3.574 -3.519 . . . 1.0 . . . . . . . . . . . . A . 7 GLY O . . . . . . . . . c25520_2n0c 1 . 9 . 1298 . 1 1 8 HIS C C 4.478 -6.329 -2.755 . . . 1.0 . . . . . . . . . . . . A . 8 HIS C . . . . . . . . . c25520_2n0c 1 . 9 . 1299 . 1 1 8 HIS CA C 3.986 -5.117 -1.970 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CA . . . . . . . . . c25520_2n0c 1 . 9 . 1300 . 1 1 8 HIS CB C 4.596 -5.122 -0.568 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CB . . . . . . . . . c25520_2n0c 1 . 9 . 1301 . 1 1 8 HIS CD2 C 5.300 -2.669 -0.090 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CD2 . . . . . . . . . c25520_2n0c 1 . 9 . 1302 . 1 1 8 HIS CE1 C 3.866 -2.252 1.511 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CE1 . . . . . . . . . c25520_2n0c 1 . 9 . 1303 . 1 1 8 HIS CG C 4.546 -3.784 0.117 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CG . . . . . . . . . c25520_2n0c 1 . 9 . 1304 . 1 1 8 HIS H H 2.065 -5.712 -1.212 . . . 1.0 . . . . . . . . . . . . A . 8 HIS H . . . . . . . . . c25520_2n0c 1 . 9 . 1305 . 1 1 8 HIS HA H 4.329 -4.214 -2.482 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HA . . . . . . . . . c25520_2n0c 1 . 9 . 1306 . 1 1 8 HIS HB2 H 4.048 -5.837 0.043 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HB2 . . . . . . . . . c25520_2n0c 1 . 9 . 1307 . 1 1 8 HIS HB3 H 5.640 -5.438 -0.626 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HB3 . . . . . . . . . c25520_2n0c 1 . 9 . 1308 . 1 1 8 HIS HD1 H 2.946 -4.136 1.517 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HD1 . . . . . . . . . c25520_2n0c 1 . 9 . 1309 . 1 1 8 HIS HD2 H 6.221 -2.626 -0.653 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HD2 . . . . . . . . . c25520_2n0c 1 . 9 . 1310 . 1 1 8 HIS HE1 H 3.322 -1.752 2.295 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HE1 . . . . . . . . . c25520_2n0c 1 . 9 . 1311 . 1 1 8 HIS N N 2.529 -5.107 -1.889 . . . 1.0 . . . . . . . . . . . . A . 8 HIS N . . . . . . . . . c25520_2n0c 1 . 9 . 1312 . 1 1 8 HIS ND1 N 3.646 -3.502 1.132 . . . 1.0 . . . . . . . . . . . . A . 8 HIS ND1 . . . . . . . . . c25520_2n0c 1 . 9 . 1313 . 1 1 8 HIS NE2 N 4.857 -1.707 0.801 . . . 1.0 . . . . . . . . . . . . A . 8 HIS NE2 . . . . . . . . . c25520_2n0c 1 . 9 . 1314 . 1 1 8 HIS O O 5.422 -7.006 -2.346 . . . 1.0 . . . . . . . . . . . . A . 8 HIS O . . . . . . . . . c25520_2n0c 1 . 9 . 1315 . 1 1 9 LEU C C 3.785 -7.488 -6.176 . . . 1.0 . . . . . . . . . . . . A . 9 LEU C . . . . . . . . . c25520_2n0c 1 . 9 . 1316 . 1 1 9 LEU CA C 4.204 -7.727 -4.729 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CA . . . . . . . . . c25520_2n0c 1 . 9 . 1317 . 1 1 9 LEU CB C 3.560 -9.013 -4.206 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CB . . . . . . . . . c25520_2n0c 1 . 9 . 1318 . 1 1 9 LEU CD1 C 5.435 -10.675 -4.112 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD1 . . . . . . . . . c25520_2n0c 1 . 9 . 1319 . 1 1 9 LEU CD2 C 3.105 -11.447 -4.597 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD2 . . . . . . . . . c25520_2n0c 1 . 9 . 1320 . 1 1 9 LEU CG C 4.112 -10.320 -4.775 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CG . . . . . . . . . c25520_2n0c 1 . 9 . 1321 . 1 1 9 LEU H H 3.061 -5.995 -4.175 . . . 1.0 . . . . . . . . . . . . A . 9 LEU H . . . . . . . . . c25520_2n0c 1 . 9 . 1322 . 1 1 9 LEU HA H 5.284 -7.848 -4.699 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HA . . . . . . . . . c25520_2n0c 1 . 9 . 1323 . 1 1 9 LEU HB2 H 3.678 -9.035 -3.123 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB2 . . . . . . . . . c25520_2n0c 1 . 9 . 1324 . 1 1 9 LEU HB3 H 2.491 -8.957 -4.432 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB3 . . . . . . . . . c25520_2n0c 1 . 9 . 1325 . 1 1 9 LEU HD11 H 6.201 -9.949 -4.378 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD11 . . . . . . . . . c25520_2n0c 1 . 9 . 1326 . 1 1 9 LEU HD12 H 5.749 -11.664 -4.446 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD12 . . . . . . . . . c25520_2n0c 1 . 9 . 1327 . 1 1 9 LEU HD13 H 5.305 -10.685 -3.030 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD13 . . . . . . . . . c25520_2n0c 1 . 9 . 1328 . 1 1 9 LEU HD21 H 3.554 -12.391 -4.906 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD21 . . . . . . . . . c25520_2n0c 1 . 9 . 1329 . 1 1 9 LEU HD22 H 2.219 -11.250 -5.201 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD22 . . . . . . . . . c25520_2n0c 1 . 9 . 1330 . 1 1 9 LEU HD23 H 2.821 -11.508 -3.546 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD23 . . . . . . . . . c25520_2n0c 1 . 9 . 1331 . 1 1 9 LEU HG H 4.288 -10.176 -5.842 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HG . . . . . . . . . c25520_2n0c 1 . 9 . 1332 . 1 1 9 LEU N N 3.832 -6.597 -3.886 . . . 1.0 . . . . . . . . . . . . A . 9 LEU N . . . . . . . . . c25520_2n0c 1 . 9 . 1333 . 1 1 9 LEU O O 2.601 -7.330 -6.472 . . . 1.0 . . . . . . . . . . . . A . 9 LEU O . . . . . . . . . c25520_2n0c 1 . 9 . 1334 . 1 1 10 MET C C 3.631 -8.369 -9.058 . . . 1.0 . . . . . . . . . . . . A . 10 MET C . . . . . . . . . c25520_2n0c 1 . 9 . 1335 . 1 1 10 MET CA C 4.497 -7.248 -8.491 . . . 1.0 . . . . . . . . . . . . A . 10 MET CA . . . . . . . . . c25520_2n0c 1 . 9 . 1336 . 1 1 10 MET CB C 5.810 -7.157 -9.272 . . . 1.0 . . . . . . . . . . . . A . 10 MET CB . . . . . . . . . c25520_2n0c 1 . 9 . 1337 . 1 1 10 MET CE C 8.573 -10.122 -10.247 . . . 1.0 . . . . . . . . . . . . A . 10 MET CE . . . . . . . . . c25520_2n0c 1 . 9 . 1338 . 1 1 10 MET CG C 6.644 -8.426 -9.209 . . . 1.0 . . . . . . . . . . . . A . 10 MET CG . . . . . . . . . c25520_2n0c 1 . 9 . 1339 . 1 1 10 MET H H 5.727 -7.605 -6.766 . . . 1.0 . . . . . . . . . . . . A . 10 MET H . . . . . . . . . c25520_2n0c 1 . 9 . 1340 . 1 1 10 MET HA H 3.961 -6.307 -8.599 . . . 1.0 . . . . . . . . . . . . A . 10 MET HA . . . . . . . . . c25520_2n0c 1 . 9 . 1341 . 1 1 10 MET HB2 H 5.580 -6.952 -10.318 . . . 1.0 . . . . . . . . . . . . A . 10 MET HB2 . . . . . . . . . c25520_2n0c 1 . 9 . 1342 . 1 1 10 MET HB3 H 6.399 -6.330 -8.873 . . . 1.0 . . . . . . . . . . . . A . 10 MET HB3 . . . . . . . . . c25520_2n0c 1 . 9 . 1343 . 1 1 10 MET HE1 H 8.861 -10.292 -9.210 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE1 . . . . . . . . . c25520_2n0c 1 . 9 . 1344 . 1 1 10 MET HE2 H 9.437 -10.277 -10.894 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE2 . . . . . . . . . c25520_2n0c 1 . 9 . 1345 . 1 1 10 MET HE3 H 7.783 -10.820 -10.524 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE3 . . . . . . . . . c25520_2n0c 1 . 9 . 1346 . 1 1 10 MET HG2 H 7.083 -8.506 -8.216 . . . 1.0 . . . . . . . . . . . . A . 10 MET HG2 . . . . . . . . . c25520_2n0c 1 . 9 . 1347 . 1 1 10 MET HG3 H 6.004 -9.289 -9.383 . . . 1.0 . . . . . . . . . . . . A . 10 MET HG3 . . . . . . . . . c25520_2n0c 1 . 9 . 1348 . 1 1 10 MET N N 4.765 -7.464 -7.074 . . . 1.0 . . . . . . . . . . . . A . 10 MET N . . . . . . . . . c25520_2n0c 1 . 9 . 1349 . 1 1 10 MET O O 3.575 -9.419 -8.440 . . . 1.0 . . . . . . . . . . . . A . 10 MET O . . . . . . . . . c25520_2n0c 1 . 9 . 1350 . 1 1 10 MET SD S 7.973 -8.444 -10.427 . . . 1.0 . . . . . . . . . . . . A . 10 MET SD . . . . . . . . . c25520_2n0c 1 . 10 . 1351 . 1 1 1 GLY C C -8.335 3.304 4.535 . . . 1.0 . . . . . . . . . . . . A . 1 GLY C . . . . . . . . . c25520_2n0c 1 . 10 . 1352 . 1 1 1 GLY CA C -9.277 2.235 5.052 . . . 1.0 . . . . . . . . . . . . A . 1 GLY CA . . . . . . . . . c25520_2n0c 1 . 10 . 1353 . 1 1 1 GLY H1 H -9.789 3.557 6.530 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H1 . . . . . . . . . c25520_2n0c 1 . 10 . 1354 . 1 1 1 GLY H2 H -9.148 2.086 7.091 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H2 . . . . . . . . . c25520_2n0c 1 . 10 . 1355 . 1 1 1 GLY H3 H -10.737 2.152 6.488 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H3 . . . . . . . . . c25520_2n0c 1 . 10 . 1356 . 1 1 1 GLY HA2 H -8.749 1.282 5.075 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA2 . . . . . . . . . c25520_2n0c 1 . 10 . 1357 . 1 1 1 GLY HA3 H -10.125 2.153 4.371 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA3 . . . . . . . . . c25520_2n0c 1 . 10 . 1358 . 1 1 1 GLY N N -9.773 2.528 6.384 . . . 1.0 . . . . . . . . . . . . A . 1 GLY N . . . . . . . . . c25520_2n0c 1 . 10 . 1359 . 1 1 1 GLY O O -8.685 4.481 4.494 . . . 1.0 . . . . . . . . . . . . A . 1 GLY O . . . . . . . . . c25520_2n0c 1 . 10 . 1360 . 1 1 2 ASN C C -5.324 3.185 2.503 . . . 1.0 . . . . . . . . . . . . A . 2 ASN C . . . . . . . . . c25520_2n0c 1 . 10 . 1361 . 1 1 2 ASN CA C -6.137 3.823 3.626 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CA . . . . . . . . . c25520_2n0c 1 . 10 . 1362 . 1 1 2 ASN CB C -5.206 4.277 4.751 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CB . . . . . . . . . c25520_2n0c 1 . 10 . 1363 . 1 1 2 ASN CG C -4.572 5.626 4.468 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CG . . . . . . . . . c25520_2n0c 1 . 10 . 1364 . 1 1 2 ASN H H -6.903 1.900 4.199 . . . 1.0 . . . . . . . . . . . . A . 2 ASN H . . . . . . . . . c25520_2n0c 1 . 10 . 1365 . 1 1 2 ASN HA H -6.646 4.703 3.221 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HA . . . . . . . . . c25520_2n0c 1 . 10 . 1366 . 1 1 2 ASN HB2 H -5.786 4.352 5.670 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HB2 . . . . . . . . . c25520_2n0c 1 . 10 . 1367 . 1 1 2 ASN HB3 H -4.419 3.533 4.894 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HB3 . . . . . . . . . c25520_2n0c 1 . 10 . 1368 . 1 1 2 ASN HD21 H -3.580 5.580 6.256 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HD21 . . . . . . . . . c25520_2n0c 1 . 10 . 1369 . 1 1 2 ASN HD22 H -3.305 7.008 5.254 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HD22 . . . . . . . . . c25520_2n0c 1 . 10 . 1370 . 1 1 2 ASN N N -7.134 2.891 4.141 . . . 1.0 . . . . . . . . . . . . A . 2 ASN N . . . . . . . . . c25520_2n0c 1 . 10 . 1371 . 1 1 2 ASN ND2 N -3.757 6.105 5.401 . . . 1.0 . . . . . . . . . . . . A . 2 ASN ND2 . . . . . . . . . c25520_2n0c 1 . 10 . 1372 . 1 1 2 ASN O O -5.028 1.990 2.539 . . . 1.0 . . . . . . . . . . . . A . 2 ASN O . . . . . . . . . c25520_2n0c 1 . 10 . 1373 . 1 1 2 ASN OD1 O -4.812 6.230 3.422 . . . 1.0 . . . . . . . . . . . . A . 2 ASN OD1 . . . . . . . . . c25520_2n0c 1 . 10 . 1374 . 1 1 3 HIS C C -2.742 3.988 0.463 . . . 1.0 . . . . . . . . . . . . A . 3 HIS C . . . . . . . . . c25520_2n0c 1 . 10 . 1375 . 1 1 3 HIS CA C -4.187 3.505 0.375 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CA . . . . . . . . . c25520_2n0c 1 . 10 . 1376 . 1 1 3 HIS CB C -4.815 3.969 -0.940 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CB . . . . . . . . . c25520_2n0c 1 . 10 . 1377 . 1 1 3 HIS CD2 C -5.075 1.946 -2.547 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CD2 . . . . . . . . . c25520_2n0c 1 . 10 . 1378 . 1 1 3 HIS CE1 C -3.401 2.406 -3.881 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CE1 . . . . . . . . . c25520_2n0c 1 . 10 . 1379 . 1 1 3 HIS CG C -4.477 3.090 -2.112 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CG . . . . . . . . . c25520_2n0c 1 . 10 . 1380 . 1 1 3 HIS H H -5.243 4.972 1.537 . . . 1.0 . . . . . . . . . . . . A . 3 HIS H . . . . . . . . . c25520_2n0c 1 . 10 . 1381 . 1 1 3 HIS HA H -4.182 2.411 0.379 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HA . . . . . . . . . c25520_2n0c 1 . 10 . 1382 . 1 1 3 HIS HB2 H -5.897 3.979 -0.818 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HB2 . . . . . . . . . c25520_2n0c 1 . 10 . 1383 . 1 1 3 HIS HB3 H -4.480 4.986 -1.155 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HB3 . . . . . . . . . c25520_2n0c 1 . 10 . 1384 . 1 1 3 HIS HD1 H -2.782 4.156 -2.906 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HD1 . . . . . . . . . c25520_2n0c 1 . 10 . 1385 . 1 1 3 HIS HD2 H -6.041 1.581 -2.232 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HD2 . . . . . . . . . c25520_2n0c 1 . 10 . 1386 . 1 1 3 HIS HE1 H -2.686 2.347 -4.688 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HE1 . . . . . . . . . c25520_2n0c 1 . 10 . 1387 . 1 1 3 HIS N N -4.967 3.990 1.508 . . . 1.0 . . . . . . . . . . . . A . 3 HIS N . . . . . . . . . c25520_2n0c 1 . 10 . 1388 . 1 1 3 HIS ND1 N -3.423 3.365 -2.968 . . . 1.0 . . . . . . . . . . . . A . 3 HIS ND1 . . . . . . . . . c25520_2n0c 1 . 10 . 1389 . 1 1 3 HIS NE2 N -4.382 1.525 -3.667 . . . 1.0 . . . . . . . . . . . . A . 3 HIS NE2 . . . . . . . . . c25520_2n0c 1 . 10 . 1390 . 1 1 3 HIS O O -2.143 4.368 -0.543 . . . 1.0 . . . . . . . . . . . . A . 3 HIS O . . . . . . . . . c25520_2n0c 1 . 10 . 1391 . 1 1 4 TRP C C 0.170 3.455 1.224 . . . 1.0 . . . . . . . . . . . . A . 4 TRP C . . . . . . . . . c25520_2n0c 1 . 10 . 1392 . 1 1 4 TRP CA C -0.817 4.408 1.890 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CA . . . . . . . . . c25520_2n0c 1 . 10 . 1393 . 1 1 4 TRP CB C -0.522 4.502 3.388 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CB . . . . . . . . . c25520_2n0c 1 . 10 . 1394 . 1 1 4 TRP CD1 C -0.572 6.532 4.953 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CD1 . . . . . . . . . c25520_2n0c 1 . 10 . 1395 . 1 1 4 TRP CD2 C 0.750 6.781 3.163 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CD2 . . . . . . . . . c25520_2n0c 1 . 10 . 1396 . 1 1 4 TRP CE2 C 0.812 7.958 3.935 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CE2 . . . . . . . . . c25520_2n0c 1 . 10 . 1397 . 1 1 4 TRP CE3 C 1.503 6.708 1.988 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CE3 . . . . . . . . . c25520_2n0c 1 . 10 . 1398 . 1 1 4 TRP CG C -0.140 5.882 3.832 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CG . . . . . . . . . c25520_2n0c 1 . 10 . 1399 . 1 1 4 TRP CH2 C 2.321 8.949 2.412 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CH2 . . . . . . . . . c25520_2n0c 1 . 10 . 1400 . 1 1 4 TRP CZ2 C 1.595 9.049 3.568 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CZ2 . . . . . . . . . c25520_2n0c 1 . 10 . 1401 . 1 1 4 TRP CZ3 C 2.279 7.791 1.624 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CZ3 . . . . . . . . . c25520_2n0c 1 . 10 . 1402 . 1 1 4 TRP H H -2.740 3.639 2.465 . . . 1.0 . . . . . . . . . . . . A . 4 TRP H . . . . . . . . . c25520_2n0c 1 . 10 . 1403 . 1 1 4 TRP HA H -0.717 5.393 1.438 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HA . . . . . . . . . c25520_2n0c 1 . 10 . 1404 . 1 1 4 TRP HB2 H -1.420 4.214 3.934 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HB2 . . . . . . . . . c25520_2n0c 1 . 10 . 1405 . 1 1 4 TRP HB3 H 0.282 3.811 3.662 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HB3 . . . . . . . . . c25520_2n0c 1 . 10 . 1406 . 1 1 4 TRP HD1 H -1.260 6.124 5.679 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HD1 . . . . . . . . . c25520_2n0c 1 . 10 . 1407 . 1 1 4 TRP HE1 H -0.155 8.472 5.754 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HE1 . . . . . . . . . c25520_2n0c 1 . 10 . 1408 . 1 1 4 TRP HE3 H 1.492 5.818 1.379 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HE3 . . . . . . . . . c25520_2n0c 1 . 10 . 1409 . 1 1 4 TRP HH2 H 2.936 9.781 2.103 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HH2 . . . . . . . . . c25520_2n0c 1 . 10 . 1410 . 1 1 4 TRP HZ2 H 1.627 9.944 4.171 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HZ2 . . . . . . . . . c25520_2n0c 1 . 10 . 1411 . 1 1 4 TRP HZ3 H 2.862 7.739 0.716 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HZ3 . . . . . . . . . c25520_2n0c 1 . 10 . 1412 . 1 1 4 TRP N N -2.191 3.971 1.671 . . . 1.0 . . . . . . . . . . . . A . 4 TRP N . . . . . . . . . c25520_2n0c 1 . 10 . 1413 . 1 1 4 TRP NE1 N -0.003 7.780 5.020 . . . 1.0 . . . . . . . . . . . . A . 4 TRP NE1 . . . . . . . . . c25520_2n0c 1 . 10 . 1414 . 1 1 4 TRP O O 0.842 3.817 0.259 . . . 1.0 . . . . . . . . . . . . A . 4 TRP O . . . . . . . . . c25520_2n0c 1 . 10 . 1415 . 1 1 5 ALA C C 0.451 -0.112 1.040 . . . 1.0 . . . . . . . . . . . . A . 5 ALA C . . . . . . . . . c25520_2n0c 1 . 10 . 1416 . 1 1 5 ALA CA C 1.156 1.231 1.201 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CA . . . . . . . . . c25520_2n0c 1 . 10 . 1417 . 1 1 5 ALA CB C 2.381 1.083 2.092 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CB . . . . . . . . . c25520_2n0c 1 . 10 . 1418 . 1 1 5 ALA H H -0.329 1.998 2.549 . . . 1.0 . . . . . . . . . . . . A . 5 ALA H . . . . . . . . . c25520_2n0c 1 . 10 . 1419 . 1 1 5 ALA HA H 1.497 1.547 0.211 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HA . . . . . . . . . c25520_2n0c 1 . 10 . 1420 . 1 1 5 ALA HB1 H 2.837 2.060 2.249 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB1 . . . . . . . . . c25520_2n0c 1 . 10 . 1421 . 1 1 5 ALA HB2 H 3.102 0.416 1.618 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB2 . . . . . . . . . c25520_2n0c 1 . 10 . 1422 . 1 1 5 ALA HB3 H 2.077 0.666 3.052 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB3 . . . . . . . . . c25520_2n0c 1 . 10 . 1423 . 1 1 5 ALA N N 0.253 2.236 1.747 . . . 1.0 . . . . . . . . . . . . A . 5 ALA N . . . . . . . . . c25520_2n0c 1 . 10 . 1424 . 1 1 5 ALA O O 0.147 -0.786 2.024 . . . 1.0 . . . . . . . . . . . . A . 5 ALA O . . . . . . . . . c25520_2n0c 1 . 10 . 1425 . 1 1 6 VAL C C -0.012 -2.331 -1.830 . . . 1.0 . . . . . . . . . . . . A . 6 VAL C . . . . . . . . . c25520_2n0c 1 . 10 . 1426 . 1 1 6 VAL CA C -0.476 -1.758 -0.498 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CA . . . . . . . . . c25520_2n0c 1 . 10 . 1427 . 1 1 6 VAL CB C -2.005 -1.587 -0.527 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CB . . . . . . . . . c25520_2n0c 1 . 10 . 1428 . 1 1 6 VAL CG1 C -2.423 -0.719 -1.705 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CG1 . . . . . . . . . c25520_2n0c 1 . 10 . 1429 . 1 1 6 VAL CG2 C -2.691 -2.943 -0.585 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CG2 . . . . . . . . . c25520_2n0c 1 . 10 . 1430 . 1 1 6 VAL H H 0.476 0.109 -0.981 . . . 1.0 . . . . . . . . . . . . A . 6 VAL H . . . . . . . . . c25520_2n0c 1 . 10 . 1431 . 1 1 6 VAL HA H -0.227 -2.480 0.284 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HA . . . . . . . . . c25520_2n0c 1 . 10 . 1432 . 1 1 6 VAL HB H -2.310 -1.084 0.392 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HB . . . . . . . . . c25520_2n0c 1 . 10 . 1433 . 1 1 6 VAL HG11 H -2.321 -1.295 -2.625 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG11 . . . . . . . . . c25520_2n0c 1 . 10 . 1434 . 1 1 6 VAL HG12 H -1.785 0.163 -1.755 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG12 . . . . . . . . . c25520_2n0c 1 . 10 . 1435 . 1 1 6 VAL HG13 H -3.461 -0.411 -1.585 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG13 . . . . . . . . . c25520_2n0c 1 . 10 . 1436 . 1 1 6 VAL HG21 H -3.769 -2.811 -0.501 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG21 . . . . . . . . . c25520_2n0c 1 . 10 . 1437 . 1 1 6 VAL HG22 H -2.336 -3.570 0.232 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG22 . . . . . . . . . c25520_2n0c 1 . 10 . 1438 . 1 1 6 VAL HG23 H -2.457 -3.420 -1.537 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG23 . . . . . . . . . c25520_2n0c 1 . 10 . 1439 . 1 1 6 VAL N N 0.195 -0.494 -0.207 . . . 1.0 . . . . . . . . . . . . A . 6 VAL N . . . . . . . . . c25520_2n0c 1 . 10 . 1440 . 1 1 6 VAL O O 0.157 -1.602 -2.807 . . . 1.0 . . . . . . . . . . . . A . 6 VAL O . . . . . . . . . c25520_2n0c 1 . 10 . 1441 . 1 1 7 GLY C C 2.052 -4.821 -2.979 . . . 1.0 . . . . . . . . . . . . A . 7 GLY C . . . . . . . . . c25520_2n0c 1 . 10 . 1442 . 1 1 7 GLY CA C 0.635 -4.295 -3.083 . . . 1.0 . . . . . . . . . . . . A . 7 GLY CA . . . . . . . . . c25520_2n0c 1 . 10 . 1443 . 1 1 7 GLY H H 0.037 -4.199 -1.024 . . . 1.0 . . . . . . . . . . . . A . 7 GLY H . . . . . . . . . c25520_2n0c 1 . 10 . 1444 . 1 1 7 GLY HA2 H -0.027 -5.140 -3.276 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA2 . . . . . . . . . c25520_2n0c 1 . 10 . 1445 . 1 1 7 GLY HA3 H 0.577 -3.608 -3.931 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA3 . . . . . . . . . c25520_2n0c 1 . 10 . 1446 . 1 1 7 GLY N N 0.193 -3.644 -1.865 . . . 1.0 . . . . . . . . . . . . A . 7 GLY N . . . . . . . . . c25520_2n0c 1 . 10 . 1447 . 1 1 7 GLY O O 2.740 -4.981 -3.988 . . . 1.0 . . . . . . . . . . . . A . 7 GLY O . . . . . . . . . c25520_2n0c 1 . 10 . 1448 . 1 1 8 HIS C C 3.810 -7.102 -1.239 . . . 1.0 . . . . . . . . . . . . A . 8 HIS C . . . . . . . . . c25520_2n0c 1 . 10 . 1449 . 1 1 8 HIS CA C 3.839 -5.603 -1.521 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CA . . . . . . . . . c25520_2n0c 1 . 10 . 1450 . 1 1 8 HIS CB C 4.494 -4.865 -0.353 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CB . . . . . . . . . c25520_2n0c 1 . 10 . 1451 . 1 1 8 HIS CD2 C 6.096 -3.155 -1.474 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CD2 . . . . . . . . . c25520_2n0c 1 . 10 . 1452 . 1 1 8 HIS CE1 C 5.118 -1.326 -0.775 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CE1 . . . . . . . . . c25520_2n0c 1 . 10 . 1453 . 1 1 8 HIS CG C 5.018 -3.503 -0.716 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CG . . . . . . . . . c25520_2n0c 1 . 10 . 1454 . 1 1 8 HIS H H 1.875 -4.942 -0.957 . . . 1.0 . . . . . . . . . . . . A . 8 HIS H . . . . . . . . . c25520_2n0c 1 . 10 . 1455 . 1 1 8 HIS HA H 4.454 -5.435 -2.409 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HA . . . . . . . . . c25520_2n0c 1 . 10 . 1456 . 1 1 8 HIS HB2 H 3.752 -4.743 0.434 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HB2 . . . . . . . . . c25520_2n0c 1 . 10 . 1457 . 1 1 8 HIS HB3 H 5.326 -5.456 0.037 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HB3 . . . . . . . . . c25520_2n0c 1 . 10 . 1458 . 1 1 8 HIS HD1 H 3.581 -2.261 0.303 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HD1 . . . . . . . . . c25520_2n0c 1 . 10 . 1459 . 1 1 8 HIS HD2 H 6.650 -3.816 -2.124 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HD2 . . . . . . . . . c25520_2n0c 1 . 10 . 1460 . 1 1 8 HIS HE1 H 4.891 -0.283 -0.609 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HE1 . . . . . . . . . c25520_2n0c 1 . 10 . 1461 . 1 1 8 HIS N N 2.493 -5.092 -1.754 . . . 1.0 . . . . . . . . . . . . A . 8 HIS N . . . . . . . . . c25520_2n0c 1 . 10 . 1462 . 1 1 8 HIS ND1 N 4.413 -2.334 -0.283 . . . 1.0 . . . . . . . . . . . . A . 8 HIS ND1 . . . . . . . . . c25520_2n0c 1 . 10 . 1463 . 1 1 8 HIS NE2 N 6.146 -1.774 -1.501 . . . 1.0 . . . . . . . . . . . . A . 8 HIS NE2 . . . . . . . . . c25520_2n0c 1 . 10 . 1464 . 1 1 8 HIS O O 4.511 -7.591 -0.351 . . . 1.0 . . . . . . . . . . . . A . 8 HIS O . . . . . . . . . c25520_2n0c 1 . 10 . 1465 . 1 1 9 LEU C C 3.272 -10.003 -3.106 . . . 1.0 . . . . . . . . . . . . A . 9 LEU C . . . . . . . . . c25520_2n0c 1 . 10 . 1466 . 1 1 9 LEU CA C 2.873 -9.270 -1.829 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CA . . . . . . . . . c25520_2n0c 1 . 10 . 1467 . 1 1 9 LEU CB C 1.440 -9.640 -1.443 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CB . . . . . . . . . c25520_2n0c 1 . 10 . 1468 . 1 1 9 LEU CD1 C 1.645 -10.616 0.857 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD1 . . . . . . . . . c25520_2n0c 1 . 10 . 1469 . 1 1 9 LEU CD2 C -0.146 -11.429 -0.687 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD2 . . . . . . . . . c25520_2n0c 1 . 10 . 1470 . 1 1 9 LEU CG C 1.278 -10.899 -0.591 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CG . . . . . . . . . c25520_2n0c 1 . 10 . 1471 . 1 1 9 LEU H H 2.442 -7.363 -2.718 . . . 1.0 . . . . . . . . . . . . A . 9 LEU H . . . . . . . . . c25520_2n0c 1 . 10 . 1472 . 1 1 9 LEU HA H 3.535 -9.605 -1.032 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HA . . . . . . . . . c25520_2n0c 1 . 10 . 1473 . 1 1 9 LEU HB2 H 1.020 -8.801 -0.890 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB2 . . . . . . . . . c25520_2n0c 1 . 10 . 1474 . 1 1 9 LEU HB3 H 0.858 -9.761 -2.362 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB3 . . . . . . . . . c25520_2n0c 1 . 10 . 1475 . 1 1 9 LEU HD11 H 2.713 -10.433 0.953 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD11 . . . . . . . . . c25520_2n0c 1 . 10 . 1476 . 1 1 9 LEU HD12 H 1.374 -11.479 1.467 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD12 . . . . . . . . . c25520_2n0c 1 . 10 . 1477 . 1 1 9 LEU HD13 H 1.093 -9.744 1.208 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD13 . . . . . . . . . c25520_2n0c 1 . 10 . 1478 . 1 1 9 LEU HD21 H -0.837 -10.656 -0.352 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD21 . . . . . . . . . c25520_2n0c 1 . 10 . 1479 . 1 1 9 LEU HD22 H -0.251 -12.310 -0.052 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD22 . . . . . . . . . c25520_2n0c 1 . 10 . 1480 . 1 1 9 LEU HD23 H -0.373 -11.697 -1.719 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD23 . . . . . . . . . c25520_2n0c 1 . 10 . 1481 . 1 1 9 LEU HG H 1.959 -11.656 -0.978 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HG . . . . . . . . . c25520_2n0c 1 . 10 . 1482 . 1 1 9 LEU N N 2.994 -7.826 -1.997 . . . 1.0 . . . . . . . . . . . . A . 9 LEU N . . . . . . . . . c25520_2n0c 1 . 10 . 1483 . 1 1 9 LEU O O 2.780 -9.693 -4.190 . . . 1.0 . . . . . . . . . . . . A . 9 LEU O . . . . . . . . . c25520_2n0c 1 . 10 . 1484 . 1 1 10 MET C C 4.258 -13.227 -3.950 . . . 1.0 . . . . . . . . . . . . A . 10 MET C . . . . . . . . . c25520_2n0c 1 . 10 . 1485 . 1 1 10 MET CA C 4.629 -11.756 -4.109 . . . 1.0 . . . . . . . . . . . . A . 10 MET CA . . . . . . . . . c25520_2n0c 1 . 10 . 1486 . 1 1 10 MET CB C 6.144 -11.615 -4.270 . . . 1.0 . . . . . . . . . . . . A . 10 MET CB . . . . . . . . . c25520_2n0c 1 . 10 . 1487 . 1 1 10 MET CE C 8.457 -13.613 -6.704 . . . 1.0 . . . . . . . . . . . . A . 10 MET CE . . . . . . . . . c25520_2n0c 1 . 10 . 1488 . 1 1 10 MET CG C 6.623 -11.793 -5.702 . . . 1.0 . . . . . . . . . . . . A . 10 MET CG . . . . . . . . . c25520_2n0c 1 . 10 . 1489 . 1 1 10 MET H H 4.533 -11.189 -2.040 . . . 1.0 . . . . . . . . . . . . A . 10 MET H . . . . . . . . . c25520_2n0c 1 . 10 . 1490 . 1 1 10 MET HA H 4.147 -11.389 -5.016 . . . 1.0 . . . . . . . . . . . . A . 10 MET HA . . . . . . . . . c25520_2n0c 1 . 10 . 1491 . 1 1 10 MET HB2 H 6.424 -10.618 -3.930 . . . 1.0 . . . . . . . . . . . . A . 10 MET HB2 . . . . . . . . . c25520_2n0c 1 . 10 . 1492 . 1 1 10 MET HB3 H 6.651 -12.347 -3.637 . . . 1.0 . . . . . . . . . . . . A . 10 MET HB3 . . . . . . . . . c25520_2n0c 1 . 10 . 1493 . 1 1 10 MET HE1 H 9.105 -13.391 -5.856 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE1 . . . . . . . . . c25520_2n0c 1 . 10 . 1494 . 1 1 10 MET HE2 H 8.678 -14.613 -7.078 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE2 . . . . . . . . . c25520_2n0c 1 . 10 . 1495 . 1 1 10 MET HE3 H 8.630 -12.882 -7.495 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE3 . . . . . . . . . c25520_2n0c 1 . 10 . 1496 . 1 1 10 MET HG2 H 5.938 -11.287 -6.380 . . . 1.0 . . . . . . . . . . . . A . 10 MET HG2 . . . . . . . . . c25520_2n0c 1 . 10 . 1497 . 1 1 10 MET HG3 H 7.609 -11.334 -5.803 . . . 1.0 . . . . . . . . . . . . A . 10 MET HG3 . . . . . . . . . c25520_2n0c 1 . 10 . 1498 . 1 1 10 MET N N 4.167 -10.977 -2.967 . . . 1.0 . . . . . . . . . . . . A . 10 MET N . . . . . . . . . c25520_2n0c 1 . 10 . 1499 . 1 1 10 MET O O 5.137 -14.066 -4.049 . . . 1.0 . . . . . . . . . . . . A . 10 MET O . . . . . . . . . c25520_2n0c 1 . 10 . 1500 . 1 1 10 MET SD S 6.745 -13.525 -6.184 . . . 1.0 . . . . . . . . . . . . A . 10 MET SD . . . . . . . . . c25520_2n0c 1 . 11 . 1501 . 1 1 1 GLY C C -8.546 5.251 -0.001 . . . 1.0 . . . . . . . . . . . . A . 1 GLY C . . . . . . . . . c25520_2n0c 1 . 11 . 1502 . 1 1 1 GLY CA C -10.011 4.949 0.239 . . . 1.0 . . . . . . . . . . . . A . 1 GLY CA . . . . . . . . . c25520_2n0c 1 . 11 . 1503 . 1 1 1 GLY H1 H -10.262 5.418 -1.738 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H1 . . . . . . . . . c25520_2n0c 1 . 11 . 1504 . 1 1 1 GLY H2 H -11.703 5.371 -0.837 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H2 . . . . . . . . . c25520_2n0c 1 . 11 . 1505 . 1 1 1 GLY H3 H -10.926 3.927 -1.282 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H3 . . . . . . . . . c25520_2n0c 1 . 11 . 1506 . 1 1 1 GLY HA2 H -10.426 5.718 0.891 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA2 . . . . . . . . . c25520_2n0c 1 . 11 . 1507 . 1 1 1 GLY HA3 H -10.095 3.982 0.735 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA3 . . . . . . . . . c25520_2n0c 1 . 11 . 1508 . 1 1 1 GLY N N -10.780 4.914 -0.991 . . . 1.0 . . . . . . . . . . . . A . 1 GLY N . . . . . . . . . c25520_2n0c 1 . 11 . 1509 . 1 1 1 GLY O O -8.057 5.138 -1.124 . . . 1.0 . . . . . . . . . . . . A . 1 GLY O . . . . . . . . . c25520_2n0c 1 . 11 . 1510 . 1 1 2 ASN C C -5.565 4.723 1.222 . . . 1.0 . . . . . . . . . . . . A . 2 ASN C . . . . . . . . . c25520_2n0c 1 . 11 . 1511 . 1 1 2 ASN CA C -6.422 5.957 0.957 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CA . . . . . . . . . c25520_2n0c 1 . 11 . 1512 . 1 1 2 ASN CB C -6.057 7.068 1.944 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CB . . . . . . . . . c25520_2n0c 1 . 11 . 1513 . 1 1 2 ASN CG C -4.806 7.820 1.532 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CG . . . . . . . . . c25520_2n0c 1 . 11 . 1514 . 1 1 2 ASN H H -8.303 5.713 1.964 . . . 1.0 . . . . . . . . . . . . A . 2 ASN H . . . . . . . . . c25520_2n0c 1 . 11 . 1515 . 1 1 2 ASN HA H -6.209 6.315 -0.054 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HA . . . . . . . . . c25520_2n0c 1 . 11 . 1516 . 1 1 2 ASN HB2 H -6.885 7.775 1.989 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HB2 . . . . . . . . . c25520_2n0c 1 . 11 . 1517 . 1 1 2 ASN HB3 H -5.909 6.635 2.936 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HB3 . . . . . . . . . c25520_2n0c 1 . 11 . 1518 . 1 1 2 ASN HD21 H -4.117 7.805 3.458 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HD21 . . . . . . . . . c25520_2n0c 1 . 11 . 1519 . 1 1 2 ASN HD22 H -3.076 8.590 2.267 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HD22 . . . . . . . . . c25520_2n0c 1 . 11 . 1520 . 1 1 2 ASN N N -7.841 5.637 1.058 . . . 1.0 . . . . . . . . . . . . A . 2 ASN N . . . . . . . . . c25520_2n0c 1 . 11 . 1521 . 1 1 2 ASN ND2 N -3.934 8.090 2.496 . . . 1.0 . . . . . . . . . . . . A . 2 ASN ND2 . . . . . . . . . c25520_2n0c 1 . 11 . 1522 . 1 1 2 ASN O O -5.509 4.224 2.346 . . . 1.0 . . . . . . . . . . . . A . 2 ASN O . . . . . . . . . c25520_2n0c 1 . 11 . 1523 . 1 1 2 ASN OD1 O -4.627 8.154 0.361 . . . 1.0 . . . . . . . . . . . . A . 2 ASN OD1 . . . . . . . . . c25520_2n0c 1 . 11 . 1524 . 1 1 3 HIS C C -2.571 3.465 0.350 . . . 1.0 . . . . . . . . . . . . A . 3 HIS C . . . . . . . . . c25520_2n0c 1 . 11 . 1525 . 1 1 3 HIS CA C -4.042 3.063 0.301 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CA . . . . . . . . . c25520_2n0c 1 . 11 . 1526 . 1 1 3 HIS CB C -4.284 2.108 -0.870 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CB . . . . . . . . . c25520_2n0c 1 . 11 . 1527 . 1 1 3 HIS CD2 C -6.470 0.994 -1.722 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CD2 . . . . . . . . . c25520_2n0c 1 . 11 . 1528 . 1 1 3 HIS CE1 C -7.191 0.239 0.202 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CE1 . . . . . . . . . c25520_2n0c 1 . 11 . 1529 . 1 1 3 HIS CG C -5.573 1.343 -0.757 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CG . . . . . . . . . c25520_2n0c 1 . 11 . 1530 . 1 1 3 HIS H H -4.982 4.698 -0.726 . . . 1.0 . . . . . . . . . . . . A . 3 HIS H . . . . . . . . . c25520_2n0c 1 . 11 . 1531 . 1 1 3 HIS HA H -4.282 2.527 1.224 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HA . . . . . . . . . c25520_2n0c 1 . 11 . 1532 . 1 1 3 HIS HB2 H -4.309 2.692 -1.788 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HB2 . . . . . . . . . c25520_2n0c 1 . 11 . 1533 . 1 1 3 HIS HB3 H -3.461 1.399 -0.928 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HB3 . . . . . . . . . c25520_2n0c 1 . 11 . 1534 . 1 1 3 HIS HD1 H -5.597 0.956 1.362 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HD1 . . . . . . . . . c25520_2n0c 1 . 11 . 1535 . 1 1 3 HIS HD2 H -6.507 1.397 -2.723 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HD2 . . . . . . . . . c25520_2n0c 1 . 11 . 1536 . 1 1 3 HIS HE1 H -7.799 -0.245 0.951 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HE1 . . . . . . . . . c25520_2n0c 1 . 11 . 1537 . 1 1 3 HIS N N -4.897 4.238 0.180 . . . 1.0 . . . . . . . . . . . . A . 3 HIS N . . . . . . . . . c25520_2n0c 1 . 11 . 1538 . 1 1 3 HIS ND1 N -6.045 0.857 0.451 . . . 1.0 . . . . . . . . . . . . A . 3 HIS ND1 . . . . . . . . . c25520_2n0c 1 . 11 . 1539 . 1 1 3 HIS NE2 N -7.488 0.296 -1.099 . . . 1.0 . . . . . . . . . . . . A . 3 HIS NE2 . . . . . . . . . c25520_2n0c 1 . 11 . 1540 . 1 1 3 HIS O O -1.855 3.358 -0.646 . . . 1.0 . . . . . . . . . . . . A . 3 HIS O . . . . . . . . . c25520_2n0c 1 . 11 . 1541 . 1 1 4 TRP C C 0.220 3.252 1.242 . . . 1.0 . . . . . . . . . . . . A . 4 TRP C . . . . . . . . . c25520_2n0c 1 . 11 . 1542 . 1 1 4 TRP CA C -0.742 4.347 1.690 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CA . . . . . . . . . c25520_2n0c 1 . 11 . 1543 . 1 1 4 TRP CB C -0.479 4.705 3.154 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CB . . . . . . . . . c25520_2n0c 1 . 11 . 1544 . 1 1 4 TRP CD1 C -1.387 6.785 4.345 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CD1 . . . . . . . . . c25520_2n0c 1 . 11 . 1545 . 1 1 4 TRP CD2 C 0.166 7.218 2.791 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CD2 . . . . . . . . . c25520_2n0c 1 . 11 . 1546 . 1 1 4 TRP CE2 C -0.247 8.437 3.366 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CE2 . . . . . . . . . c25520_2n0c 1 . 11 . 1547 . 1 1 4 TRP CE3 C 1.138 7.243 1.788 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CE3 . . . . . . . . . c25520_2n0c 1 . 11 . 1548 . 1 1 4 TRP CG C -0.575 6.175 3.432 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CG . . . . . . . . . c25520_2n0c 1 . 11 . 1549 . 1 1 4 TRP CH2 C 1.230 9.657 1.985 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CH2 . . . . . . . . . c25520_2n0c 1 . 11 . 1550 . 1 1 4 TRP CZ2 C 0.280 9.662 2.969 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CZ2 . . . . . . . . . c25520_2n0c 1 . 11 . 1551 . 1 1 4 TRP CZ3 C 1.661 8.460 1.395 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CZ3 . . . . . . . . . c25520_2n0c 1 . 11 . 1552 . 1 1 4 TRP H H -2.771 3.990 2.302 . . . 1.0 . . . . . . . . . . . . A . 4 TRP H . . . . . . . . . c25520_2n0c 1 . 11 . 1553 . 1 1 4 TRP HA H -0.571 5.227 1.071 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HA . . . . . . . . . c25520_2n0c 1 . 11 . 1554 . 1 1 4 TRP HB2 H -1.220 4.198 3.768 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HB2 . . . . . . . . . c25520_2n0c 1 . 11 . 1555 . 1 1 4 TRP HB3 H 0.516 4.361 3.453 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HB3 . . . . . . . . . c25520_2n0c 1 . 11 . 1556 . 1 1 4 TRP HD1 H -2.077 6.273 4.999 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HD1 . . . . . . . . . c25520_2n0c 1 . 11 . 1557 . 1 1 4 TRP HE1 H -1.674 8.836 4.890 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HE1 . . . . . . . . . c25520_2n0c 1 . 11 . 1558 . 1 1 4 TRP HE3 H 1.479 6.326 1.333 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HE3 . . . . . . . . . c25520_2n0c 1 . 11 . 1559 . 1 1 4 TRP HH2 H 1.655 10.594 1.658 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HH2 . . . . . . . . . c25520_2n0c 1 . 11 . 1560 . 1 1 4 TRP HZ2 H -0.050 10.587 3.421 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HZ2 . . . . . . . . . c25520_2n0c 1 . 11 . 1561 . 1 1 4 TRP HZ3 H 2.413 8.485 0.620 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HZ3 . . . . . . . . . c25520_2n0c 1 . 11 . 1562 . 1 1 4 TRP N N -2.128 3.928 1.513 . . . 1.0 . . . . . . . . . . . . A . 4 TRP N . . . . . . . . . c25520_2n0c 1 . 11 . 1563 . 1 1 4 TRP NE1 N -1.195 8.145 4.311 . . . 1.0 . . . . . . . . . . . . A . 4 TRP NE1 . . . . . . . . . c25520_2n0c 1 . 11 . 1564 . 1 1 4 TRP O O 0.844 3.356 0.187 . . . 1.0 . . . . . . . . . . . . A . 4 TRP O . . . . . . . . . c25520_2n0c 1 . 11 . 1565 . 1 1 5 ALA C C 0.424 -0.196 1.513 . . . 1.0 . . . . . . . . . . . . A . 5 ALA C . . . . . . . . . c25520_2n0c 1 . 11 . 1566 . 1 1 5 ALA CA C 1.217 1.088 1.735 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CA . . . . . . . . . c25520_2n0c 1 . 11 . 1567 . 1 1 5 ALA CB C 2.239 0.894 2.845 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CB . . . . . . . . . c25520_2n0c 1 . 11 . 1568 . 1 1 5 ALA H H -0.209 2.177 2.914 . . . 1.0 . . . . . . . . . . . . A . 5 ALA H . . . . . . . . . c25520_2n0c 1 . 11 . 1569 . 1 1 5 ALA HA H 1.763 1.303 0.811 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HA . . . . . . . . . c25520_2n0c 1 . 11 . 1570 . 1 1 5 ALA HB1 H 3.122 0.384 2.461 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB1 . . . . . . . . . c25520_2n0c 1 . 11 . 1571 . 1 1 5 ALA HB2 H 1.800 0.304 3.652 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB2 . . . . . . . . . c25520_2n0c 1 . 11 . 1572 . 1 1 5 ALA HB3 H 2.530 1.870 3.233 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB3 . . . . . . . . . c25520_2n0c 1 . 11 . 1573 . 1 1 5 ALA N N 0.333 2.202 2.050 . . . 1.0 . . . . . . . . . . . . A . 5 ALA N . . . . . . . . . c25520_2n0c 1 . 11 . 1574 . 1 1 5 ALA O O 0.117 -0.920 2.460 . . . 1.0 . . . . . . . . . . . . A . 5 ALA O . . . . . . . . . c25520_2n0c 1 . 11 . 1575 . 1 1 6 VAL C C -0.257 -2.199 -1.461 . . . 1.0 . . . . . . . . . . . . A . 6 VAL C . . . . . . . . . c25520_2n0c 1 . 11 . 1576 . 1 1 6 VAL CA C -0.664 -1.670 -0.092 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CA . . . . . . . . . c25520_2n0c 1 . 11 . 1577 . 1 1 6 VAL CB C -2.178 -1.395 -0.086 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CB . . . . . . . . . c25520_2n0c 1 . 11 . 1578 . 1 1 6 VAL CG1 C -2.951 -2.658 -0.433 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CG1 . . . . . . . . . c25520_2n0c 1 . 11 . 1579 . 1 1 6 VAL CG2 C -2.617 -0.845 1.261 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CG2 . . . . . . . . . c25520_2n0c 1 . 11 . 1580 . 1 1 6 VAL H H 0.381 0.164 -0.488 . . . 1.0 . . . . . . . . . . . . A . 6 VAL H . . . . . . . . . c25520_2n0c 1 . 11 . 1581 . 1 1 6 VAL HA H -0.463 -2.449 0.647 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HA . . . . . . . . . c25520_2n0c 1 . 11 . 1582 . 1 1 6 VAL HB H -2.386 -0.653 -0.853 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HB . . . . . . . . . c25520_2n0c 1 . 11 . 1583 . 1 1 6 VAL HG11 H -2.607 -3.470 0.207 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG11 . . . . . . . . . c25520_2n0c 1 . 11 . 1584 . 1 1 6 VAL HG12 H -2.784 -2.921 -1.477 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG12 . . . . . . . . . c25520_2n0c 1 . 11 . 1585 . 1 1 6 VAL HG13 H -4.016 -2.494 -0.269 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG13 . . . . . . . . . c25520_2n0c 1 . 11 . 1586 . 1 1 6 VAL HG21 H -3.704 -0.775 1.294 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG21 . . . . . . . . . c25520_2n0c 1 . 11 . 1587 . 1 1 6 VAL HG22 H -2.187 0.145 1.411 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG22 . . . . . . . . . c25520_2n0c 1 . 11 . 1588 . 1 1 6 VAL HG23 H -2.271 -1.515 2.048 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG23 . . . . . . . . . c25520_2n0c 1 . 11 . 1589 . 1 1 6 VAL N N 0.094 -0.473 0.255 . . . 1.0 . . . . . . . . . . . . A . 6 VAL N . . . . . . . . . c25520_2n0c 1 . 11 . 1590 . 1 1 6 VAL O O -0.241 -1.460 -2.445 . . . 1.0 . . . . . . . . . . . . A . 6 VAL O . . . . . . . . . c25520_2n0c 1 . 11 . 1591 . 1 1 7 GLY C C 1.955 -4.402 -2.821 . . . 1.0 . . . . . . . . . . . . A . 7 GLY C . . . . . . . . . c25520_2n0c 1 . 11 . 1592 . 1 1 7 GLY CA C 0.472 -4.094 -2.774 . . . 1.0 . . . . . . . . . . . . A . 7 GLY CA . . . . . . . . . c25520_2n0c 1 . 11 . 1593 . 1 1 7 GLY H H 0.035 -4.053 -0.672 . . . 1.0 . . . . . . . . . . . . A . 7 GLY H . . . . . . . . . c25520_2n0c 1 . 11 . 1594 . 1 1 7 GLY HA2 H -0.073 -5.031 -2.888 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA2 . . . . . . . . . c25520_2n0c 1 . 11 . 1595 . 1 1 7 GLY HA3 H 0.220 -3.441 -3.614 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA3 . . . . . . . . . c25520_2n0c 1 . 11 . 1596 . 1 1 7 GLY N N 0.070 -3.486 -1.520 . . . 1.0 . . . . . . . . . . . . A . 7 GLY N . . . . . . . . . c25520_2n0c 1 . 11 . 1597 . 1 1 7 GLY O O 2.658 -3.971 -3.735 . . . 1.0 . . . . . . . . . . . . A . 7 GLY O . . . . . . . . . c25520_2n0c 1 . 11 . 1598 . 1 1 8 HIS C C 4.090 -6.867 -2.424 . . . 1.0 . . . . . . . . . . . . A . 8 HIS C . . . . . . . . . c25520_2n0c 1 . 11 . 1599 . 1 1 8 HIS CA C 3.846 -5.514 -1.763 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CA . . . . . . . . . c25520_2n0c 1 . 11 . 1600 . 1 1 8 HIS CB C 4.316 -5.551 -0.308 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CB . . . . . . . . . c25520_2n0c 1 . 11 . 1601 . 1 1 8 HIS CD2 C 5.280 -3.241 0.382 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CD2 . . . . . . . . . c25520_2n0c 1 . 11 . 1602 . 1 1 8 HIS CE1 C 3.563 -2.535 1.544 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CE1 . . . . . . . . . c25520_2n0c 1 . 11 . 1603 . 1 1 8 HIS CG C 4.316 -4.204 0.360 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CG . . . . . . . . . c25520_2n0c 1 . 11 . 1604 . 1 1 8 HIS H H 1.801 -5.479 -1.104 . . . 1.0 . . . . . . . . . . . . A . 8 HIS H . . . . . . . . . c25520_2n0c 1 . 11 . 1605 . 1 1 8 HIS HA H 4.439 -4.760 -2.286 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HA . . . . . . . . . c25520_2n0c 1 . 11 . 1606 . 1 1 8 HIS HB2 H 3.649 -6.208 0.249 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HB2 . . . . . . . . . c25520_2n0c 1 . 11 . 1607 . 1 1 8 HIS HB3 H 5.326 -5.964 -0.274 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HB3 . . . . . . . . . c25520_2n0c 1 . 11 . 1608 . 1 1 8 HIS HD1 H 2.363 -4.233 1.268 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HD1 . . . . . . . . . c25520_2n0c 1 . 11 . 1609 . 1 1 8 HIS HD2 H 6.311 -3.374 0.091 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HD2 . . . . . . . . . c25520_2n0c 1 . 11 . 1610 . 1 1 8 HIS HE1 H 2.924 -1.925 2.161 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HE1 . . . . . . . . . c25520_2n0c 1 . 11 . 1611 . 1 1 8 HIS N N 2.435 -5.149 -1.832 . . . 1.0 . . . . . . . . . . . . A . 8 HIS N . . . . . . . . . c25520_2n0c 1 . 11 . 1612 . 1 1 8 HIS ND1 N 3.240 -3.740 1.098 . . . 1.0 . . . . . . . . . . . . A . 8 HIS ND1 . . . . . . . . . c25520_2n0c 1 . 11 . 1613 . 1 1 8 HIS NE2 N 4.787 -2.190 1.137 . . . 1.0 . . . . . . . . . . . . A . 8 HIS NE2 . . . . . . . . . c25520_2n0c 1 . 11 . 1614 . 1 1 8 HIS O O 4.732 -7.745 -1.846 . . . 1.0 . . . . . . . . . . . . A . 8 HIS O . . . . . . . . . c25520_2n0c 1 . 11 . 1615 . 1 1 9 LEU C C 4.813 -8.135 -5.451 . . . 1.0 . . . . . . . . . . . . A . 9 LEU C . . . . . . . . . c25520_2n0c 1 . 11 . 1616 . 1 1 9 LEU CA C 3.737 -8.275 -4.378 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CA . . . . . . . . . c25520_2n0c 1 . 11 . 1617 . 1 1 9 LEU CB C 2.411 -8.685 -5.020 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CB . . . . . . . . . c25520_2n0c 1 . 11 . 1618 . 1 1 9 LEU CD1 C 0.712 -10.525 -5.149 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD1 . . . . . . . . . c25520_2n0c 1 . 11 . 1619 . 1 1 9 LEU CD2 C 2.794 -10.650 -6.530 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD2 . . . . . . . . . c25520_2n0c 1 . 11 . 1620 . 1 1 9 LEU CG C 2.194 -10.187 -5.210 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CG . . . . . . . . . c25520_2n0c 1 . 11 . 1621 . 1 1 9 LEU H H 3.056 -6.262 -4.066 . . . 1.0 . . . . . . . . . . . . A . 9 LEU H . . . . . . . . . c25520_2n0c 1 . 11 . 1622 . 1 1 9 LEU HA H 4.043 -9.063 -3.689 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HA . . . . . . . . . c25520_2n0c 1 . 11 . 1623 . 1 1 9 LEU HB2 H 1.624 -8.306 -4.363 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB2 . . . . . . . . . c25520_2n0c 1 . 11 . 1624 . 1 1 9 LEU HB3 H 2.311 -8.176 -5.982 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB3 . . . . . . . . . c25520_2n0c 1 . 11 . 1625 . 1 1 9 LEU HD11 H 0.574 -11.596 -5.293 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD11 . . . . . . . . . c25520_2n0c 1 . 11 . 1626 . 1 1 9 LEU HD12 H 0.191 -9.982 -5.938 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD12 . . . . . . . . . c25520_2n0c 1 . 11 . 1627 . 1 1 9 LEU HD13 H 0.306 -10.236 -4.180 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD13 . . . . . . . . . c25520_2n0c 1 . 11 . 1628 . 1 1 9 LEU HD21 H 2.562 -9.938 -7.320 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD21 . . . . . . . . . c25520_2n0c 1 . 11 . 1629 . 1 1 9 LEU HD22 H 2.375 -11.622 -6.797 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD22 . . . . . . . . . c25520_2n0c 1 . 11 . 1630 . 1 1 9 LEU HD23 H 3.867 -10.752 -6.439 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD23 . . . . . . . . . c25520_2n0c 1 . 11 . 1631 . 1 1 9 LEU HG H 2.687 -10.720 -4.397 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HG . . . . . . . . . c25520_2n0c 1 . 11 . 1632 . 1 1 9 LEU N N 3.576 -7.028 -3.638 . . . 1.0 . . . . . . . . . . . . A . 9 LEU N . . . . . . . . . c25520_2n0c 1 . 11 . 1633 . 1 1 9 LEU O O 5.043 -7.045 -5.975 . . . 1.0 . . . . . . . . . . . . A . 9 LEU O . . . . . . . . . c25520_2n0c 1 . 11 . 1634 . 1 1 10 MET C C 5.953 -9.642 -8.150 . . . 1.0 . . . . . . . . . . . . A . 10 MET C . . . . . . . . . c25520_2n0c 1 . 11 . 1635 . 1 1 10 MET CA C 6.515 -9.248 -6.787 . . . 1.0 . . . . . . . . . . . . A . 10 MET CA . . . . . . . . . c25520_2n0c 1 . 11 . 1636 . 1 1 10 MET CB C 7.637 -10.208 -6.388 . . . 1.0 . . . . . . . . . . . . A . 10 MET CB . . . . . . . . . c25520_2n0c 1 . 11 . 1637 . 1 1 10 MET CE C 7.379 -14.257 -5.414 . . . 1.0 . . . . . . . . . . . . A . 10 MET CE . . . . . . . . . c25520_2n0c 1 . 11 . 1638 . 1 1 10 MET CG C 7.218 -11.669 -6.393 . . . 1.0 . . . . . . . . . . . . A . 10 MET CG . . . . . . . . . c25520_2n0c 1 . 11 . 1639 . 1 1 10 MET H H 5.228 -10.119 -5.303 . . . 1.0 . . . . . . . . . . . . A . 10 MET H . . . . . . . . . c25520_2n0c 1 . 11 . 1640 . 1 1 10 MET HA H 6.936 -8.243 -6.871 . . . 1.0 . . . . . . . . . . . . A . 10 MET HA . . . . . . . . . c25520_2n0c 1 . 11 . 1641 . 1 1 10 MET HB2 H 8.471 -10.081 -7.078 . . . 1.0 . . . . . . . . . . . . A . 10 MET HB2 . . . . . . . . . c25520_2n0c 1 . 11 . 1642 . 1 1 10 MET HB3 H 7.971 -9.949 -5.383 . . . 1.0 . . . . . . . . . . . . A . 10 MET HB3 . . . . . . . . . c25520_2n0c 1 . 11 . 1643 . 1 1 10 MET HE1 H 6.331 -14.111 -5.152 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE1 . . . . . . . . . c25520_2n0c 1 . 11 . 1644 . 1 1 10 MET HE2 H 7.448 -14.640 -6.432 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE2 . . . . . . . . . c25520_2n0c 1 . 11 . 1645 . 1 1 10 MET HE3 H 7.831 -14.971 -4.726 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE3 . . . . . . . . . c25520_2n0c 1 . 11 . 1646 . 1 1 10 MET HG2 H 6.185 -11.737 -6.053 . . . 1.0 . . . . . . . . . . . . A . 10 MET HG2 . . . . . . . . . c25520_2n0c 1 . 11 . 1647 . 1 1 10 MET HG3 H 7.284 -12.056 -7.411 . . . 1.0 . . . . . . . . . . . . A . 10 MET HG3 . . . . . . . . . c25520_2n0c 1 . 11 . 1648 . 1 1 10 MET N N 5.466 -9.246 -5.774 . . . 1.0 . . . . . . . . . . . . A . 10 MET N . . . . . . . . . c25520_2n0c 1 . 11 . 1649 . 1 1 10 MET O O 4.850 -9.221 -8.457 . . . 1.0 . . . . . . . . . . . . A . 10 MET O . . . . . . . . . c25520_2n0c 1 . 11 . 1650 . 1 1 10 MET SD S 8.239 -12.688 -5.311 . . . 1.0 . . . . . . . . . . . . A . 10 MET SD . . . . . . . . . c25520_2n0c 1 . 12 . 1651 . 1 1 1 GLY C C -8.303 5.736 2.058 . . . 1.0 . . . . . . . . . . . . A . 1 GLY C . . . . . . . . . c25520_2n0c 1 . 12 . 1652 . 1 1 1 GLY CA C -9.779 5.394 2.000 . . . 1.0 . . . . . . . . . . . . A . 1 GLY CA . . . . . . . . . c25520_2n0c 1 . 12 . 1653 . 1 1 1 GLY H1 H -11.071 6.238 0.653 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H1 . . . . . . . . . c25520_2n0c 1 . 12 . 1654 . 1 1 1 GLY H2 H -10.720 4.601 0.363 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H2 . . . . . . . . . c25520_2n0c 1 . 12 . 1655 . 1 1 1 GLY H3 H -9.569 5.798 0.005 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H3 . . . . . . . . . c25520_2n0c 1 . 12 . 1656 . 1 1 1 GLY HA2 H -10.323 6.064 2.665 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA2 . . . . . . . . . c25520_2n0c 1 . 12 . 1657 . 1 1 1 GLY HA3 H -9.915 4.369 2.343 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA3 . . . . . . . . . c25520_2n0c 1 . 12 . 1658 . 1 1 1 GLY N N -10.324 5.516 0.661 . . . 1.0 . . . . . . . . . . . . A . 1 GLY N . . . . . . . . . c25520_2n0c 1 . 12 . 1659 . 1 1 1 GLY O O -7.914 6.877 1.814 . . . 1.0 . . . . . . . . . . . . A . 1 GLY O . . . . . . . . . c25520_2n0c 1 . 12 . 1660 . 1 1 2 ASN C C -5.285 3.823 1.769 . . . 1.0 . . . . . . . . . . . . A . 2 ASN C . . . . . . . . . c25520_2n0c 1 . 12 . 1661 . 1 1 2 ASN CA C -6.038 4.947 2.474 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CA . . . . . . . . . c25520_2n0c 1 . 12 . 1662 . 1 1 2 ASN CB C -5.605 5.026 3.939 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CB . . . . . . . . . c25520_2n0c 1 . 12 . 1663 . 1 1 2 ASN CG C -6.528 5.899 4.768 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CG . . . . . . . . . c25520_2n0c 1 . 12 . 1664 . 1 1 2 ASN H H -7.863 3.820 2.576 . . . 1.0 . . . . . . . . . . . . A . 2 ASN H . . . . . . . . . c25520_2n0c 1 . 12 . 1665 . 1 1 2 ASN HA H -5.767 5.890 1.993 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HA . . . . . . . . . c25520_2n0c 1 . 12 . 1666 . 1 1 2 ASN HB2 H -5.616 4.021 4.362 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HB2 . . . . . . . . . c25520_2n0c 1 . 12 . 1667 . 1 1 2 ASN HB3 H -4.591 5.423 3.992 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HB3 . . . . . . . . . c25520_2n0c 1 . 12 . 1668 . 1 1 2 ASN HD21 H -5.106 7.366 4.874 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HD21 . . . . . . . . . c25520_2n0c 1 . 12 . 1669 . 1 1 2 ASN HD22 H -6.636 7.709 5.687 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HD22 . . . . . . . . . c25520_2n0c 1 . 12 . 1670 . 1 1 2 ASN N N -7.479 4.745 2.383 . . . 1.0 . . . . . . . . . . . . A . 2 ASN N . . . . . . . . . c25520_2n0c 1 . 12 . 1671 . 1 1 2 ASN ND2 N -6.050 7.083 5.136 . . . 1.0 . . . . . . . . . . . . A . 2 ASN ND2 . . . . . . . . . c25520_2n0c 1 . 12 . 1672 . 1 1 2 ASN O O -5.353 2.664 2.180 . . . 1.0 . . . . . . . . . . . . A . 2 ASN O . . . . . . . . . c25520_2n0c 1 . 12 . 1673 . 1 1 2 ASN OD1 O -7.657 5.514 5.074 . . . 1.0 . . . . . . . . . . . . A . 2 ASN OD1 . . . . . . . . . c25520_2n0c 1 . 12 . 1674 . 1 1 3 HIS C C -2.302 3.463 0.071 . . . 1.0 . . . . . . . . . . . . A . 3 HIS C . . . . . . . . . c25520_2n0c 1 . 12 . 1675 . 1 1 3 HIS CA C -3.799 3.195 -0.053 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CA . . . . . . . . . c25520_2n0c 1 . 12 . 1676 . 1 1 3 HIS CB C -4.215 3.223 -1.524 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CB . . . . . . . . . c25520_2n0c 1 . 12 . 1677 . 1 1 3 HIS CD2 C -5.095 5.446 -2.538 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CD2 . . . . . . . . . c25520_2n0c 1 . 12 . 1678 . 1 1 3 HIS CE1 C -3.155 6.365 -2.974 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CE1 . . . . . . . . . c25520_2n0c 1 . 12 . 1679 . 1 1 3 HIS CG C -4.111 4.587 -2.151 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CG . . . . . . . . . c25520_2n0c 1 . 12 . 1680 . 1 1 3 HIS H H -4.550 5.152 0.418 . . . 1.0 . . . . . . . . . . . . A . 3 HIS H . . . . . . . . . c25520_2n0c 1 . 12 . 1681 . 1 1 3 HIS HA H -3.992 2.192 0.337 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HA . . . . . . . . . c25520_2n0c 1 . 12 . 1682 . 1 1 3 HIS HB2 H -3.572 2.543 -2.081 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HB2 . . . . . . . . . c25520_2n0c 1 . 12 . 1683 . 1 1 3 HIS HB3 H -5.246 2.874 -1.602 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HB3 . . . . . . . . . c25520_2n0c 1 . 12 . 1684 . 1 1 3 HIS HD1 H -1.969 4.791 -2.261 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HD1 . . . . . . . . . c25520_2n0c 1 . 12 . 1685 . 1 1 3 HIS HD2 H -6.137 5.377 -2.263 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HD2 . . . . . . . . . c25520_2n0c 1 . 12 . 1686 . 1 1 3 HIS HE1 H -2.403 7.065 -3.304 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HE1 . . . . . . . . . c25520_2n0c 1 . 12 . 1687 . 1 1 3 HIS N N -4.566 4.174 0.707 . . . 1.0 . . . . . . . . . . . . A . 3 HIS N . . . . . . . . . c25520_2n0c 1 . 12 . 1688 . 1 1 3 HIS ND1 N -2.894 5.184 -2.434 . . . 1.0 . . . . . . . . . . . . A . 3 HIS ND1 . . . . . . . . . c25520_2n0c 1 . 12 . 1689 . 1 1 3 HIS NE2 N -4.472 6.568 -3.057 . . . 1.0 . . . . . . . . . . . . A . 3 HIS NE2 . . . . . . . . . c25520_2n0c 1 . 12 . 1690 . 1 1 3 HIS O O -1.544 3.259 -0.878 . . . 1.0 . . . . . . . . . . . . A . 3 HIS O . . . . . . . . . c25520_2n0c 1 . 12 . 1691 . 1 1 4 TRP C C 0.402 3.020 1.141 . . . 1.0 . . . . . . . . . . . . A . 4 TRP C . . . . . . . . . c25520_2n0c 1 . 12 . 1692 . 1 1 4 TRP CA C -0.476 4.216 1.493 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CA . . . . . . . . . c25520_2n0c 1 . 12 . 1693 . 1 1 4 TRP CB C -0.266 4.606 2.957 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CB . . . . . . . . . c25520_2n0c 1 . 12 . 1694 . 1 1 4 TRP CD1 C -1.025 6.814 4.013 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CD1 . . . . . . . . . c25520_2n0c 1 . 12 . 1695 . 1 1 4 TRP CD2 C 0.658 7.024 2.550 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CD2 . . . . . . . . . c25520_2n0c 1 . 12 . 1696 . 1 1 4 TRP CE2 C 0.339 8.300 3.054 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CE2 . . . . . . . . . c25520_2n0c 1 . 12 . 1697 . 1 1 4 TRP CE3 C 1.688 6.908 1.613 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CE3 . . . . . . . . . c25520_2n0c 1 . 12 . 1698 . 1 1 4 TRP CG C -0.226 6.088 3.177 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CG . . . . . . . . . c25520_2n0c 1 . 12 . 1699 . 1 1 4 TRP CH2 C 2.018 9.306 1.732 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CH2 . . . . . . . . . c25520_2n0c 1 . 12 . 1700 . 1 1 4 TRP CZ2 C 1.014 9.449 2.650 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CZ2 . . . . . . . . . c25520_2n0c 1 . 12 . 1701 . 1 1 4 TRP CZ3 C 2.357 8.050 1.214 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CZ3 . . . . . . . . . c25520_2n0c 1 . 12 . 1702 . 1 1 4 TRP H H -2.561 4.065 1.993 . . . 1.0 . . . . . . . . . . . . A . 4 TRP H . . . . . . . . . c25520_2n0c 1 . 12 . 1703 . 1 1 4 TRP HA H -0.186 5.052 0.857 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HA . . . . . . . . . c25520_2n0c 1 . 12 . 1704 . 1 1 4 TRP HB2 H -1.091 4.201 3.540 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HB2 . . . . . . . . . c25520_2n0c 1 . 12 . 1705 . 1 1 4 TRP HB3 H 0.669 4.177 3.331 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HB3 . . . . . . . . . c25520_2n0c 1 . 12 . 1706 . 1 1 4 TRP HD1 H -1.805 6.402 4.637 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HD1 . . . . . . . . . c25520_2n0c 1 . 12 . 1707 . 1 1 4 TRP HE1 H -1.129 8.904 4.466 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HE1 . . . . . . . . . c25520_2n0c 1 . 12 . 1708 . 1 1 4 TRP HE3 H 1.957 5.942 1.212 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HE3 . . . . . . . . . c25520_2n0c 1 . 12 . 1709 . 1 1 4 TRP HH2 H 2.559 10.181 1.402 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HH2 . . . . . . . . . c25520_2n0c 1 . 12 . 1710 . 1 1 4 TRP HZ2 H 0.755 10.420 3.047 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HZ2 . . . . . . . . . c25520_2n0c 1 . 12 . 1711 . 1 1 4 TRP HZ3 H 3.154 7.966 0.489 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HZ3 . . . . . . . . . c25520_2n0c 1 . 12 . 1712 . 1 1 4 TRP N N -1.883 3.920 1.245 . . . 1.0 . . . . . . . . . . . . A . 4 TRP N . . . . . . . . . c25520_2n0c 1 . 12 . 1713 . 1 1 4 TRP NE1 N -0.691 8.145 3.944 . . . 1.0 . . . . . . . . . . . . A . 4 TRP NE1 . . . . . . . . . c25520_2n0c 1 . 12 . 1714 . 1 1 4 TRP O O 1.103 3.031 0.130 . . . 1.0 . . . . . . . . . . . . A . 4 TRP O . . . . . . . . . c25520_2n0c 1 . 12 . 1715 . 1 1 5 ALA C C 0.250 -0.422 1.522 . . . 1.0 . . . . . . . . . . . . A . 5 ALA C . . . . . . . . . c25520_2n0c 1 . 12 . 1716 . 1 1 5 ALA CA C 1.148 0.788 1.756 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CA . . . . . . . . . c25520_2n0c 1 . 12 . 1717 . 1 1 5 ALA CB C 2.077 0.538 2.936 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CB . . . . . . . . . c25520_2n0c 1 . 12 . 1718 . 1 1 5 ALA H H -0.242 2.045 2.805 . . . 1.0 . . . . . . . . . . . . A . 5 ALA H . . . . . . . . . c25520_2n0c 1 . 12 . 1719 . 1 1 5 ALA HA H 1.771 0.916 0.867 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HA . . . . . . . . . c25520_2n0c 1 . 12 . 1720 . 1 1 5 ALA HB1 H 2.572 -0.425 2.816 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB1 . . . . . . . . . c25520_2n0c 1 . 12 . 1721 . 1 1 5 ALA HB2 H 1.492 0.535 3.856 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB2 . . . . . . . . . c25520_2n0c 1 . 12 . 1722 . 1 1 5 ALA HB3 H 2.827 1.328 2.984 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB3 . . . . . . . . . c25520_2n0c 1 . 12 . 1723 . 1 1 5 ALA N N 0.358 1.991 1.981 . . . 1.0 . . . . . . . . . . . . A . 5 ALA N . . . . . . . . . c25520_2n0c 1 . 12 . 1724 . 1 1 5 ALA O O -0.196 -1.070 2.469 . . . 1.0 . . . . . . . . . . . . A . 5 ALA O . . . . . . . . . c25520_2n0c 1 . 12 . 1725 . 1 1 6 VAL C C -0.393 -2.495 -1.409 . . . 1.0 . . . . . . . . . . . . A . 6 VAL C . . . . . . . . . c25520_2n0c 1 . 12 . 1726 . 1 1 6 VAL CA C -0.858 -1.856 -0.107 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CA . . . . . . . . . c25520_2n0c 1 . 12 . 1727 . 1 1 6 VAL CB C -2.330 -1.433 -0.248 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CB . . . . . . . . . c25520_2n0c 1 . 12 . 1728 . 1 1 6 VAL CG1 C -3.191 -2.625 -0.642 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CG1 . . . . . . . . . c25520_2n0c 1 . 12 . 1729 . 1 1 6 VAL CG2 C -2.833 -0.807 1.044 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CG2 . . . . . . . . . c25520_2n0c 1 . 12 . 1730 . 1 1 6 VAL H H 0.391 -0.149 -0.489 . . . 1.0 . . . . . . . . . . . . A . 6 VAL H . . . . . . . . . c25520_2n0c 1 . 12 . 1731 . 1 1 6 VAL HA H -0.800 -2.609 0.681 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HA . . . . . . . . . c25520_2n0c 1 . 12 . 1732 . 1 1 6 VAL HB H -2.395 -0.688 -1.042 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HB . . . . . . . . . c25520_2n0c 1 . 12 . 1733 . 1 1 6 VAL HG11 H -4.245 -2.363 -0.557 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG11 . . . . . . . . . c25520_2n0c 1 . 12 . 1734 . 1 1 6 VAL HG12 H -2.969 -3.458 0.025 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG12 . . . . . . . . . c25520_2n0c 1 . 12 . 1735 . 1 1 6 VAL HG13 H -2.974 -2.916 -1.670 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG13 . . . . . . . . . c25520_2n0c 1 . 12 . 1736 . 1 1 6 VAL HG21 H -3.902 -0.612 0.968 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG21 . . . . . . . . . c25520_2n0c 1 . 12 . 1737 . 1 1 6 VAL HG22 H -2.309 0.131 1.227 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG22 . . . . . . . . . c25520_2n0c 1 . 12 . 1738 . 1 1 6 VAL HG23 H -2.645 -1.494 1.869 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG23 . . . . . . . . . c25520_2n0c 1 . 12 . 1739 . 1 1 6 VAL N N -0.012 -0.722 0.253 . . . 1.0 . . . . . . . . . . . . A . 6 VAL N . . . . . . . . . c25520_2n0c 1 . 12 . 1740 . 1 1 6 VAL O O -0.091 -1.802 -2.380 . . . 1.0 . . . . . . . . . . . . A . 6 VAL O . . . . . . . . . c25520_2n0c 1 . 12 . 1741 . 1 1 7 GLY C C 1.575 -4.404 -2.867 . . . 1.0 . . . . . . . . . . . . A . 7 GLY C . . . . . . . . . c25520_2n0c 1 . 12 . 1742 . 1 1 7 GLY CA C 0.087 -4.535 -2.615 . . . 1.0 . . . . . . . . . . . . A . 7 GLY CA . . . . . . . . . c25520_2n0c 1 . 12 . 1743 . 1 1 7 GLY H H -0.606 -4.347 -0.592 . . . 1.0 . . . . . . . . . . . . A . 7 GLY H . . . . . . . . . c25520_2n0c 1 . 12 . 1744 . 1 1 7 GLY HA2 H -0.157 -5.591 -2.498 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA2 . . . . . . . . . c25520_2n0c 1 . 12 . 1745 . 1 1 7 GLY HA3 H -0.454 -4.141 -3.476 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA3 . . . . . . . . . c25520_2n0c 1 . 12 . 1746 . 1 1 7 GLY N N -0.341 -3.823 -1.426 . . . 1.0 . . . . . . . . . . . . A . 7 GLY N . . . . . . . . . c25520_2n0c 1 . 12 . 1747 . 1 1 7 GLY O O 2.001 -4.126 -3.989 . . . 1.0 . . . . . . . . . . . . A . 7 GLY O . . . . . . . . . c25520_2n0c 1 . 12 . 1748 . 1 1 8 HIS C C 4.472 -5.875 -1.796 . . . 1.0 . . . . . . . . . . . . A . 8 HIS C . . . . . . . . . c25520_2n0c 1 . 12 . 1749 . 1 1 8 HIS CA C 3.821 -4.501 -1.933 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CA . . . . . . . . . c25520_2n0c 1 . 12 . 1750 . 1 1 8 HIS CB C 4.371 -3.555 -0.869 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CB . . . . . . . . . c25520_2n0c 1 . 12 . 1751 . 1 1 8 HIS CD2 C 3.171 -1.385 -1.643 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CD2 . . . . . . . . . c25520_2n0c 1 . 12 . 1752 . 1 1 8 HIS CE1 C 4.899 -0.043 -1.566 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CE1 . . . . . . . . . c25520_2n0c 1 . 12 . 1753 . 1 1 8 HIS CG C 4.256 -2.099 -1.233 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CG . . . . . . . . . c25520_2n0c 1 . 12 . 1754 . 1 1 8 HIS H H 1.958 -4.829 -0.916 . . . 1.0 . . . . . . . . . . . . A . 8 HIS H . . . . . . . . . c25520_2n0c 1 . 12 . 1755 . 1 1 8 HIS HA H 4.090 -4.097 -2.914 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HA . . . . . . . . . c25520_2n0c 1 . 12 . 1756 . 1 1 8 HIS HB2 H 3.820 -3.720 0.054 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HB2 . . . . . . . . . c25520_2n0c 1 . 12 . 1757 . 1 1 8 HIS HB3 H 5.426 -3.774 -0.691 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HB3 . . . . . . . . . c25520_2n0c 1 . 12 . 1758 . 1 1 8 HIS HD1 H 6.293 -1.472 -0.920 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HD1 . . . . . . . . . c25520_2n0c 1 . 12 . 1759 . 1 1 8 HIS HD2 H 2.143 -1.704 -1.569 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HD2 . . . . . . . . . c25520_2n0c 1 . 12 . 1760 . 1 1 8 HIS HE1 H 5.516 0.842 -1.630 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HE1 . . . . . . . . . c25520_2n0c 1 . 12 . 1761 . 1 1 8 HIS N N 2.370 -4.602 -1.820 . . . 1.0 . . . . . . . . . . . . A . 8 HIS N . . . . . . . . . c25520_2n0c 1 . 12 . 1762 . 1 1 8 HIS ND1 N 5.338 -1.236 -1.190 . . . 1.0 . . . . . . . . . . . . A . 8 HIS ND1 . . . . . . . . . c25520_2n0c 1 . 12 . 1763 . 1 1 8 HIS NE2 N 3.595 -0.084 -1.850 . . . 1.0 . . . . . . . . . . . . A . 8 HIS NE2 . . . . . . . . . c25520_2n0c 1 . 12 . 1764 . 1 1 8 HIS O O 5.626 -5.988 -1.382 . . . 1.0 . . . . . . . . . . . . A . 8 HIS O . . . . . . . . . c25520_2n0c 1 . 12 . 1765 . 1 1 9 LEU C C 4.012 -9.026 -3.374 . . . 1.0 . . . . . . . . . . . . A . 9 LEU C . . . . . . . . . c25520_2n0c 1 . 12 . 1766 . 1 1 9 LEU CA C 4.228 -8.282 -2.060 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CA . . . . . . . . . c25520_2n0c 1 . 12 . 1767 . 1 1 9 LEU CB C 3.539 -9.031 -0.919 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CB . . . . . . . . . c25520_2n0c 1 . 12 . 1768 . 1 1 9 LEU CD1 C 1.532 -10.402 -0.303 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD1 . . . . . . . . . c25520_2n0c 1 . 12 . 1769 . 1 1 9 LEU CD2 C 1.348 -7.911 -0.435 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD2 . . . . . . . . . c25520_2n0c 1 . 12 . 1770 . 1 1 9 LEU CG C 2.017 -9.149 -1.015 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CG . . . . . . . . . c25520_2n0c 1 . 12 . 1771 . 1 1 9 LEU H H 2.776 -6.755 -2.484 . . . 1.0 . . . . . . . . . . . . A . 9 LEU H . . . . . . . . . c25520_2n0c 1 . 12 . 1772 . 1 1 9 LEU HA H 5.303 -8.264 -1.866 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HA . . . . . . . . . c25520_2n0c 1 . 12 . 1773 . 1 1 9 LEU HB2 H 3.963 -10.037 -0.892 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB2 . . . . . . . . . c25520_2n0c 1 . 12 . 1774 . 1 1 9 LEU HB3 H 3.797 -8.530 0.017 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB3 . . . . . . . . . c25520_2n0c 1 . 12 . 1775 . 1 1 9 LEU HD11 H 1.949 -11.286 -0.785 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD11 . . . . . . . . . c25520_2n0c 1 . 12 . 1776 . 1 1 9 LEU HD12 H 0.443 -10.445 -0.344 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD12 . . . . . . . . . c25520_2n0c 1 . 12 . 1777 . 1 1 9 LEU HD13 H 1.857 -10.369 0.737 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD13 . . . . . . . . . c25520_2n0c 1 . 12 . 1778 . 1 1 9 LEU HD21 H 1.616 -7.030 -1.015 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD21 . . . . . . . . . c25520_2n0c 1 . 12 . 1779 . 1 1 9 LEU HD22 H 1.671 -7.779 0.598 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD22 . . . . . . . . . c25520_2n0c 1 . 12 . 1780 . 1 1 9 LEU HD23 H 0.266 -8.043 -0.459 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD23 . . . . . . . . . c25520_2n0c 1 . 12 . 1781 . 1 1 9 LEU HG H 1.741 -9.231 -2.062 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HG . . . . . . . . . c25520_2n0c 1 . 12 . 1782 . 1 1 9 LEU N N 3.725 -6.916 -2.145 . . . 1.0 . . . . . . . . . . . . A . 9 LEU N . . . . . . . . . c25520_2n0c 1 . 12 . 1783 . 1 1 9 LEU O O 2.963 -8.899 -4.005 . . . 1.0 . . . . . . . . . . . . A . 9 LEU O . . . . . . . . . c25520_2n0c 1 . 12 . 1784 . 1 1 10 MET C C 4.821 -12.062 -4.728 . . . 1.0 . . . . . . . . . . . . A . 10 MET C . . . . . . . . . c25520_2n0c 1 . 12 . 1785 . 1 1 10 MET CA C 4.928 -10.568 -5.019 . . . 1.0 . . . . . . . . . . . . A . 10 MET CA . . . . . . . . . c25520_2n0c 1 . 12 . 1786 . 1 1 10 MET CB C 6.150 -10.294 -5.897 . . . 1.0 . . . . . . . . . . . . A . 10 MET CB . . . . . . . . . c25520_2n0c 1 . 12 . 1787 . 1 1 10 MET CE C 5.536 -6.336 -6.856 . . . 1.0 . . . . . . . . . . . . A . 10 MET CE . . . . . . . . . c25520_2n0c 1 . 12 . 1788 . 1 1 10 MET CG C 5.999 -9.068 -6.783 . . . 1.0 . . . . . . . . . . . . A . 10 MET CG . . . . . . . . . c25520_2n0c 1 . 12 . 1789 . 1 1 10 MET H H 5.856 -9.866 -3.214 . . . 1.0 . . . . . . . . . . . . A . 10 MET H . . . . . . . . . c25520_2n0c 1 . 12 . 1790 . 1 1 10 MET HA H 4.032 -10.282 -5.570 . . . 1.0 . . . . . . . . . . . . A . 10 MET HA . . . . . . . . . c25520_2n0c 1 . 12 . 1791 . 1 1 10 MET HB2 H 7.006 -10.133 -5.244 . . . 1.0 . . . . . . . . . . . . A . 10 MET HB2 . . . . . . . . . c25520_2n0c 1 . 12 . 1792 . 1 1 10 MET HB3 H 6.351 -11.166 -6.528 . . . 1.0 . . . . . . . . . . . . A . 10 MET HB3 . . . . . . . . . c25520_2n0c 1 . 12 . 1793 . 1 1 10 MET HE1 H 6.000 -5.354 -6.764 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE1 . . . . . . . . . c25520_2n0c 1 . 12 . 1794 . 1 1 10 MET HE2 H 4.525 -6.300 -6.450 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE2 . . . . . . . . . c25520_2n0c 1 . 12 . 1795 . 1 1 10 MET HE3 H 5.496 -6.623 -7.907 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE3 . . . . . . . . . c25520_2n0c 1 . 12 . 1796 . 1 1 10 MET HG2 H 6.621 -9.188 -7.671 . . . 1.0 . . . . . . . . . . . . A . 10 MET HG2 . . . . . . . . . c25520_2n0c 1 . 12 . 1797 . 1 1 10 MET HG3 H 4.962 -8.967 -7.098 . . . 1.0 . . . . . . . . . . . . A . 10 MET HG3 . . . . . . . . . c25520_2n0c 1 . 12 . 1798 . 1 1 10 MET N N 5.011 -9.802 -3.781 . . . 1.0 . . . . . . . . . . . . A . 10 MET N . . . . . . . . . c25520_2n0c 1 . 12 . 1799 . 1 1 10 MET O O 3.718 -12.524 -4.492 . . . 1.0 . . . . . . . . . . . . A . 10 MET O . . . . . . . . . c25520_2n0c 1 . 12 . 1800 . 1 1 10 MET SD S 6.501 -7.546 -5.954 . . . 1.0 . . . . . . . . . . . . A . 10 MET SD . . . . . . . . . c25520_2n0c 1 . 13 . 1801 . 1 1 1 GLY C C -6.062 6.060 3.160 . . . 1.0 . . . . . . . . . . . . A . 1 GLY C . . . . . . . . . c25520_2n0c 1 . 13 . 1802 . 1 1 1 GLY CA C -6.711 7.346 2.689 . . . 1.0 . . . . . . . . . . . . A . 1 GLY CA . . . . . . . . . c25520_2n0c 1 . 13 . 1803 . 1 1 1 GLY H1 H -4.977 7.627 1.640 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H1 . . . . . . . . . c25520_2n0c 1 . 13 . 1804 . 1 1 1 GLY H2 H -5.476 8.973 2.550 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H2 . . . . . . . . . c25520_2n0c 1 . 13 . 1805 . 1 1 1 GLY H3 H -6.278 8.572 1.105 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H3 . . . . . . . . . c25520_2n0c 1 . 13 . 1806 . 1 1 1 GLY HA2 H -7.069 7.898 3.557 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA2 . . . . . . . . . c25520_2n0c 1 . 13 . 1807 . 1 1 1 GLY HA3 H -7.560 7.098 2.052 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA3 . . . . . . . . . c25520_2n0c 1 . 13 . 1808 . 1 1 1 GLY N N -5.796 8.189 1.943 . . . 1.0 . . . . . . . . . . . . A . 1 GLY N . . . . . . . . . c25520_2n0c 1 . 13 . 1809 . 1 1 1 GLY O O -5.145 6.083 3.979 . . . 1.0 . . . . . . . . . . . . A . 1 GLY O . . . . . . . . . c25520_2n0c 1 . 13 . 1810 . 1 1 2 ASN C C -5.233 3.006 1.854 . . . 1.0 . . . . . . . . . . . . A . 2 ASN C . . . . . . . . . c25520_2n0c 1 . 13 . 1811 . 1 1 2 ASN CA C -6.001 3.631 3.015 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CA . . . . . . . . . c25520_2n0c 1 . 13 . 1812 . 1 1 2 ASN CB C -7.130 2.696 3.456 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CB . . . . . . . . . c25520_2n0c 1 . 13 . 1813 . 1 1 2 ASN CG C -8.224 3.426 4.210 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CG . . . . . . . . . c25520_2n0c 1 . 13 . 1814 . 1 1 2 ASN H H -7.306 4.979 1.970 . . . 1.0 . . . . . . . . . . . . A . 2 ASN H . . . . . . . . . c25520_2n0c 1 . 13 . 1815 . 1 1 2 ASN HA H -5.312 3.746 3.858 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HA . . . . . . . . . c25520_2n0c 1 . 13 . 1816 . 1 1 2 ASN HB2 H -7.580 2.240 2.572 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HB2 . . . . . . . . . c25520_2n0c 1 . 13 . 1817 . 1 1 2 ASN HB3 H -6.722 1.906 4.090 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HB3 . . . . . . . . . c25520_2n0c 1 . 13 . 1818 . 1 1 2 ASN HD21 H -7.552 2.675 5.991 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HD21 . . . . . . . . . c25520_2n0c 1 . 13 . 1819 . 1 1 2 ASN HD22 H -8.953 3.749 6.080 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HD22 . . . . . . . . . c25520_2n0c 1 . 13 . 1820 . 1 1 2 ASN N N -6.540 4.933 2.642 . . . 1.0 . . . . . . . . . . . . A . 2 ASN N . . . . . . . . . c25520_2n0c 1 . 13 . 1821 . 1 1 2 ASN ND2 N -8.241 3.270 5.529 . . . 1.0 . . . . . . . . . . . . A . 2 ASN ND2 . . . . . . . . . c25520_2n0c 1 . 13 . 1822 . 1 1 2 ASN O O -5.160 1.783 1.730 . . . 1.0 . . . . . . . . . . . . A . 2 ASN O . . . . . . . . . c25520_2n0c 1 . 13 . 1823 . 1 1 2 ASN OD1 O -9.044 4.124 3.614 . . . 1.0 . . . . . . . . . . . . A . 2 ASN OD1 . . . . . . . . . c25520_2n0c 1 . 13 . 1824 . 1 1 3 HIS C C -2.428 3.776 -0.018 . . . 1.0 . . . . . . . . . . . . A . 3 HIS C . . . . . . . . . c25520_2n0c 1 . 13 . 1825 . 1 1 3 HIS CA C -3.898 3.386 -0.146 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CA . . . . . . . . . c25520_2n0c 1 . 13 . 1826 . 1 1 3 HIS CB C -4.481 3.961 -1.437 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CB . . . . . . . . . c25520_2n0c 1 . 13 . 1827 . 1 1 3 HIS CD2 C -5.452 6.311 -0.912 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CD2 . . . . . . . . . c25520_2n0c 1 . 13 . 1828 . 1 1 3 HIS CE1 C -3.919 7.502 -1.924 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CE1 . . . . . . . . . c25520_2n0c 1 . 13 . 1829 . 1 1 3 HIS CG C -4.536 5.463 -1.458 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CG . . . . . . . . . c25520_2n0c 1 . 13 . 1830 . 1 1 3 HIS H H -4.757 4.857 1.164 . . . 1.0 . . . . . . . . . . . . A . 3 HIS H . . . . . . . . . c25520_2n0c 1 . 13 . 1831 . 1 1 3 HIS HA H -3.950 2.296 -0.204 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HA . . . . . . . . . c25520_2n0c 1 . 13 . 1832 . 1 1 3 HIS HB2 H -3.867 3.631 -2.274 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HB2 . . . . . . . . . c25520_2n0c 1 . 13 . 1833 . 1 1 3 HIS HB3 H -5.490 3.568 -1.567 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HB3 . . . . . . . . . c25520_2n0c 1 . 13 . 1834 . 1 1 3 HIS HD1 H -2.757 5.889 -2.596 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HD1 . . . . . . . . . c25520_2n0c 1 . 13 . 1835 . 1 1 3 HIS HD2 H -6.203 6.045 -0.182 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HD2 . . . . . . . . . c25520_2n0c 1 . 13 . 1836 . 1 1 3 HIS HE1 H -3.361 8.342 -2.310 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HE1 . . . . . . . . . c25520_2n0c 1 . 13 . 1837 . 1 1 3 HIS N N -4.661 3.855 1.005 . . . 1.0 . . . . . . . . . . . . A . 3 HIS N . . . . . . . . . c25520_2n0c 1 . 13 . 1838 . 1 1 3 HIS ND1 N -3.575 6.233 -2.093 . . . 1.0 . . . . . . . . . . . . A . 3 HIS ND1 . . . . . . . . . c25520_2n0c 1 . 13 . 1839 . 1 1 3 HIS NE2 N -5.045 7.599 -1.217 . . . 1.0 . . . . . . . . . . . . A . 3 HIS NE2 . . . . . . . . . c25520_2n0c 1 . 13 . 1840 . 1 1 3 HIS O O -1.758 4.042 -1.015 . . . 1.0 . . . . . . . . . . . . A . 3 HIS O . . . . . . . . . c25520_2n0c 1 . 13 . 1841 . 1 1 4 TRP C C 0.388 3.014 1.126 . . . 1.0 . . . . . . . . . . . . A . 4 TRP C . . . . . . . . . c25520_2n0c 1 . 13 . 1842 . 1 1 4 TRP CA C -0.546 4.168 1.473 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CA . . . . . . . . . c25520_2n0c 1 . 13 . 1843 . 1 1 4 TRP CB C -0.363 4.565 2.939 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CB . . . . . . . . . c25520_2n0c 1 . 13 . 1844 . 1 1 4 TRP CD1 C -1.106 6.744 4.067 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CD1 . . . . . . . . . c25520_2n0c 1 . 13 . 1845 . 1 1 4 TRP CD2 C 0.419 7.017 2.450 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CD2 . . . . . . . . . c25520_2n0c 1 . 13 . 1846 . 1 1 4 TRP CE2 C 0.099 8.280 2.985 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CE2 . . . . . . . . . c25520_2n0c 1 . 13 . 1847 . 1 1 4 TRP CE3 C 1.359 6.941 1.418 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CE3 . . . . . . . . . c25520_2n0c 1 . 13 . 1848 . 1 1 4 TRP CG C -0.361 6.048 3.156 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CG . . . . . . . . . c25520_2n0c 1 . 13 . 1849 . 1 1 4 TRP CH2 C 1.602 9.351 1.509 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CH2 . . . . . . . . . c25520_2n0c 1 . 13 . 1850 . 1 1 4 TRP CZ2 C 0.686 9.456 2.521 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CZ2 . . . . . . . . . c25520_2n0c 1 . 13 . 1851 . 1 1 4 TRP CZ3 C 1.940 8.108 0.959 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CZ3 . . . . . . . . . c25520_2n0c 1 . 13 . 1852 . 1 1 4 TRP H H -2.541 3.576 2.001 . . . 1.0 . . . . . . . . . . . . A . 4 TRP H . . . . . . . . . c25520_2n0c 1 . 13 . 1853 . 1 1 4 TRP HA H -0.305 5.012 0.839 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HA . . . . . . . . . c25520_2n0c 1 . 13 . 1854 . 1 1 4 TRP HB2 H -1.184 4.142 3.514 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HB2 . . . . . . . . . c25520_2n0c 1 . 13 . 1855 . 1 1 4 TRP HB3 H 0.577 4.158 3.324 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HB3 . . . . . . . . . c25520_2n0c 1 . 13 . 1856 . 1 1 4 TRP HD1 H -1.804 6.303 4.762 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HD1 . . . . . . . . . c25520_2n0c 1 . 13 . 1857 . 1 1 4 TRP HE1 H -1.251 8.829 4.530 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HE1 . . . . . . . . . c25520_2n0c 1 . 13 . 1858 . 1 1 4 TRP HE3 H 1.647 5.992 0.996 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HE3 . . . . . . . . . c25520_2n0c 1 . 13 . 1859 . 1 1 4 TRP HH2 H 2.072 10.246 1.130 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HH2 . . . . . . . . . c25520_2n0c 1 . 13 . 1860 . 1 1 4 TRP HZ2 H 0.425 10.416 2.941 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HZ2 . . . . . . . . . c25520_2n0c 1 . 13 . 1861 . 1 1 4 TRP HZ3 H 2.666 8.057 0.160 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HZ3 . . . . . . . . . c25520_2n0c 1 . 13 . 1862 . 1 1 4 TRP N N -1.935 3.809 1.215 . . . 1.0 . . . . . . . . . . . . A . 4 TRP N . . . . . . . . . c25520_2n0c 1 . 13 . 1863 . 1 1 4 TRP NE1 N -0.833 8.087 3.969 . . . 1.0 . . . . . . . . . . . . A . 4 TRP NE1 . . . . . . . . . c25520_2n0c 1 . 13 . 1864 . 1 1 4 TRP O O 1.089 3.053 0.116 . . . 1.0 . . . . . . . . . . . . A . 4 TRP O . . . . . . . . . c25520_2n0c 1 . 13 . 1865 . 1 1 5 ALA C C 0.397 -0.433 1.534 . . . 1.0 . . . . . . . . . . . . A . 5 ALA C . . . . . . . . . c25520_2n0c 1 . 13 . 1866 . 1 1 5 ALA CA C 1.238 0.821 1.751 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CA . . . . . . . . . c25520_2n0c 1 . 13 . 1867 . 1 1 5 ALA CB C 2.185 0.628 2.925 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CB . . . . . . . . . c25520_2n0c 1 . 13 . 1868 . 1 1 5 ALA H H -0.211 2.016 2.793 . . . 1.0 . . . . . . . . . . . . A . 5 ALA H . . . . . . . . . c25520_2n0c 1 . 13 . 1869 . 1 1 5 ALA HA H 1.847 0.970 0.855 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HA . . . . . . . . . c25520_2n0c 1 . 13 . 1870 . 1 1 5 ALA HB1 H 2.816 1.510 3.033 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB1 . . . . . . . . . c25520_2n0c 1 . 13 . 1871 . 1 1 5 ALA HB2 H 2.809 -0.249 2.753 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB2 . . . . . . . . . c25520_2n0c 1 . 13 . 1872 . 1 1 5 ALA HB3 H 1.602 0.486 3.835 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB3 . . . . . . . . . c25520_2n0c 1 . 13 . 1873 . 1 1 5 ALA N N 0.392 1.987 1.970 . . . 1.0 . . . . . . . . . . . . A . 5 ALA N . . . . . . . . . c25520_2n0c 1 . 13 . 1874 . 1 1 5 ALA O O 0.060 -1.139 2.485 . . . 1.0 . . . . . . . . . . . . A . 5 ALA O . . . . . . . . . c25520_2n0c 1 . 13 . 1875 . 1 1 6 VAL C C -0.366 -2.414 -1.441 . . . 1.0 . . . . . . . . . . . . A . 6 VAL C . . . . . . . . . c25520_2n0c 1 . 13 . 1876 . 1 1 6 VAL CA C -0.739 -1.877 -0.065 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CA . . . . . . . . . c25520_2n0c 1 . 13 . 1877 . 1 1 6 VAL CB C -2.242 -1.553 -0.040 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CB . . . . . . . . . c25520_2n0c 1 . 13 . 1878 . 1 1 6 VAL CG1 C -3.061 -2.784 -0.400 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CG1 . . . . . . . . . c25520_2n0c 1 . 13 . 1879 . 1 1 6 VAL CG2 C -2.651 -1.010 1.321 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CG2 . . . . . . . . . c25520_2n0c 1 . 13 . 1880 . 1 1 6 VAL H H 0.377 -0.085 -0.469 . . . 1.0 . . . . . . . . . . . . A . 6 VAL H . . . . . . . . . c25520_2n0c 1 . 13 . 1881 . 1 1 6 VAL HA H -0.555 -2.665 0.669 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HA . . . . . . . . . c25520_2n0c 1 . 13 . 1882 . 1 1 6 VAL HB H -2.435 -0.785 -0.791 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HB . . . . . . . . . c25520_2n0c 1 . 13 . 1883 . 1 1 6 VAL HG11 H -4.119 -2.589 -0.224 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG11 . . . . . . . . . c25520_2n0c 1 . 13 . 1884 . 1 1 6 VAL HG12 H -2.738 -3.618 0.224 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG12 . . . . . . . . . c25520_2n0c 1 . 13 . 1885 . 1 1 6 VAL HG13 H -2.913 -3.038 -1.449 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG13 . . . . . . . . . c25520_2n0c 1 . 13 . 1886 . 1 1 6 VAL HG21 H -2.202 -0.030 1.478 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG21 . . . . . . . . . c25520_2n0c 1 . 13 . 1887 . 1 1 6 VAL HG22 H -2.305 -1.695 2.095 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG22 . . . . . . . . . c25520_2n0c 1 . 13 . 1888 . 1 1 6 VAL HG23 H -3.736 -0.920 1.374 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG23 . . . . . . . . . c25520_2n0c 1 . 13 . 1889 . 1 1 6 VAL N N 0.063 -0.706 0.277 . . . 1.0 . . . . . . . . . . . . A . 6 VAL N . . . . . . . . . c25520_2n0c 1 . 13 . 1890 . 1 1 6 VAL O O -0.218 -1.653 -2.398 . . . 1.0 . . . . . . . . . . . . A . 6 VAL O . . . . . . . . . c25520_2n0c 1 . 13 . 1891 . 1 1 7 GLY C C 1.635 -4.504 -2.972 . . . 1.0 . . . . . . . . . . . . A . 7 GLY C . . . . . . . . . c25520_2n0c 1 . 13 . 1892 . 1 1 7 GLY CA C 0.137 -4.348 -2.801 . . . 1.0 . . . . . . . . . . . . A . 7 GLY CA . . . . . . . . . c25520_2n0c 1 . 13 . 1893 . 1 1 7 GLY H H -0.354 -4.313 -0.712 . . . 1.0 . . . . . . . . . . . . A . 7 GLY H . . . . . . . . . c25520_2n0c 1 . 13 . 1894 . 1 1 7 GLY HA2 H -0.319 -5.337 -2.839 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA2 . . . . . . . . . c25520_2n0c 1 . 13 . 1895 . 1 1 7 GLY HA3 H -0.255 -3.752 -3.628 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA3 . . . . . . . . . c25520_2n0c 1 . 13 . 1896 . 1 1 7 GLY N N -0.216 -3.730 -1.537 . . . 1.0 . . . . . . . . . . . . A . 7 GLY N . . . . . . . . . c25520_2n0c 1 . 13 . 1897 . 1 1 7 GLY O O 2.133 -4.602 -4.094 . . . 1.0 . . . . . . . . . . . . A . 7 GLY O . . . . . . . . . c25520_2n0c 1 . 13 . 1898 . 1 1 8 HIS C C 4.225 -6.078 -1.482 . . . 1.0 . . . . . . . . . . . . A . 8 HIS C . . . . . . . . . c25520_2n0c 1 . 13 . 1899 . 1 1 8 HIS CA C 3.809 -4.668 -1.889 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CA . . . . . . . . . c25520_2n0c 1 . 13 . 1900 . 1 1 8 HIS CB C 4.466 -3.642 -0.964 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CB . . . . . . . . . c25520_2n0c 1 . 13 . 1901 . 1 1 8 HIS CD2 C 5.055 -1.498 -2.305 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CD2 . . . . . . . . . c25520_2n0c 1 . 13 . 1902 . 1 1 8 HIS CE1 C 3.425 -0.231 -1.575 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CE1 . . . . . . . . . c25520_2n0c 1 . 13 . 1903 . 1 1 8 HIS CG C 4.304 -2.221 -1.428 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CG . . . . . . . . . c25520_2n0c 1 . 13 . 1904 . 1 1 8 HIS H H 1.887 -4.440 -0.956 . . . 1.0 . . . . . . . . . . . . A . 8 HIS H . . . . . . . . . c25520_2n0c 1 . 13 . 1905 . 1 1 8 HIS HA H 4.174 -4.481 -2.902 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HA . . . . . . . . . c25520_2n0c 1 . 13 . 1906 . 1 1 8 HIS HB2 H 4.013 -3.732 0.021 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HB2 . . . . . . . . . c25520_2n0c 1 . 13 . 1907 . 1 1 8 HIS HB3 H 5.531 -3.869 -0.885 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HB3 . . . . . . . . . c25520_2n0c 1 . 13 . 1908 . 1 1 8 HIS HD1 H 2.550 -1.656 -0.312 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HD1 . . . . . . . . . c25520_2n0c 1 . 13 . 1909 . 1 1 8 HIS HD2 H 6.039 -1.765 -2.661 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HD2 . . . . . . . . . c25520_2n0c 1 . 13 . 1910 . 1 1 8 HIS HE1 H 2.774 0.617 -1.423 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HE1 . . . . . . . . . c25520_2n0c 1 . 13 . 1911 . 1 1 8 HIS N N 2.358 -4.525 -1.857 . . . 1.0 . . . . . . . . . . . . A . 8 HIS N . . . . . . . . . c25520_2n0c 1 . 13 . 1912 . 1 1 8 HIS ND1 N 3.279 -1.404 -0.978 . . . 1.0 . . . . . . . . . . . . A . 8 HIS ND1 . . . . . . . . . c25520_2n0c 1 . 13 . 1913 . 1 1 8 HIS NE2 N 4.485 -0.241 -2.387 . . . 1.0 . . . . . . . . . . . . A . 8 HIS NE2 . . . . . . . . . c25520_2n0c 1 . 13 . 1914 . 1 1 8 HIS O O 5.299 -6.279 -0.912 . . . 1.0 . . . . . . . . . . . . A . 8 HIS O . . . . . . . . . c25520_2n0c 1 . 13 . 1915 . 1 1 9 LEU C C 4.584 -9.073 -2.464 . . . 1.0 . . . . . . . . . . . . A . 9 LEU C . . . . . . . . . c25520_2n0c 1 . 13 . 1916 . 1 1 9 LEU CA C 3.647 -8.442 -1.440 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CA . . . . . . . . . c25520_2n0c 1 . 13 . 1917 . 1 1 9 LEU CB C 2.343 -9.239 -1.365 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CB . . . . . . . . . c25520_2n0c 1 . 13 . 1918 . 1 1 9 LEU CD1 C 0.063 -9.396 -0.336 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD1 . . . . . . . . . c25520_2n0c 1 . 13 . 1919 . 1 1 9 LEU CD2 C 2.085 -9.958 1.022 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD2 . . . . . . . . . c25520_2n0c 1 . 13 . 1920 . 1 1 9 LEU CG C 1.528 -9.074 -0.082 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CG . . . . . . . . . c25520_2n0c 1 . 13 . 1921 . 1 1 9 LEU H H 2.495 -6.818 -2.251 . . . 1.0 . . . . . . . . . . . . A . 9 LEU H . . . . . . . . . c25520_2n0c 1 . 13 . 1922 . 1 1 9 LEU HA H 4.123 -8.480 -0.462 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HA . . . . . . . . . c25520_2n0c 1 . 13 . 1923 . 1 1 9 LEU HB2 H 1.726 -8.923 -2.208 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB2 . . . . . . . . . c25520_2n0c 1 . 13 . 1924 . 1 1 9 LEU HB3 H 2.571 -10.302 -1.491 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB3 . . . . . . . . . c25520_2n0c 1 . 13 . 1925 . 1 1 9 LEU HD11 H -0.358 -8.682 -1.044 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD11 . . . . . . . . . c25520_2n0c 1 . 13 . 1926 . 1 1 9 LEU HD12 H -0.488 -9.343 0.603 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD12 . . . . . . . . . c25520_2n0c 1 . 13 . 1927 . 1 1 9 LEU HD13 H -0.015 -10.402 -0.747 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD13 . . . . . . . . . c25520_2n0c 1 . 13 . 1928 . 1 1 9 LEU HD21 H 3.101 -9.659 1.271 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD21 . . . . . . . . . c25520_2n0c 1 . 13 . 1929 . 1 1 9 LEU HD22 H 2.083 -10.995 0.685 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD22 . . . . . . . . . c25520_2n0c 1 . 13 . 1930 . 1 1 9 LEU HD23 H 1.455 -9.866 1.907 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD23 . . . . . . . . . c25520_2n0c 1 . 13 . 1931 . 1 1 9 LEU HG H 1.605 -8.032 0.231 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HG . . . . . . . . . c25520_2n0c 1 . 13 . 1932 . 1 1 9 LEU N N 3.369 -7.050 -1.777 . . . 1.0 . . . . . . . . . . . . A . 9 LEU N . . . . . . . . . c25520_2n0c 1 . 13 . 1933 . 1 1 9 LEU O O 4.852 -8.492 -3.515 . . . 1.0 . . . . . . . . . . . . A . 9 LEU O . . . . . . . . . c25520_2n0c 1 . 13 . 1934 . 1 1 10 MET C C 5.226 -12.003 -3.883 . . . 1.0 . . . . . . . . . . . . A . 10 MET C . . . . . . . . . c25520_2n0c 1 . 13 . 1935 . 1 1 10 MET CA C 5.984 -10.978 -3.046 . . . 1.0 . . . . . . . . . . . . A . 10 MET CA . . . . . . . . . c25520_2n0c 1 . 13 . 1936 . 1 1 10 MET CB C 7.088 -11.671 -2.245 . . . 1.0 . . . . . . . . . . . . A . 10 MET CB . . . . . . . . . c25520_2n0c 1 . 13 . 1937 . 1 1 10 MET CE C 9.141 -14.797 -2.198 . . . 1.0 . . . . . . . . . . . . A . 10 MET CE . . . . . . . . . c25520_2n0c 1 . 13 . 1938 . 1 1 10 MET CG C 8.104 -12.395 -3.112 . . . 1.0 . . . . . . . . . . . . A . 10 MET CG . . . . . . . . . c25520_2n0c 1 . 13 . 1939 . 1 1 10 MET H H 4.819 -10.697 -1.264 . . . 1.0 . . . . . . . . . . . . A . 10 MET H . . . . . . . . . c25520_2n0c 1 . 13 . 1940 . 1 1 10 MET HA H 6.459 -10.265 -3.724 . . . 1.0 . . . . . . . . . . . . A . 10 MET HA . . . . . . . . . c25520_2n0c 1 . 13 . 1941 . 1 1 10 MET HB2 H 7.614 -10.924 -1.651 . . . 1.0 . . . . . . . . . . . . A . 10 MET HB2 . . . . . . . . . c25520_2n0c 1 . 13 . 1942 . 1 1 10 MET HB3 H 6.624 -12.394 -1.573 . . . 1.0 . . . . . . . . . . . . A . 10 MET HB3 . . . . . . . . . c25520_2n0c 1 . 13 . 1943 . 1 1 10 MET HE1 H 9.264 -15.167 -3.216 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE1 . . . . . . . . . c25520_2n0c 1 . 13 . 1944 . 1 1 10 MET HE2 H 9.825 -15.325 -1.534 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE2 . . . . . . . . . c25520_2n0c 1 . 13 . 1945 . 1 1 10 MET HE3 H 8.115 -14.966 -1.871 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE3 . . . . . . . . . c25520_2n0c 1 . 13 . 1946 . 1 1 10 MET HG2 H 7.606 -13.225 -3.612 . . . 1.0 . . . . . . . . . . . . A . 10 MET HG2 . . . . . . . . . c25520_2n0c 1 . 13 . 1947 . 1 1 10 MET HG3 H 8.477 -11.699 -3.864 . . . 1.0 . . . . . . . . . . . . A . 10 MET HG3 . . . . . . . . . c25520_2n0c 1 . 13 . 1948 . 1 1 10 MET N N 5.079 -10.266 -2.151 . . . 1.0 . . . . . . . . . . . . A . 10 MET N . . . . . . . . . c25520_2n0c 1 . 13 . 1949 . 1 1 10 MET O O 5.160 -13.146 -3.459 . . . 1.0 . . . . . . . . . . . . A . 10 MET O . . . . . . . . . c25520_2n0c 1 . 13 . 1950 . 1 1 10 MET SD S 9.493 -13.042 -2.161 . . . 1.0 . . . . . . . . . . . . A . 10 MET SD . . . . . . . . . c25520_2n0c 1 . 14 . 1951 . 1 1 1 GLY C C -8.598 5.273 3.512 . . . 1.0 . . . . . . . . . . . . A . 1 GLY C . . . . . . . . . c25520_2n0c 1 . 14 . 1952 . 1 1 1 GLY CA C -9.238 5.388 4.880 . . . 1.0 . . . . . . . . . . . . A . 1 GLY CA . . . . . . . . . c25520_2n0c 1 . 14 . 1953 . 1 1 1 GLY H1 H -9.508 3.372 5.105 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H1 . . . . . . . . . c25520_2n0c 1 . 14 . 1954 . 1 1 1 GLY H2 H -10.881 4.212 4.556 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H2 . . . . . . . . . c25520_2n0c 1 . 14 . 1955 . 1 1 1 GLY H3 H -10.405 4.323 6.185 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H3 . . . . . . . . . c25520_2n0c 1 . 14 . 1956 . 1 1 1 GLY HA2 H -9.854 6.287 4.906 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA2 . . . . . . . . . c25520_2n0c 1 . 14 . 1957 . 1 1 1 GLY HA3 H -8.451 5.477 5.629 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA3 . . . . . . . . . c25520_2n0c 1 . 14 . 1958 . 1 1 1 GLY N N -10.067 4.243 5.205 . . . 1.0 . . . . . . . . . . . . A . 1 GLY N . . . . . . . . . c25520_2n0c 1 . 14 . 1959 . 1 1 1 GLY O O -9.217 4.780 2.570 . . . 1.0 . . . . . . . . . . . . A . 1 GLY O . . . . . . . . . c25520_2n0c 1 . 14 . 1960 . 1 1 2 ASN C C -5.684 4.480 2.100 . . . 1.0 . . . . . . . . . . . . A . 2 ASN C . . . . . . . . . c25520_2n0c 1 . 14 . 1961 . 1 1 2 ASN CA C -6.631 5.676 2.135 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CA . . . . . . . . . c25520_2n0c 1 . 14 . 1962 . 1 1 2 ASN CB C -5.844 6.971 1.920 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CB . . . . . . . . . c25520_2n0c 1 . 14 . 1963 . 1 1 2 ASN CG C -4.727 7.143 2.931 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CG . . . . . . . . . c25520_2n0c 1 . 14 . 1964 . 1 1 2 ASN H H -6.895 6.128 4.219 . . . 1.0 . . . . . . . . . . . . A . 2 ASN H . . . . . . . . . c25520_2n0c 1 . 14 . 1965 . 1 1 2 ASN HA H -7.345 5.568 1.315 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HA . . . . . . . . . c25520_2n0c 1 . 14 . 1966 . 1 1 2 ASN HB2 H -5.419 6.967 0.917 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HB2 . . . . . . . . . c25520_2n0c 1 . 14 . 1967 . 1 1 2 ASN HB3 H -6.530 7.815 2.012 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HB3 . . . . . . . . . c25520_2n0c 1 . 14 . 1968 . 1 1 2 ASN HD21 H -3.427 6.122 1.724 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HD21 . . . . . . . . . c25520_2n0c 1 . 14 . 1969 . 1 1 2 ASN HD22 H -2.771 6.694 3.262 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HD22 . . . . . . . . . c25520_2n0c 1 . 14 . 1970 . 1 1 2 ASN N N -7.354 5.729 3.400 . . . 1.0 . . . . . . . . . . . . A . 2 ASN N . . . . . . . . . c25520_2n0c 1 . 14 . 1971 . 1 1 2 ASN ND2 N -3.553 6.610 2.612 . . . 1.0 . . . . . . . . . . . . A . 2 ASN ND2 . . . . . . . . . c25520_2n0c 1 . 14 . 1972 . 1 1 2 ASN O O -5.520 3.775 3.096 . . . 1.0 . . . . . . . . . . . . A . 2 ASN O . . . . . . . . . c25520_2n0c 1 . 14 . 1973 . 1 1 2 ASN OD1 O -4.917 7.749 3.986 . . . 1.0 . . . . . . . . . . . . A . 2 ASN OD1 . . . . . . . . . c25520_2n0c 1 . 14 . 1974 . 1 1 3 HIS C C -2.700 3.655 0.656 . . . 1.0 . . . . . . . . . . . . A . 3 HIS C . . . . . . . . . c25520_2n0c 1 . 14 . 1975 . 1 1 3 HIS CA C -4.133 3.147 0.779 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CA . . . . . . . . . c25520_2n0c 1 . 14 . 1976 . 1 1 3 HIS CB C -4.503 2.323 -0.453 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CB . . . . . . . . . c25520_2n0c 1 . 14 . 1977 . 1 1 3 HIS CD2 C -5.573 0.394 0.916 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CD2 . . . . . . . . . c25520_2n0c 1 . 14 . 1978 . 1 1 3 HIS CE1 C -7.130 -0.164 -0.519 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CE1 . . . . . . . . . c25520_2n0c 1 . 14 . 1979 . 1 1 3 HIS CG C -5.470 1.207 -0.173 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CG . . . . . . . . . c25520_2n0c 1 . 14 . 1980 . 1 1 3 HIS H H -5.245 4.874 0.153 . . . 1.0 . . . . . . . . . . . . A . 3 HIS H . . . . . . . . . c25520_2n0c 1 . 14 . 1981 . 1 1 3 HIS HA H -4.178 2.497 1.654 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HA . . . . . . . . . c25520_2n0c 1 . 14 . 1982 . 1 1 3 HIS HB2 H -4.960 2.989 -1.183 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HB2 . . . . . . . . . c25520_2n0c 1 . 14 . 1983 . 1 1 3 HIS HB3 H -3.600 1.891 -0.893 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HB3 . . . . . . . . . c25520_2n0c 1 . 14 . 1984 . 1 1 3 HIS HD1 H -6.643 1.261 -1.979 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HD1 . . . . . . . . . c25520_2n0c 1 . 14 . 1985 . 1 1 3 HIS HD2 H -4.799 0.235 1.652 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HD2 . . . . . . . . . c25520_2n0c 1 . 14 . 1986 . 1 1 3 HIS HE1 H -7.966 -0.665 -0.983 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HE1 . . . . . . . . . c25520_2n0c 1 . 14 . 1987 . 1 1 3 HIS N N -5.065 4.257 0.944 . . . 1.0 . . . . . . . . . . . . A . 3 HIS N . . . . . . . . . c25520_2n0c 1 . 14 . 1988 . 1 1 3 HIS ND1 N -6.461 0.840 -1.068 . . . 1.0 . . . . . . . . . . . . A . 3 HIS ND1 . . . . . . . . . c25520_2n0c 1 . 14 . 1989 . 1 1 3 HIS NE2 N -6.629 -0.469 0.681 . . . 1.0 . . . . . . . . . . . . A . 3 HIS NE2 . . . . . . . . . c25520_2n0c 1 . 14 . 1990 . 1 1 3 HIS O O -2.214 3.909 -0.447 . . . 1.0 . . . . . . . . . . . . A . 3 HIS O . . . . . . . . . c25520_2n0c 1 . 14 . 1991 . 1 1 4 TRP C C 0.275 3.296 1.104 . . . 1.0 . . . . . . . . . . . . A . 4 TRP C . . . . . . . . . c25520_2n0c 1 . 14 . 1992 . 1 1 4 TRP CA C -0.651 4.278 1.812 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CA . . . . . . . . . c25520_2n0c 1 . 14 . 1993 . 1 1 4 TRP CB C -0.183 4.492 3.253 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CB . . . . . . . . . c25520_2n0c 1 . 14 . 1994 . 1 1 4 TRP CD1 C -0.186 6.645 4.643 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CD1 . . . . . . . . . c25520_2n0c 1 . 14 . 1995 . 1 1 4 TRP CD2 C 1.003 6.774 2.749 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CD2 . . . . . . . . . c25520_2n0c 1 . 14 . 1996 . 1 1 4 TRP CE2 C 1.082 8.012 3.415 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CE2 . . . . . . . . . c25520_2n0c 1 . 14 . 1997 . 1 1 4 TRP CE3 C 1.674 6.618 1.534 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CE3 . . . . . . . . . c25520_2n0c 1 . 14 . 1998 . 1 1 4 TRP CG C 0.187 5.914 3.552 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CG . . . . . . . . . c25520_2n0c 1 . 14 . 1999 . 1 1 4 TRP CH2 C 2.453 8.906 1.711 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CH2 . . . . . . . . . c25520_2n0c 1 . 14 . 2000 . 1 1 4 TRP CZ2 C 1.805 9.087 2.903 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CZ2 . . . . . . . . . c25520_2n0c 1 . 14 . 2001 . 1 1 4 TRP CZ3 C 2.391 7.685 1.027 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CZ3 . . . . . . . . . c25520_2n0c 1 . 14 . 2002 . 1 1 4 TRP H H -2.487 3.567 2.674 . . . 1.0 . . . . . . . . . . . . A . 4 TRP H . . . . . . . . . c25520_2n0c 1 . 14 . 2003 . 1 1 4 TRP HA H -0.621 5.227 1.279 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HA . . . . . . . . . c25520_2n0c 1 . 14 . 2004 . 1 1 4 TRP HB2 H -0.995 4.213 3.922 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HB2 . . . . . . . . . c25520_2n0c 1 . 14 . 2005 . 1 1 4 TRP HB3 H 0.678 3.854 3.473 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HB3 . . . . . . . . . c25520_2n0c 1 . 14 . 2006 . 1 1 4 TRP HD1 H -0.810 6.282 5.447 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HD1 . . . . . . . . . c25520_2n0c 1 . 14 . 2007 . 1 1 4 TRP HE1 H 0.226 8.657 5.250 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HE1 . . . . . . . . . c25520_2n0c 1 . 14 . 2008 . 1 1 4 TRP HE3 H 1.638 5.679 1.003 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HE3 . . . . . . . . . c25520_2n0c 1 . 14 . 2009 . 1 1 4 TRP HH2 H 3.022 9.724 1.290 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HH2 . . . . . . . . . c25520_2n0c 1 . 14 . 2010 . 1 1 4 TRP HZ2 H 1.853 10.030 3.427 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HZ2 . . . . . . . . . c25520_2n0c 1 . 14 . 2011 . 1 1 4 TRP HZ3 H 2.912 7.571 0.088 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HZ3 . . . . . . . . . c25520_2n0c 1 . 14 . 2012 . 1 1 4 TRP N N -2.029 3.801 1.793 . . . 1.0 . . . . . . . . . . . . A . 4 TRP N . . . . . . . . . c25520_2n0c 1 . 14 . 2013 . 1 1 4 TRP NE1 N 0.348 7.909 4.567 . . . 1.0 . . . . . . . . . . . . A . 4 TRP NE1 . . . . . . . . . c25520_2n0c 1 . 14 . 2014 . 1 1 4 TRP O O 0.810 3.593 0.037 . . . 1.0 . . . . . . . . . . . . A . 4 TRP O . . . . . . . . . c25520_2n0c 1 . 14 . 2015 . 1 1 5 ALA C C 0.557 -0.203 0.921 . . . 1.0 . . . . . . . . . . . . A . 5 ALA C . . . . . . . . . c25520_2n0c 1 . 14 . 2016 . 1 1 5 ALA CA C 1.322 1.100 1.130 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CA . . . . . . . . . c25520_2n0c 1 . 14 . 2017 . 1 1 5 ALA CB C 2.532 0.867 2.021 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CB . . . . . . . . . c25520_2n0c 1 . 14 . 2018 . 1 1 5 ALA H H -0.010 1.941 2.592 . . . 1.0 . . . . . . . . . . . . A . 5 ALA H . . . . . . . . . c25520_2n0c 1 . 14 . 2019 . 1 1 5 ALA HA H 1.686 1.429 0.153 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HA . . . . . . . . . c25520_2n0c 1 . 14 . 2020 . 1 1 5 ALA HB1 H 3.141 1.771 2.052 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB1 . . . . . . . . . c25520_2n0c 1 . 14 . 2021 . 1 1 5 ALA HB2 H 3.125 0.042 1.626 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB2 . . . . . . . . . c25520_2n0c 1 . 14 . 2022 . 1 1 5 ALA HB3 H 2.194 0.623 3.028 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB3 . . . . . . . . . c25520_2n0c 1 . 14 . 2023 . 1 1 5 ALA N N 0.460 2.126 1.705 . . . 1.0 . . . . . . . . . . . . A . 5 ALA N . . . . . . . . . c25520_2n0c 1 . 14 . 2024 . 1 1 5 ALA O O 0.347 -0.969 1.862 . . . 1.0 . . . . . . . . . . . . A . 5 ALA O . . . . . . . . . c25520_2n0c 1 . 14 . 2025 . 1 1 6 VAL C C -0.031 -2.324 -1.899 . . . 1.0 . . . . . . . . . . . . A . 6 VAL C . . . . . . . . . c25520_2n0c 1 . 14 . 2026 . 1 1 6 VAL CA C -0.599 -1.660 -0.652 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CA . . . . . . . . . c25520_2n0c 1 . 14 . 2027 . 1 1 6 VAL CB C -2.091 -1.360 -0.874 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CB . . . . . . . . . c25520_2n0c 1 . 14 . 2028 . 1 1 6 VAL CG1 C -2.280 -0.452 -2.080 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CG1 . . . . . . . . . c25520_2n0c 1 . 14 . 2029 . 1 1 6 VAL CG2 C -2.875 -2.653 -1.043 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CG2 . . . . . . . . . c25520_2n0c 1 . 14 . 2030 . 1 1 6 VAL H H 0.352 0.224 -1.056 . . . 1.0 . . . . . . . . . . . . A . 6 VAL H . . . . . . . . . c25520_2n0c 1 . 14 . 2031 . 1 1 6 VAL HA H -0.516 -2.374 0.171 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HA . . . . . . . . . c25520_2n0c 1 . 14 . 2032 . 1 1 6 VAL HB H -2.469 -0.840 0.006 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HB . . . . . . . . . c25520_2n0c 1 . 14 . 2033 . 1 1 6 VAL HG11 H -1.618 0.409 -2.000 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG11 . . . . . . . . . c25520_2n0c 1 . 14 . 2034 . 1 1 6 VAL HG12 H -3.315 -0.113 -2.126 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG12 . . . . . . . . . c25520_2n0c 1 . 14 . 2035 . 1 1 6 VAL HG13 H -2.041 -1.010 -2.986 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG13 . . . . . . . . . c25520_2n0c 1 . 14 . 2036 . 1 1 6 VAL HG21 H -2.682 -3.314 -0.198 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG21 . . . . . . . . . c25520_2n0c 1 . 14 . 2037 . 1 1 6 VAL HG22 H -2.560 -3.141 -1.965 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG22 . . . . . . . . . c25520_2n0c 1 . 14 . 2038 . 1 1 6 VAL HG23 H -3.942 -2.433 -1.097 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG23 . . . . . . . . . c25520_2n0c 1 . 14 . 2039 . 1 1 6 VAL N N 0.143 -0.449 -0.318 . . . 1.0 . . . . . . . . . . . . A . 6 VAL N . . . . . . . . . c25520_2n0c 1 . 14 . 2040 . 1 1 6 VAL O O 0.420 -1.649 -2.825 . . . 1.0 . . . . . . . . . . . . A . 6 VAL O . . . . . . . . . c25520_2n0c 1 . 14 . 2041 . 1 1 7 GLY C C 1.915 -4.760 -2.904 . . . 1.0 . . . . . . . . . . . . A . 7 GLY C . . . . . . . . . c25520_2n0c 1 . 14 . 2042 . 1 1 7 GLY CA C 0.454 -4.387 -3.063 . . . 1.0 . . . . . . . . . . . . A . 7 GLY CA . . . . . . . . . c25520_2n0c 1 . 14 . 2043 . 1 1 7 GLY H H -0.445 -4.162 -1.127 . . . 1.0 . . . . . . . . . . . . A . 7 GLY H . . . . . . . . . c25520_2n0c 1 . 14 . 2044 . 1 1 7 GLY HA2 H -0.126 -5.303 -3.171 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA2 . . . . . . . . . c25520_2n0c 1 . 14 . 2045 . 1 1 7 GLY HA3 H 0.339 -3.791 -3.971 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA3 . . . . . . . . . c25520_2n0c 1 . 14 . 2046 . 1 1 7 GLY N N -0.058 -3.653 -1.922 . . . 1.0 . . . . . . . . . . . . A . 7 GLY N . . . . . . . . . c25520_2n0c 1 . 14 . 2047 . 1 1 7 GLY O O 2.623 -4.965 -3.891 . . . 1.0 . . . . . . . . . . . . A . 7 GLY O . . . . . . . . . c25520_2n0c 1 . 14 . 2048 . 1 1 8 HIS C C 3.868 -6.646 -0.913 . . . 1.0 . . . . . . . . . . . . A . 8 HIS C . . . . . . . . . c25520_2n0c 1 . 14 . 2049 . 1 1 8 HIS CA C 3.757 -5.197 -1.373 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CA . . . . . . . . . c25520_2n0c 1 . 14 . 2050 . 1 1 8 HIS CB C 4.332 -4.265 -0.306 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CB . . . . . . . . . c25520_2n0c 1 . 14 . 2051 . 1 1 8 HIS CD2 C 5.860 -2.651 -1.648 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CD2 . . . . . . . . . c25520_2n0c 1 . 14 . 2052 . 1 1 8 HIS CE1 C 4.806 -0.788 -1.187 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CE1 . . . . . . . . . c25520_2n0c 1 . 14 . 2053 . 1 1 8 HIS CG C 4.798 -2.941 -0.845 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CG . . . . . . . . . c25520_2n0c 1 . 14 . 2054 . 1 1 8 HIS H H 1.735 -4.666 -0.881 . . . 1.0 . . . . . . . . . . . . A . 8 HIS H . . . . . . . . . c25520_2n0c 1 . 14 . 2055 . 1 1 8 HIS HA H 4.358 -5.081 -2.280 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HA . . . . . . . . . c25520_2n0c 1 . 14 . 2056 . 1 1 8 HIS HB2 H 3.557 -4.073 0.432 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HB2 . . . . . . . . . c25520_2n0c 1 . 14 . 2057 . 1 1 8 HIS HB3 H 5.177 -4.746 0.192 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HB3 . . . . . . . . . c25520_2n0c 1 . 14 . 2058 . 1 1 8 HIS HD1 H 3.312 -1.637 0.014 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HD1 . . . . . . . . . c25520_2n0c 1 . 14 . 2059 . 1 1 8 HIS HD2 H 6.441 -3.367 -2.210 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HD2 . . . . . . . . . c25520_2n0c 1 . 14 . 2060 . 1 1 8 HIS HE1 H 4.535 0.257 -1.156 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HE1 . . . . . . . . . c25520_2n0c 1 . 14 . 2061 . 1 1 8 HIS N N 2.370 -4.847 -1.658 . . . 1.0 . . . . . . . . . . . . A . 8 HIS N . . . . . . . . . c25520_2n0c 1 . 14 . 2062 . 1 1 8 HIS ND1 N 4.145 -1.752 -0.564 . . . 1.0 . . . . . . . . . . . . A . 8 HIS ND1 . . . . . . . . . c25520_2n0c 1 . 14 . 2063 . 1 1 8 HIS NE2 N 5.851 -1.283 -1.855 . . . 1.0 . . . . . . . . . . . . A . 8 HIS NE2 . . . . . . . . . c25520_2n0c 1 . 14 . 2064 . 1 1 8 HIS O O 4.774 -7.001 -0.157 . . . 1.0 . . . . . . . . . . . . A . 8 HIS O . . . . . . . . . c25520_2n0c 1 . 14 . 2065 . 1 1 9 LEU C C 3.531 -9.746 -2.124 . . . 1.0 . . . . . . . . . . . . A . 9 LEU C . . . . . . . . . c25520_2n0c 1 . 14 . 2066 . 1 1 9 LEU CA C 2.936 -8.894 -1.008 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CA . . . . . . . . . c25520_2n0c 1 . 14 . 2067 . 1 1 9 LEU CB C 1.510 -9.355 -0.702 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CB . . . . . . . . . c25520_2n0c 1 . 14 . 2068 . 1 1 9 LEU CD1 C -0.650 -8.736 0.409 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD1 . . . . . . . . . c25520_2n0c 1 . 14 . 2069 . 1 1 9 LEU CD2 C 1.279 -9.533 1.788 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD2 . . . . . . . . . c25520_2n0c 1 . 14 . 2070 . 1 1 9 LEU CG C 0.864 -8.755 0.548 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CG . . . . . . . . . c25520_2n0c 1 . 14 . 2071 . 1 1 9 LEU H H 2.219 -7.128 -1.999 . . . 1.0 . . . . . . . . . . . . A . 9 LEU H . . . . . . . . . c25520_2n0c 1 . 14 . 2072 . 1 1 9 LEU HA H 3.533 -9.039 -0.105 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HA . . . . . . . . . c25520_2n0c 1 . 14 . 2073 . 1 1 9 LEU HB2 H 0.898 -9.096 -1.567 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB2 . . . . . . . . . c25520_2n0c 1 . 14 . 2074 . 1 1 9 LEU HB3 H 1.514 -10.445 -0.601 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB3 . . . . . . . . . c25520_2n0c 1 . 14 . 2075 . 1 1 9 LEU HD11 H -1.095 -8.434 1.356 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD11 . . . . . . . . . c25520_2n0c 1 . 14 . 2076 . 1 1 9 LEU HD12 H -0.996 -9.736 0.147 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD12 . . . . . . . . . c25520_2n0c 1 . 14 . 2077 . 1 1 9 LEU HD13 H -0.943 -8.035 -0.372 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD13 . . . . . . . . . c25520_2n0c 1 . 14 . 2078 . 1 1 9 LEU HD21 H 0.811 -9.091 2.667 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD21 . . . . . . . . . c25520_2n0c 1 . 14 . 2079 . 1 1 9 LEU HD22 H 2.363 -9.506 1.902 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD22 . . . . . . . . . c25520_2n0c 1 . 14 . 2080 . 1 1 9 LEU HD23 H 0.951 -10.567 1.684 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD23 . . . . . . . . . c25520_2n0c 1 . 14 . 2081 . 1 1 9 LEU HG H 1.215 -7.726 0.648 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HG . . . . . . . . . c25520_2n0c 1 . 14 . 2082 . 1 1 9 LEU N N 2.943 -7.481 -1.373 . . . 1.0 . . . . . . . . . . . . A . 9 LEU N . . . . . . . . . c25520_2n0c 1 . 14 . 2083 . 1 1 9 LEU O O 2.957 -9.856 -3.207 . . . 1.0 . . . . . . . . . . . . A . 9 LEU O . . . . . . . . . c25520_2n0c 1 . 14 . 2084 . 1 1 10 MET C C 4.454 -12.356 -3.253 . . . 1.0 . . . . . . . . . . . . A . 10 MET C . . . . . . . . . c25520_2n0c 1 . 14 . 2085 . 1 1 10 MET CA C 5.353 -11.198 -2.830 . . . 1.0 . . . . . . . . . . . . A . 10 MET CA . . . . . . . . . c25520_2n0c 1 . 14 . 2086 . 1 1 10 MET CB C 6.664 -11.737 -2.258 . . . 1.0 . . . . . . . . . . . . A . 10 MET CB . . . . . . . . . c25520_2n0c 1 . 14 . 2087 . 1 1 10 MET CE C 9.020 -12.414 0.298 . . . 1.0 . . . . . . . . . . . . A . 10 MET CE . . . . . . . . . c25520_2n0c 1 . 14 . 2088 . 1 1 10 MET CG C 6.514 -12.369 -0.884 . . . 1.0 . . . . . . . . . . . . A . 10 MET CG . . . . . . . . . c25520_2n0c 1 . 14 . 2089 . 1 1 10 MET H H 5.106 -10.226 -0.930 . . . 1.0 . . . . . . . . . . . . A . 10 MET H . . . . . . . . . c25520_2n0c 1 . 14 . 2090 . 1 1 10 MET HA H 5.574 -10.596 -3.710 . . . 1.0 . . . . . . . . . . . . A . 10 MET HA . . . . . . . . . c25520_2n0c 1 . 14 . 2091 . 1 1 10 MET HB2 H 7.065 -12.475 -2.958 . . . 1.0 . . . . . . . . . . . . A . 10 MET HB2 . . . . . . . . . c25520_2n0c 1 . 14 . 2092 . 1 1 10 MET HB3 H 7.369 -10.907 -2.190 . . . 1.0 . . . . . . . . . . . . A . 10 MET HB3 . . . . . . . . . c25520_2n0c 1 . 14 . 2093 . 1 1 10 MET HE1 H 8.938 -13.329 0.885 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE1 . . . . . . . . . c25520_2n0c 1 . 14 . 2094 . 1 1 10 MET HE2 H 9.232 -12.666 -0.741 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE2 . . . . . . . . . c25520_2n0c 1 . 14 . 2095 . 1 1 10 MET HE3 H 9.828 -11.800 0.695 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE3 . . . . . . . . . c25520_2n0c 1 . 14 . 2096 . 1 1 10 MET HG2 H 5.464 -12.355 -0.590 . . . 1.0 . . . . . . . . . . . . A . 10 MET HG2 . . . . . . . . . c25520_2n0c 1 . 14 . 2097 . 1 1 10 MET HG3 H 6.850 -13.409 -0.923 . . . 1.0 . . . . . . . . . . . . A . 10 MET HG3 . . . . . . . . . c25520_2n0c 1 . 14 . 2098 . 1 1 10 MET N N 4.683 -10.351 -1.850 . . . 1.0 . . . . . . . . . . . . A . 10 MET N . . . . . . . . . c25520_2n0c 1 . 14 . 2099 . 1 1 10 MET O O 3.855 -12.261 -4.311 . . . 1.0 . . . . . . . . . . . . A . 10 MET O . . . . . . . . . c25520_2n0c 1 . 14 . 2100 . 1 1 10 MET SD S 7.473 -11.515 0.382 . . . 1.0 . . . . . . . . . . . . A . 10 MET SD . . . . . . . . . c25520_2n0c 1 . 15 . 2101 . 1 1 1 GLY C C -9.346 5.448 1.527 . . . 1.0 . . . . . . . . . . . . A . 1 GLY C . . . . . . . . . c25520_2n0c 1 . 15 . 2102 . 1 1 1 GLY CA C -10.738 4.904 1.782 . . . 1.0 . . . . . . . . . . . . A . 1 GLY CA . . . . . . . . . c25520_2n0c 1 . 15 . 2103 . 1 1 1 GLY H1 H -11.444 2.997 1.532 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H1 . . . . . . . . . c25520_2n0c 1 . 15 . 2104 . 1 1 1 GLY H2 H -10.177 3.425 0.484 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H2 . . . . . . . . . c25520_2n0c 1 . 15 . 2105 . 1 1 1 GLY H3 H -11.743 4.033 0.226 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H3 . . . . . . . . . c25520_2n0c 1 . 15 . 2106 . 1 1 1 GLY HA2 H -11.466 5.691 1.584 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA2 . . . . . . . . . c25520_2n0c 1 . 15 . 2107 . 1 1 1 GLY HA3 H -10.814 4.608 2.828 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA3 . . . . . . . . . c25520_2n0c 1 . 15 . 2108 . 1 1 1 GLY N N -11.048 3.759 0.947 . . . 1.0 . . . . . . . . . . . . A . 1 GLY N . . . . . . . . . c25520_2n0c 1 . 15 . 2109 . 1 1 1 GLY O O -9.182 6.453 0.837 . . . 1.0 . . . . . . . . . . . . A . 1 GLY O . . . . . . . . . c25520_2n0c 1 . 15 . 2110 . 1 1 2 ASN C C -6.026 4.001 1.818 . . . 1.0 . . . . . . . . . . . . A . 2 ASN C . . . . . . . . . c25520_2n0c 1 . 15 . 2111 . 1 1 2 ASN CA C -6.955 5.207 1.919 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CA . . . . . . . . . c25520_2n0c 1 . 15 . 2112 . 1 1 2 ASN CB C -6.527 6.099 3.086 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CB . . . . . . . . . c25520_2n0c 1 . 15 . 2113 . 1 1 2 ASN CG C -5.324 6.958 2.747 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CG . . . . . . . . . c25520_2n0c 1 . 15 . 2114 . 1 1 2 ASN H H -8.541 3.957 2.652 . . . 1.0 . . . . . . . . . . . . A . 2 ASN H . . . . . . . . . c25520_2n0c 1 . 15 . 2115 . 1 1 2 ASN HA H -6.865 5.784 0.994 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HA . . . . . . . . . c25520_2n0c 1 . 15 . 2116 . 1 1 2 ASN HB2 H -7.358 6.754 3.343 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HB2 . . . . . . . . . c25520_2n0c 1 . 15 . 2117 . 1 1 2 ASN HB3 H -6.292 5.472 3.949 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HB3 . . . . . . . . . c25520_2n0c 1 . 15 . 2118 . 1 1 2 ASN HD21 H -4.532 6.649 4.608 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HD21 . . . . . . . . . c25520_2n0c 1 . 15 . 2119 . 1 1 2 ASN HD22 H -3.581 7.663 3.519 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HD22 . . . . . . . . . c25520_2n0c 1 . 15 . 2120 . 1 1 2 ASN N N -8.341 4.783 2.088 . . . 1.0 . . . . . . . . . . . . A . 2 ASN N . . . . . . . . . c25520_2n0c 1 . 15 . 2121 . 1 1 2 ASN ND2 N -4.410 7.098 3.700 . . . 1.0 . . . . . . . . . . . . A . 2 ASN ND2 . . . . . . . . . c25520_2n0c 1 . 15 . 2122 . 1 1 2 ASN O O -6.120 3.064 2.611 . . . 1.0 . . . . . . . . . . . . A . 2 ASN O . . . . . . . . . c25520_2n0c 1 . 15 . 2123 . 1 1 2 ASN OD1 O -5.218 7.488 1.641 . . . 1.0 . . . . . . . . . . . . A . 2 ASN OD1 . . . . . . . . . c25520_2n0c 1 . 15 . 2124 . 1 1 3 HIS C C -2.748 3.469 0.603 . . . 1.0 . . . . . . . . . . . . A . 3 HIS C . . . . . . . . . c25520_2n0c 1 . 15 . 2125 . 1 1 3 HIS CA C -4.180 2.944 0.634 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CA . . . . . . . . . c25520_2n0c 1 . 15 . 2126 . 1 1 3 HIS CB C -4.495 2.206 -0.667 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CB . . . . . . . . . c25520_2n0c 1 . 15 . 2127 . 1 1 3 HIS CD2 C -5.857 3.769 -2.231 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CD2 . . . . . . . . . c25520_2n0c 1 . 15 . 2128 . 1 1 3 HIS CE1 C -4.254 4.254 -3.639 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CE1 . . . . . . . . . c25520_2n0c 1 . 15 . 2129 . 1 1 3 HIS CG C -4.725 3.119 -1.839 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CG . . . . . . . . . c25520_2n0c 1 . 15 . 2130 . 1 1 3 HIS H H -5.100 4.839 0.216 . . . 1.0 . . . . . . . . . . . . A . 3 HIS H . . . . . . . . . c25520_2n0c 1 . 15 . 2131 . 1 1 3 HIS HA H -4.254 2.232 1.461 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HA . . . . . . . . . c25520_2n0c 1 . 15 . 2132 . 1 1 3 HIS HB2 H -3.663 1.550 -0.904 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HB2 . . . . . . . . . c25520_2n0c 1 . 15 . 2133 . 1 1 3 HIS HB3 H -5.388 1.598 -0.515 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HB3 . . . . . . . . . c25520_2n0c 1 . 15 . 2134 . 1 1 3 HIS HD1 H -2.758 3.108 -2.719 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HD1 . . . . . . . . . c25520_2n0c 1 . 15 . 2135 . 1 1 3 HIS HD2 H -6.748 3.902 -1.634 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HD2 . . . . . . . . . c25520_2n0c 1 . 15 . 2136 . 1 1 3 HIS HE1 H -3.715 4.675 -4.476 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HE1 . . . . . . . . . c25520_2n0c 1 . 15 . 2137 . 1 1 3 HIS N N -5.128 4.033 0.839 . . . 1.0 . . . . . . . . . . . . A . 3 HIS N . . . . . . . . . c25520_2n0c 1 . 15 . 2138 . 1 1 3 HIS ND1 N -3.723 3.438 -2.741 . . . 1.0 . . . . . . . . . . . . A . 3 HIS ND1 . . . . . . . . . c25520_2n0c 1 . 15 . 2139 . 1 1 3 HIS NE2 N -5.541 4.482 -3.372 . . . 1.0 . . . . . . . . . . . . A . 3 HIS NE2 . . . . . . . . . c25520_2n0c 1 . 15 . 2140 . 1 1 3 HIS O O -2.127 3.544 -0.457 . . . 1.0 . . . . . . . . . . . . A . 3 HIS O . . . . . . . . . c25520_2n0c 1 . 15 . 2141 . 1 1 4 TRP C C 0.125 3.403 1.218 . . . 1.0 . . . . . . . . . . . . A . 4 TRP C . . . . . . . . . c25520_2n0c 1 . 15 . 2142 . 1 1 4 TRP CA C -0.872 4.351 1.877 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CA . . . . . . . . . c25520_2n0c 1 . 15 . 2143 . 1 1 4 TRP CB C -0.499 4.564 3.345 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CB . . . . . . . . . c25520_2n0c 1 . 15 . 2144 . 1 1 4 TRP CD1 C -1.457 6.404 4.850 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CD1 . . . . . . . . . c25520_2n0c 1 . 15 . 2145 . 1 1 4 TRP CD2 C -0.092 7.150 3.238 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CD2 . . . . . . . . . c25520_2n0c 1 . 15 . 2146 . 1 1 4 TRP CE2 C -0.546 8.252 3.987 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CE2 . . . . . . . . . c25520_2n0c 1 . 15 . 2147 . 1 1 4 TRP CE3 C 0.780 7.375 2.169 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CE3 . . . . . . . . . c25520_2n0c 1 . 15 . 2148 . 1 1 4 TRP CG C -0.686 5.977 3.805 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CG . . . . . . . . . c25520_2n0c 1 . 15 . 2149 . 1 1 4 TRP CH2 C 0.697 9.750 2.649 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CH2 . . . . . . . . . c25520_2n0c 1 . 15 . 2150 . 1 1 4 TRP CZ2 C -0.157 9.558 3.700 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CZ2 . . . . . . . . . c25520_2n0c 1 . 15 . 2151 . 1 1 4 TRP CZ3 C 1.165 8.672 1.886 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CZ3 . . . . . . . . . c25520_2n0c 1 . 15 . 2152 . 1 1 4 TRP H H -2.797 3.744 2.615 . . . 1.0 . . . . . . . . . . . . A . 4 TRP H . . . . . . . . . c25520_2n0c 1 . 15 . 2153 . 1 1 4 TRP HA H -0.830 5.308 1.357 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HA . . . . . . . . . c25520_2n0c 1 . 15 . 2154 . 1 1 4 TRP HB2 H -1.134 3.924 3.955 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HB2 . . . . . . . . . c25520_2n0c 1 . 15 . 2155 . 1 1 4 TRP HB3 H 0.545 4.281 3.514 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HB3 . . . . . . . . . c25520_2n0c 1 . 15 . 2156 . 1 1 4 TRP HD1 H -2.043 5.762 5.491 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HD1 . . . . . . . . . c25520_2n0c 1 . 15 . 2157 . 1 1 4 TRP HE1 H -1.854 8.346 5.659 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HE1 . . . . . . . . . c25520_2n0c 1 . 15 . 2158 . 1 1 4 TRP HE3 H 1.147 6.550 1.579 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HE3 . . . . . . . . . c25520_2n0c 1 . 15 . 2159 . 1 1 4 TRP HH2 H 1.015 10.753 2.404 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HH2 . . . . . . . . . c25520_2n0c 1 . 15 . 2160 . 1 1 4 TRP HZ2 H -0.516 10.391 4.287 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HZ2 . . . . . . . . . c25520_2n0c 1 . 15 . 2161 . 1 1 4 TRP HZ3 H 1.839 8.852 1.061 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HZ3 . . . . . . . . . c25520_2n0c 1 . 15 . 2162 . 1 1 4 TRP N N -2.231 3.832 1.771 . . . 1.0 . . . . . . . . . . . . A . 4 TRP N . . . . . . . . . c25520_2n0c 1 . 15 . 2163 . 1 1 4 TRP NE1 N -1.377 7.771 4.964 . . . 1.0 . . . . . . . . . . . . A . 4 TRP NE1 . . . . . . . . . c25520_2n0c 1 . 15 . 2164 . 1 1 4 TRP O O 0.637 3.683 0.135 . . . 1.0 . . . . . . . . . . . . A . 4 TRP O . . . . . . . . . c25520_2n0c 1 . 15 . 2165 . 1 1 5 ALA C C 0.621 -0.020 1.043 . . . 1.0 . . . . . . . . . . . . A . 5 ALA C . . . . . . . . . c25520_2n0c 1 . 15 . 2166 . 1 1 5 ALA CA C 1.330 1.294 1.356 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CA . . . . . . . . . c25520_2n0c 1 . 15 . 2167 . 1 1 5 ALA CB C 2.461 1.062 2.346 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CB . . . . . . . . . c25520_2n0c 1 . 15 . 2168 . 1 1 5 ALA H H -0.058 2.111 2.776 . . . 1.0 . . . . . . . . . . . . A . 5 ALA H . . . . . . . . . c25520_2n0c 1 . 15 . 2169 . 1 1 5 ALA HA H 1.773 1.661 0.427 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HA . . . . . . . . . c25520_2n0c 1 . 15 . 2170 . 1 1 5 ALA HB1 H 2.904 2.018 2.623 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB1 . . . . . . . . . c25520_2n0c 1 . 15 . 2171 . 1 1 5 ALA HB2 H 3.223 0.428 1.892 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB2 . . . . . . . . . c25520_2n0c 1 . 15 . 2172 . 1 1 5 ALA HB3 H 2.063 0.574 3.237 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB3 . . . . . . . . . c25520_2n0c 1 . 15 . 2173 . 1 1 5 ALA N N 0.396 2.283 1.879 . . . 1.0 . . . . . . . . . . . . A . 5 ALA N . . . . . . . . . c25520_2n0c 1 . 15 . 2174 . 1 1 5 ALA O O 0.474 -0.880 1.910 . . . 1.0 . . . . . . . . . . . . A . 5 ALA O . . . . . . . . . c25520_2n0c 1 . 15 . 2175 . 1 1 6 VAL C C 0.180 -2.010 -1.831 . . . 1.0 . . . . . . . . . . . . A . 6 VAL C . . . . . . . . . c25520_2n0c 1 . 15 . 2176 . 1 1 6 VAL CA C -0.513 -1.376 -0.634 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CA . . . . . . . . . c25520_2n0c 1 . 15 . 2177 . 1 1 6 VAL CB C -1.979 -1.081 -0.996 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CB . . . . . . . . . c25520_2n0c 1 . 15 . 2178 . 1 1 6 VAL CG1 C -2.055 -0.151 -2.198 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CG1 . . . . . . . . . c25520_2n0c 1 . 15 . 2179 . 1 1 6 VAL CG2 C -2.731 -2.376 -1.267 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CG2 . . . . . . . . . c25520_2n0c 1 . 15 . 2180 . 1 1 6 VAL H H 0.337 0.583 -0.878 . . . 1.0 . . . . . . . . . . . . A . 6 VAL H . . . . . . . . . c25520_2n0c 1 . 15 . 2181 . 1 1 6 VAL HA H -0.509 -2.109 0.177 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HA . . . . . . . . . c25520_2n0c 1 . 15 . 2182 . 1 1 6 VAL HB H -2.447 -0.581 -0.147 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HB . . . . . . . . . c25520_2n0c 1 . 15 . 2183 . 1 1 6 VAL HG11 H -3.096 -0.034 -2.495 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG11 . . . . . . . . . c25520_2n0c 1 . 15 . 2184 . 1 1 6 VAL HG12 H -1.498 -0.571 -3.034 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG12 . . . . . . . . . c25520_2n0c 1 . 15 . 2185 . 1 1 6 VAL HG13 H -1.642 0.824 -1.939 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG13 . . . . . . . . . c25520_2n0c 1 . 15 . 2186 . 1 1 6 VAL HG21 H -2.629 -3.045 -0.412 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG21 . . . . . . . . . c25520_2n0c 1 . 15 . 2187 . 1 1 6 VAL HG22 H -2.314 -2.853 -2.154 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG22 . . . . . . . . . c25520_2n0c 1 . 15 . 2188 . 1 1 6 VAL HG23 H -3.787 -2.158 -1.434 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG23 . . . . . . . . . c25520_2n0c 1 . 15 . 2189 . 1 1 6 VAL N N 0.181 -0.166 -0.203 . . . 1.0 . . . . . . . . . . . . A . 6 VAL N . . . . . . . . . c25520_2n0c 1 . 15 . 2190 . 1 1 6 VAL O O 0.760 -1.317 -2.667 . . . 1.0 . . . . . . . . . . . . A . 6 VAL O . . . . . . . . . c25520_2n0c 1 . 15 . 2191 . 1 1 7 GLY C C 2.161 -4.471 -2.699 . . . 1.0 . . . . . . . . . . . . A . 7 GLY C . . . . . . . . . c25520_2n0c 1 . 15 . 2192 . 1 1 7 GLY CA C 0.741 -4.043 -3.015 . . . 1.0 . . . . . . . . . . . . A . 7 GLY CA . . . . . . . . . c25520_2n0c 1 . 15 . 2193 . 1 1 7 GLY H H -0.379 -3.858 -1.193 . . . 1.0 . . . . . . . . . . . . A . 7 GLY H . . . . . . . . . c25520_2n0c 1 . 15 . 2194 . 1 1 7 GLY HA2 H 0.152 -4.935 -3.228 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA2 . . . . . . . . . c25520_2n0c 1 . 15 . 2195 . 1 1 7 GLY HA3 H 0.750 -3.410 -3.905 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA3 . . . . . . . . . c25520_2n0c 1 . 15 . 2196 . 1 1 7 GLY N N 0.117 -3.335 -1.913 . . . 1.0 . . . . . . . . . . . . A . 7 GLY N . . . . . . . . . c25520_2n0c 1 . 15 . 2197 . 1 1 7 GLY O O 3.114 -3.973 -3.298 . . . 1.0 . . . . . . . . . . . . A . 7 GLY O . . . . . . . . . c25520_2n0c 1 . 15 . 2198 . 1 1 8 HIS C C 3.756 -7.374 -1.672 . . . 1.0 . . . . . . . . . . . . A . 8 HIS C . . . . . . . . . c25520_2n0c 1 . 15 . 2199 . 1 1 8 HIS CA C 3.617 -5.888 -1.358 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CA . . . . . . . . . c25520_2n0c 1 . 15 . 2200 . 1 1 8 HIS CB C 3.847 -5.645 0.136 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CB . . . . . . . . . c25520_2n0c 1 . 15 . 2201 . 1 1 8 HIS CD2 C 3.311 -3.634 1.690 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CD2 . . . . . . . . . c25520_2n0c 1 . 15 . 2202 . 1 1 8 HIS CE1 C 3.894 -2.032 0.317 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CE1 . . . . . . . . . c25520_2n0c 1 . 15 . 2203 . 1 1 8 HIS CG C 3.744 -4.197 0.526 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CG . . . . . . . . . c25520_2n0c 1 . 15 . 2204 . 1 1 8 HIS H H 1.472 -5.769 -1.295 . . . 1.0 . . . . . . . . . . . . A . 8 HIS H . . . . . . . . . c25520_2n0c 1 . 15 . 2205 . 1 1 8 HIS HA H 4.396 -5.352 -1.906 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HA . . . . . . . . . c25520_2n0c 1 . 15 . 2206 . 1 1 8 HIS HB2 H 3.103 -6.210 0.695 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HB2 . . . . . . . . . c25520_2n0c 1 . 15 . 2207 . 1 1 8 HIS HB3 H 4.840 -6.010 0.401 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HB3 . . . . . . . . . c25520_2n0c 1 . 15 . 2208 . 1 1 8 HIS HD1 H 4.472 -3.267 -1.276 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HD1 . . . . . . . . . c25520_2n0c 1 . 15 . 2209 . 1 1 8 HIS HD2 H 3.159 -4.155 2.624 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HD2 . . . . . . . . . c25520_2n0c 1 . 15 . 2210 . 1 1 8 HIS HE1 H 4.085 -1.051 -0.095 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HE1 . . . . . . . . . c25520_2n0c 1 . 15 . 2211 . 1 1 8 HIS N N 2.302 -5.394 -1.754 . . . 1.0 . . . . . . . . . . . . A . 8 HIS N . . . . . . . . . c25520_2n0c 1 . 15 . 2212 . 1 1 8 HIS ND1 N 4.107 -3.169 -0.329 . . . 1.0 . . . . . . . . . . . . A . 8 HIS ND1 . . . . . . . . . c25520_2n0c 1 . 15 . 2213 . 1 1 8 HIS NE2 N 3.413 -2.262 1.541 . . . 1.0 . . . . . . . . . . . . A . 8 HIS NE2 . . . . . . . . . c25520_2n0c 1 . 15 . 2214 . 1 1 8 HIS O O 4.055 -8.180 -0.789 . . . 1.0 . . . . . . . . . . . . A . 8 HIS O . . . . . . . . . c25520_2n0c 1 . 15 . 2215 . 1 1 9 LEU C C 5.005 -9.401 -3.983 . . . 1.0 . . . . . . . . . . . . A . 9 LEU C . . . . . . . . . c25520_2n0c 1 . 15 . 2216 . 1 1 9 LEU CA C 3.640 -9.120 -3.363 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CA . . . . . . . . . c25520_2n0c 1 . 15 . 2217 . 1 1 9 LEU CB C 2.534 -9.445 -4.369 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CB . . . . . . . . . c25520_2n0c 1 . 15 . 2218 . 1 1 9 LEU CD1 C 0.566 -8.546 -3.105 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD1 . . . . . . . . . c25520_2n0c 1 . 15 . 2219 . 1 1 9 LEU CD2 C 0.229 -10.299 -4.856 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD2 . . . . . . . . . c25520_2n0c 1 . 15 . 2220 . 1 1 9 LEU CG C 1.163 -9.772 -3.778 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CG . . . . . . . . . c25520_2n0c 1 . 15 . 2221 . 1 1 9 LEU H H 3.297 -7.016 -3.619 . . . 1.0 . . . . . . . . . . . . A . 9 LEU H . . . . . . . . . c25520_2n0c 1 . 15 . 2222 . 1 1 9 LEU HA H 3.507 -9.779 -2.501 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HA . . . . . . . . . c25520_2n0c 1 . 15 . 2223 . 1 1 9 LEU HB2 H 2.409 -8.579 -5.017 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB2 . . . . . . . . . c25520_2n0c 1 . 15 . 2224 . 1 1 9 LEU HB3 H 2.851 -10.293 -4.985 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB3 . . . . . . . . . c25520_2n0c 1 . 15 . 2225 . 1 1 9 LEU HD11 H 0.519 -7.733 -3.829 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD11 . . . . . . . . . c25520_2n0c 1 . 15 . 2226 . 1 1 9 LEU HD12 H 1.187 -8.245 -2.260 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD12 . . . . . . . . . c25520_2n0c 1 . 15 . 2227 . 1 1 9 LEU HD13 H -0.439 -8.776 -2.753 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD13 . . . . . . . . . c25520_2n0c 1 . 15 . 2228 . 1 1 9 LEU HD21 H 0.076 -9.523 -5.605 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD21 . . . . . . . . . c25520_2n0c 1 . 15 . 2229 . 1 1 9 LEU HD22 H -0.729 -10.568 -4.410 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD22 . . . . . . . . . c25520_2n0c 1 . 15 . 2230 . 1 1 9 LEU HD23 H 0.669 -11.177 -5.328 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD23 . . . . . . . . . c25520_2n0c 1 . 15 . 2231 . 1 1 9 LEU HG H 1.298 -10.548 -3.024 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HG . . . . . . . . . c25520_2n0c 1 . 15 . 2232 . 1 1 9 LEU N N 3.539 -7.730 -2.933 . . . 1.0 . . . . . . . . . . . . A . 9 LEU N . . . . . . . . . c25520_2n0c 1 . 15 . 2233 . 1 1 9 LEU O O 5.255 -9.062 -5.140 . . . 1.0 . . . . . . . . . . . . A . 9 LEU O . . . . . . . . . c25520_2n0c 1 . 15 . 2234 . 1 1 10 MET C C 7.160 -11.258 -4.906 . . . 1.0 . . . . . . . . . . . . A . 10 MET C . . . . . . . . . c25520_2n0c 1 . 15 . 2235 . 1 1 10 MET CA C 7.225 -10.353 -3.680 . . . 1.0 . . . . . . . . . . . . A . 10 MET CA . . . . . . . . . c25520_2n0c 1 . 15 . 2236 . 1 1 10 MET CB C 8.028 -11.035 -2.571 . . . 1.0 . . . . . . . . . . . . A . 10 MET CB . . . . . . . . . c25520_2n0c 1 . 15 . 2237 . 1 1 10 MET CE C 7.131 -14.331 -0.172 . . . 1.0 . . . . . . . . . . . . A . 10 MET CE . . . . . . . . . c25520_2n0c 1 . 15 . 2238 . 1 1 10 MET CG C 7.385 -12.308 -2.049 . . . 1.0 . . . . . . . . . . . . A . 10 MET CG . . . . . . . . . c25520_2n0c 1 . 15 . 2239 . 1 1 10 MET H H 5.614 -10.287 -2.258 . . . 1.0 . . . . . . . . . . . . A . 10 MET H . . . . . . . . . c25520_2n0c 1 . 15 . 2240 . 1 1 10 MET HA H 7.727 -9.428 -3.960 . . . 1.0 . . . . . . . . . . . . A . 10 MET HA . . . . . . . . . c25520_2n0c 1 . 15 . 2241 . 1 1 10 MET HB2 H 9.017 -11.282 -2.957 . . . 1.0 . . . . . . . . . . . . A . 10 MET HB2 . . . . . . . . . c25520_2n0c 1 . 15 . 2242 . 1 1 10 MET HB3 H 8.138 -10.338 -1.740 . . . 1.0 . . . . . . . . . . . . A . 10 MET HB3 . . . . . . . . . c25520_2n0c 1 . 15 . 2243 . 1 1 10 MET HE1 H 7.109 -14.972 -1.053 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE1 . . . . . . . . . c25520_2n0c 1 . 15 . 2244 . 1 1 10 MET HE2 H 6.117 -14.015 0.073 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE2 . . . . . . . . . c25520_2n0c 1 . 15 . 2245 . 1 1 10 MET HE3 H 7.554 -14.882 0.668 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE3 . . . . . . . . . c25520_2n0c 1 . 15 . 2246 . 1 1 10 MET HG2 H 6.329 -12.116 -1.869 . . . 1.0 . . . . . . . . . . . . A . 10 MET HG2 . . . . . . . . . c25520_2n0c 1 . 15 . 2247 . 1 1 10 MET HG3 H 7.482 -13.086 -2.807 . . . 1.0 . . . . . . . . . . . . A . 10 MET HG3 . . . . . . . . . c25520_2n0c 1 . 15 . 2248 . 1 1 10 MET N N 5.885 -10.024 -3.206 . . . 1.0 . . . . . . . . . . . . A . 10 MET N . . . . . . . . . c25520_2n0c 1 . 15 . 2249 . 1 1 10 MET O O 6.067 -11.678 -5.250 . . . 1.0 . . . . . . . . . . . . A . 10 MET O . . . . . . . . . c25520_2n0c 1 . 15 . 2250 . 1 1 10 MET SD S 8.135 -12.888 -0.516 . . . 1.0 . . . . . . . . . . . . A . 10 MET SD . . . . . . . . . c25520_2n0c 1 . 16 . 2251 . 1 1 1 GLY C C -8.878 4.604 3.056 . . . 1.0 . . . . . . . . . . . . A . 1 GLY C . . . . . . . . . c25520_2n0c 1 . 16 . 2252 . 1 1 1 GLY CA C -10.183 3.923 3.417 . . . 1.0 . . . . . . . . . . . . A . 1 GLY CA . . . . . . . . . c25520_2n0c 1 . 16 . 2253 . 1 1 1 GLY H1 H -9.587 2.366 2.230 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H1 . . . . . . . . . c25520_2n0c 1 . 16 . 2254 . 1 1 1 GLY H2 H -11.169 2.223 2.836 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H2 . . . . . . . . . c25520_2n0c 1 . 16 . 2255 . 1 1 1 GLY H3 H -9.835 1.953 3.854 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H3 . . . . . . . . . c25520_2n0c 1 . 16 . 2256 . 1 1 1 GLY HA2 H -10.998 4.426 2.897 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA2 . . . . . . . . . c25520_2n0c 1 . 16 . 2257 . 1 1 1 GLY HA3 H -10.342 4.013 4.492 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA3 . . . . . . . . . c25520_2n0c 1 . 16 . 2258 . 1 1 1 GLY N N -10.194 2.516 3.059 . . . 1.0 . . . . . . . . . . . . A . 1 GLY N . . . . . . . . . c25520_2n0c 1 . 16 . 2259 . 1 1 1 GLY O O -8.862 5.554 2.276 . . . 1.0 . . . . . . . . . . . . A . 1 GLY O . . . . . . . . . c25520_2n0c 1 . 16 . 2260 . 1 1 2 ASN C C -5.664 3.791 2.418 . . . 1.0 . . . . . . . . . . . . A . 2 ASN C . . . . . . . . . c25520_2n0c 1 . 16 . 2261 . 1 1 2 ASN CA C -6.465 4.687 3.361 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CA . . . . . . . . . c25520_2n0c 1 . 16 . 2262 . 1 1 2 ASN CB C -5.697 4.882 4.670 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CB . . . . . . . . . c25520_2n0c 1 . 16 . 2263 . 1 1 2 ASN CG C -5.645 3.616 5.505 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CG . . . . . . . . . c25520_2n0c 1 . 16 . 2264 . 1 1 2 ASN H H -7.861 3.327 4.266 . . . 1.0 . . . . . . . . . . . . A . 2 ASN H . . . . . . . . . c25520_2n0c 1 . 16 . 2265 . 1 1 2 ASN HA H -6.580 5.664 2.883 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HA . . . . . . . . . c25520_2n0c 1 . 16 . 2266 . 1 1 2 ASN HB2 H -4.676 5.184 4.438 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HB2 . . . . . . . . . c25520_2n0c 1 . 16 . 2267 . 1 1 2 ASN HB3 H -6.178 5.673 5.247 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HB3 . . . . . . . . . c25520_2n0c 1 . 16 . 2268 . 1 1 2 ASN HD21 H -7.489 4.019 6.297 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HD21 . . . . . . . . . c25520_2n0c 1 . 16 . 2269 . 1 1 2 ASN HD22 H -6.715 2.531 6.850 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HD22 . . . . . . . . . c25520_2n0c 1 . 16 . 2270 . 1 1 2 ASN N N -7.781 4.116 3.626 . . . 1.0 . . . . . . . . . . . . A . 2 ASN N . . . . . . . . . c25520_2n0c 1 . 16 . 2271 . 1 1 2 ASN ND2 N -6.700 3.373 6.275 . . . 1.0 . . . . . . . . . . . . A . 2 ASN ND2 . . . . . . . . . c25520_2n0c 1 . 16 . 2272 . 1 1 2 ASN O O -5.625 2.572 2.587 . . . 1.0 . . . . . . . . . . . . A . 2 ASN O . . . . . . . . . c25520_2n0c 1 . 16 . 2273 . 1 1 2 ASN OD1 O -4.670 2.868 5.457 . . . 1.0 . . . . . . . . . . . . A . 2 ASN OD1 . . . . . . . . . c25520_2n0c 1 . 16 . 2274 . 1 1 3 HIS C C -2.778 4.144 0.472 . . . 1.0 . . . . . . . . . . . . A . 3 HIS C . . . . . . . . . c25520_2n0c 1 . 16 . 2275 . 1 1 3 HIS CA C -4.226 3.665 0.458 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CA . . . . . . . . . c25520_2n0c 1 . 16 . 2276 . 1 1 3 HIS CB C -4.813 3.818 -0.944 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CB . . . . . . . . . c25520_2n0c 1 . 16 . 2277 . 1 1 3 HIS CD2 C -6.576 1.912 -0.872 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CD2 . . . . . . . . . c25520_2n0c 1 . 16 . 2278 . 1 1 3 HIS CE1 C -8.295 3.066 -1.579 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CE1 . . . . . . . . . c25520_2n0c 1 . 16 . 2279 . 1 1 3 HIS CG C -6.171 3.192 -1.106 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CG . . . . . . . . . c25520_2n0c 1 . 16 . 2280 . 1 1 3 HIS H H -5.097 5.419 1.340 . . . 1.0 . . . . . . . . . . . . A . 3 HIS H . . . . . . . . . c25520_2n0c 1 . 16 . 2281 . 1 1 3 HIS HA H -4.233 2.601 0.704 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HA . . . . . . . . . c25520_2n0c 1 . 16 . 2282 . 1 1 3 HIS HB2 H -4.899 4.882 -1.163 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HB2 . . . . . . . . . c25520_2n0c 1 . 16 . 2283 . 1 1 3 HIS HB3 H -4.128 3.366 -1.662 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HB3 . . . . . . . . . c25520_2n0c 1 . 16 . 2284 . 1 1 3 HIS HD1 H -7.290 4.893 -1.810 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HD1 . . . . . . . . . c25520_2n0c 1 . 16 . 2285 . 1 1 3 HIS HD2 H -5.927 1.062 -0.720 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HD2 . . . . . . . . . c25520_2n0c 1 . 16 . 2286 . 1 1 3 HIS HE1 H -9.294 3.333 -1.888 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HE1 . . . . . . . . . c25520_2n0c 1 . 16 . 2287 . 1 1 3 HIS N N -5.027 4.406 1.427 . . . 1.0 . . . . . . . . . . . . A . 3 HIS N . . . . . . . . . c25520_2n0c 1 . 16 . 2288 . 1 1 3 HIS ND1 N -7.271 3.907 -1.552 . . . 1.0 . . . . . . . . . . . . A . 3 HIS ND1 . . . . . . . . . c25520_2n0c 1 . 16 . 2289 . 1 1 3 HIS NE2 N -7.923 1.851 -1.177 . . . 1.0 . . . . . . . . . . . . A . 3 HIS NE2 . . . . . . . . . c25520_2n0c 1 . 16 . 2290 . 1 1 3 HIS O O -2.295 4.720 -0.503 . . . 1.0 . . . . . . . . . . . . A . 3 HIS O . . . . . . . . . c25520_2n0c 1 . 16 . 2291 . 1 1 4 TRP C C 0.237 3.277 1.101 . . . 1.0 . . . . . . . . . . . . A . 4 TRP C . . . . . . . . . c25520_2n0c 1 . 16 . 2292 . 1 1 4 TRP CA C -0.698 4.309 1.723 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CA . . . . . . . . . c25520_2n0c 1 . 16 . 2293 . 1 1 4 TRP CB C -0.348 4.507 3.199 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CB . . . . . . . . . c25520_2n0c 1 . 16 . 2294 . 1 1 4 TRP CD1 C -0.567 6.616 4.637 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CD1 . . . . . . . . . c25520_2n0c 1 . 16 . 2295 . 1 1 4 TRP CD2 C 0.747 6.859 2.840 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CD2 . . . . . . . . . c25520_2n0c 1 . 16 . 2296 . 1 1 4 TRP CE2 C 0.711 8.081 3.539 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CE2 . . . . . . . . . c25520_2n0c 1 . 16 . 2297 . 1 1 4 TRP CE3 C 1.512 6.773 1.674 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CE3 . . . . . . . . . c25520_2n0c 1 . 16 . 2298 . 1 1 4 TRP CG C -0.077 5.936 3.559 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CG . . . . . . . . . c25520_2n0c 1 . 16 . 2299 . 1 1 4 TRP CH2 C 2.152 9.093 1.965 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CH2 . . . . . . . . . c25520_2n0c 1 . 16 . 2300 . 1 1 4 TRP CZ2 C 1.411 9.206 3.109 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CZ2 . . . . . . . . . c25520_2n0c 1 . 16 . 2301 . 1 1 4 TRP CZ3 C 2.206 7.889 1.248 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CZ3 . . . . . . . . . c25520_2n0c 1 . 16 . 2302 . 1 1 4 TRP H H -2.545 3.416 2.355 . . . 1.0 . . . . . . . . . . . . A . 4 TRP H . . . . . . . . . c25520_2n0c 1 . 16 . 2303 . 1 1 4 TRP HA H -0.575 5.253 1.196 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HA . . . . . . . . . c25520_2n0c 1 . 16 . 2304 . 1 1 4 TRP HB2 H -1.190 4.166 3.800 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HB2 . . . . . . . . . c25520_2n0c 1 . 16 . 2305 . 1 1 4 TRP HB3 H 0.530 3.910 3.465 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HB3 . . . . . . . . . c25520_2n0c 1 . 16 . 2306 . 1 1 4 TRP HD1 H -1.227 6.200 5.385 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HD1 . . . . . . . . . c25520_2n0c 1 . 16 . 2307 . 1 1 4 TRP HE1 H -0.309 8.628 5.321 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HE1 . . . . . . . . . c25520_2n0c 1 . 16 . 2308 . 1 1 4 TRP HE3 H 1.576 5.850 1.121 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HE3 . . . . . . . . . c25520_2n0c 1 . 16 . 2309 . 1 1 4 TRP HH2 H 2.704 9.950 1.608 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HH2 . . . . . . . . . c25520_2n0c 1 . 16 . 2310 . 1 1 4 TRP HZ2 H 1.370 10.135 3.658 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HZ2 . . . . . . . . . c25520_2n0c 1 . 16 . 2311 . 1 1 4 TRP HZ3 H 2.799 7.829 0.347 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HZ3 . . . . . . . . . c25520_2n0c 1 . 16 . 2312 . 1 1 4 TRP N N -2.091 3.902 1.583 . . . 1.0 . . . . . . . . . . . . A . 4 TRP N . . . . . . . . . c25520_2n0c 1 . 16 . 2313 . 1 1 4 TRP NE1 N -0.097 7.907 4.632 . . . 1.0 . . . . . . . . . . . . A . 4 TRP NE1 . . . . . . . . . c25520_2n0c 1 . 16 . 2314 . 1 1 4 TRP O O 0.869 3.537 0.077 . . . 1.0 . . . . . . . . . . . . A . 4 TRP O . . . . . . . . . c25520_2n0c 1 . 16 . 2315 . 1 1 5 ALA C C 0.392 -0.264 1.074 . . . 1.0 . . . . . . . . . . . . A . 5 ALA C . . . . . . . . . c25520_2n0c 1 . 16 . 2316 . 1 1 5 ALA CA C 1.174 1.035 1.230 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CA . . . . . . . . . c25520_2n0c 1 . 16 . 2317 . 1 1 5 ALA CB C 2.359 0.833 2.162 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CB . . . . . . . . . c25520_2n0c 1 . 16 . 2318 . 1 1 5 ALA H H -0.230 1.955 2.572 . . . 1.0 . . . . . . . . . . . . A . 5 ALA H . . . . . . . . . c25520_2n0c 1 . 16 . 2319 . 1 1 5 ALA HA H 1.566 1.303 0.246 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HA . . . . . . . . . c25520_2n0c 1 . 16 . 2320 . 1 1 5 ALA HB1 H 2.884 -0.086 1.901 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB1 . . . . . . . . . c25520_2n0c 1 . 16 . 2321 . 1 1 5 ALA HB2 H 1.999 0.768 3.188 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB2 . . . . . . . . . c25520_2n0c 1 . 16 . 2322 . 1 1 5 ALA HB3 H 3.042 1.678 2.072 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB3 . . . . . . . . . c25520_2n0c 1 . 16 . 2323 . 1 1 5 ALA N N 0.318 2.107 1.725 . . . 1.0 . . . . . . . . . . . . A . 5 ALA N . . . . . . . . . c25520_2n0c 1 . 16 . 2324 . 1 1 5 ALA O O 0.072 -0.929 2.059 . . . 1.0 . . . . . . . . . . . . A . 5 ALA O . . . . . . . . . c25520_2n0c 1 . 16 . 2325 . 1 1 6 VAL C C -0.223 -2.454 -1.779 . . . 1.0 . . . . . . . . . . . . A . 6 VAL C . . . . . . . . . c25520_2n0c 1 . 16 . 2326 . 1 1 6 VAL CA C -0.660 -1.843 -0.454 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CA . . . . . . . . . c25520_2n0c 1 . 16 . 2327 . 1 1 6 VAL CB C -2.173 -1.576 -0.495 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CB . . . . . . . . . c25520_2n0c 1 . 16 . 2328 . 1 1 6 VAL CG1 C -2.935 -2.866 -0.769 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CG1 . . . . . . . . . c25520_2n0c 1 . 16 . 2329 . 1 1 6 VAL CG2 C -2.641 -0.939 0.804 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CG2 . . . . . . . . . c25520_2n0c 1 . 16 . 2330 . 1 1 6 VAL H H 0.382 -0.030 -0.946 . . . 1.0 . . . . . . . . . . . . A . 6 VAL H . . . . . . . . . c25520_2n0c 1 . 16 . 2331 . 1 1 6 VAL HA H -0.470 -2.573 0.336 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HA . . . . . . . . . c25520_2n0c 1 . 16 . 2332 . 1 1 6 VAL HB H -2.373 -0.883 -1.314 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HB . . . . . . . . . c25520_2n0c 1 . 16 . 2333 . 1 1 6 VAL HG11 H -2.749 -3.197 -1.791 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG11 . . . . . . . . . c25520_2n0c 1 . 16 . 2334 . 1 1 6 VAL HG12 H -4.003 -2.698 -0.633 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG12 . . . . . . . . . c25520_2n0c 1 . 16 . 2335 . 1 1 6 VAL HG13 H -2.596 -3.633 -0.073 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG13 . . . . . . . . . c25520_2n0c 1 . 16 . 2336 . 1 1 6 VAL HG21 H -2.312 -1.556 1.641 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG21 . . . . . . . . . c25520_2n0c 1 . 16 . 2337 . 1 1 6 VAL HG22 H -3.728 -0.869 0.810 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG22 . . . . . . . . . c25520_2n0c 1 . 16 . 2338 . 1 1 6 VAL HG23 H -2.215 0.059 0.900 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG23 . . . . . . . . . c25520_2n0c 1 . 16 . 2339 . 1 1 6 VAL N N 0.086 -0.621 -0.170 . . . 1.0 . . . . . . . . . . . . A . 6 VAL N . . . . . . . . . c25520_2n0c 1 . 16 . 2340 . 1 1 6 VAL O O -0.204 -1.782 -2.810 . . . 1.0 . . . . . . . . . . . . A . 6 VAL O . . . . . . . . . c25520_2n0c 1 . 16 . 2341 . 1 1 7 GLY C C 2.027 -4.780 -2.922 . . . 1.0 . . . . . . . . . . . . A . 7 GLY C . . . . . . . . . c25520_2n0c 1 . 16 . 2342 . 1 1 7 GLY CA C 0.555 -4.421 -2.953 . . . 1.0 . . . . . . . . . . . . A . 7 GLY CA . . . . . . . . . c25520_2n0c 1 . 16 . 2343 . 1 1 7 GLY H H 0.086 -4.246 -0.865 . . . 1.0 . . . . . . . . . . . . A . 7 GLY H . . . . . . . . . c25520_2n0c 1 . 16 . 2344 . 1 1 7 GLY HA2 H -0.018 -5.343 -3.044 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA2 . . . . . . . . . c25520_2n0c 1 . 16 . 2345 . 1 1 7 GLY HA3 H 0.362 -3.805 -3.835 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA3 . . . . . . . . . c25520_2n0c 1 . 16 . 2346 . 1 1 7 GLY N N 0.125 -3.737 -1.747 . . . 1.0 . . . . . . . . . . . . A . 7 GLY N . . . . . . . . . c25520_2n0c 1 . 16 . 2347 . 1 1 7 GLY O O 2.676 -4.860 -3.966 . . . 1.0 . . . . . . . . . . . . A . 7 GLY O . . . . . . . . . c25520_2n0c 1 . 16 . 2348 . 1 1 8 HIS C C 4.126 -6.850 -1.342 . . . 1.0 . . . . . . . . . . . . A . 8 HIS C . . . . . . . . . c25520_2n0c 1 . 16 . 2349 . 1 1 8 HIS CA C 3.963 -5.349 -1.560 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CA . . . . . . . . . c25520_2n0c 1 . 16 . 2350 . 1 1 8 HIS CB C 4.572 -4.582 -0.385 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CB . . . . . . . . . c25520_2n0c 1 . 16 . 2351 . 1 1 8 HIS CD2 C 5.650 -2.381 -1.243 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CD2 . . . . . . . . . c25520_2n0c 1 . 16 . 2352 . 1 1 8 HIS CE1 C 4.097 -0.999 -0.558 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CE1 . . . . . . . . . c25520_2n0c 1 . 16 . 2353 . 1 1 8 HIS CG C 4.674 -3.100 -0.621 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CG . . . . . . . . . c25520_2n0c 1 . 16 . 2354 . 1 1 8 HIS H H 1.967 -4.918 -0.894 . . . 1.0 . . . . . . . . . . . . A . 8 HIS H . . . . . . . . . c25520_2n0c 1 . 16 . 2355 . 1 1 8 HIS HA H 4.515 -5.069 -2.460 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HA . . . . . . . . . c25520_2n0c 1 . 16 . 2356 . 1 1 8 HIS HB2 H 3.945 -4.743 0.491 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HB2 . . . . . . . . . c25520_2n0c 1 . 16 . 2357 . 1 1 8 HIS HB3 H 5.568 -4.977 -0.182 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HB3 . . . . . . . . . c25520_2n0c 1 . 16 . 2358 . 1 1 8 HIS HD1 H 2.844 -2.442 0.305 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HD1 . . . . . . . . . c25520_2n0c 1 . 16 . 2359 . 1 1 8 HIS HD2 H 6.634 -2.744 -1.499 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HD2 . . . . . . . . . c25520_2n0c 1 . 16 . 2360 . 1 1 8 HIS HE1 H 3.541 -0.093 -0.368 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HE1 . . . . . . . . . c25520_2n0c 1 . 16 . 2361 . 1 1 8 HIS N N 2.557 -4.996 -1.722 . . . 1.0 . . . . . . . . . . . . A . 8 HIS N . . . . . . . . . c25520_2n0c 1 . 16 . 2362 . 1 1 8 HIS ND1 N 3.702 -2.211 -0.195 . . . 1.0 . . . . . . . . . . . . A . 8 HIS ND1 . . . . . . . . . c25520_2n0c 1 . 16 . 2363 . 1 1 8 HIS NE2 N 5.269 -1.052 -1.195 . . . 1.0 . . . . . . . . . . . . A . 8 HIS NE2 . . . . . . . . . c25520_2n0c 1 . 16 . 2364 . 1 1 8 HIS O O 5.030 -7.290 -0.631 . . . 1.0 . . . . . . . . . . . . A . 8 HIS O . . . . . . . . . c25520_2n0c 1 . 16 . 2365 . 1 1 9 LEU C C 4.539 -9.650 -2.494 . . . 1.0 . . . . . . . . . . . . A . 9 LEU C . . . . . . . . . c25520_2n0c 1 . 16 . 2366 . 1 1 9 LEU CA C 3.289 -9.084 -1.829 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CA . . . . . . . . . c25520_2n0c 1 . 16 . 2367 . 1 1 9 LEU CB C 2.039 -9.709 -2.450 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CB . . . . . . . . . c25520_2n0c 1 . 16 . 2368 . 1 1 9 LEU CD1 C 2.642 -12.098 -1.990 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD1 . . . . . . . . . c25520_2n0c 1 . 16 . 2369 . 1 1 9 LEU CD2 C 1.215 -10.836 -0.368 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD2 . . . . . . . . . c25520_2n0c 1 . 16 . 2370 . 1 1 9 LEU CG C 1.572 -11.029 -1.835 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CG . . . . . . . . . c25520_2n0c 1 . 16 . 2371 . 1 1 9 LEU H H 2.519 -7.206 -2.535 . . . 1.0 . . . . . . . . . . . . A . 9 LEU H . . . . . . . . . c25520_2n0c 1 . 16 . 2372 . 1 1 9 LEU HA H 3.314 -9.333 -0.775 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HA . . . . . . . . . c25520_2n0c 1 . 16 . 2373 . 1 1 9 LEU HB2 H 1.227 -8.991 -2.349 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB2 . . . . . . . . . c25520_2n0c 1 . 16 . 2374 . 1 1 9 LEU HB3 H 2.218 -9.869 -3.517 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB3 . . . . . . . . . c25520_2n0c 1 . 16 . 2375 . 1 1 9 LEU HD11 H 2.922 -12.182 -3.039 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD11 . . . . . . . . . c25520_2n0c 1 . 16 . 2376 . 1 1 9 LEU HD12 H 2.254 -13.055 -1.641 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD12 . . . . . . . . . c25520_2n0c 1 . 16 . 2377 . 1 1 9 LEU HD13 H 3.518 -11.825 -1.403 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD13 . . . . . . . . . c25520_2n0c 1 . 16 . 2378 . 1 1 9 LEU HD21 H 2.095 -10.978 0.261 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD21 . . . . . . . . . c25520_2n0c 1 . 16 . 2379 . 1 1 9 LEU HD22 H 0.459 -11.570 -0.081 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD22 . . . . . . . . . c25520_2n0c 1 . 16 . 2380 . 1 1 9 LEU HD23 H 0.814 -9.834 -0.206 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD23 . . . . . . . . . c25520_2n0c 1 . 16 . 2381 . 1 1 9 LEU HG H 0.682 -11.364 -2.373 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HG . . . . . . . . . c25520_2n0c 1 . 16 . 2382 . 1 1 9 LEU N N 3.244 -7.631 -1.957 . . . 1.0 . . . . . . . . . . . . A . 9 LEU N . . . . . . . . . c25520_2n0c 1 . 16 . 2383 . 1 1 9 LEU O O 4.602 -9.772 -3.718 . . . 1.0 . . . . . . . . . . . . A . 9 LEU O . . . . . . . . . c25520_2n0c 1 . 16 . 2384 . 1 1 10 MET C C 6.758 -12.078 -2.130 . . . 1.0 . . . . . . . . . . . . A . 10 MET C . . . . . . . . . c25520_2n0c 1 . 16 . 2385 . 1 1 10 MET CA C 6.778 -10.554 -2.193 . . . 1.0 . . . . . . . . . . . . A . 10 MET CA . . . . . . . . . c25520_2n0c 1 . 16 . 2386 . 1 1 10 MET CB C 7.967 -10.016 -1.394 . . . 1.0 . . . . . . . . . . . . A . 10 MET CB . . . . . . . . . c25520_2n0c 1 . 16 . 2387 . 1 1 10 MET CE C 10.019 -12.083 -3.796 . . . 1.0 . . . . . . . . . . . . A . 10 MET CE . . . . . . . . . c25520_2n0c 1 . 16 . 2388 . 1 1 10 MET CG C 9.258 -9.953 -2.195 . . . 1.0 . . . . . . . . . . . . A . 10 MET CG . . . . . . . . . c25520_2n0c 1 . 16 . 2389 . 1 1 10 MET H H 5.417 -9.878 -0.675 . . . 1.0 . . . . . . . . . . . . A . 10 MET H . . . . . . . . . c25520_2n0c 1 . 16 . 2390 . 1 1 10 MET HA H 6.889 -10.257 -3.236 . . . 1.0 . . . . . . . . . . . . A . 10 MET HA . . . . . . . . . c25520_2n0c 1 . 16 . 2391 . 1 1 10 MET HB2 H 7.714 -9.011 -1.051 . . . 1.0 . . . . . . . . . . . . A . 10 MET HB2 . . . . . . . . . c25520_2n0c 1 . 16 . 2392 . 1 1 10 MET HB3 H 8.132 -10.647 -0.518 . . . 1.0 . . . . . . . . . . . . A . 10 MET HB3 . . . . . . . . . c25520_2n0c 1 . 16 . 2393 . 1 1 10 MET HE1 H 8.966 -12.271 -4.004 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE1 . . . . . . . . . c25520_2n0c 1 . 16 . 2394 . 1 1 10 MET HE2 H 10.395 -11.326 -4.485 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE2 . . . . . . . . . c25520_2n0c 1 . 16 . 2395 . 1 1 10 MET HE3 H 10.586 -13.005 -3.925 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE3 . . . . . . . . . c25520_2n0c 1 . 16 . 2396 . 1 1 10 MET HG2 H 9.039 -9.731 -3.237 . . . 1.0 . . . . . . . . . . . . A . 10 MET HG2 . . . . . . . . . c25520_2n0c 1 . 16 . 2397 . 1 1 10 MET HG3 H 9.882 -9.147 -1.798 . . . 1.0 . . . . . . . . . . . . A . 10 MET HG3 . . . . . . . . . c25520_2n0c 1 . 16 . 2398 . 1 1 10 MET N N 5.531 -9.997 -1.681 . . . 1.0 . . . . . . . . . . . . A . 10 MET N . . . . . . . . . c25520_2n0c 1 . 16 . 2399 . 1 1 10 MET O O 7.756 -12.652 -1.729 . . . 1.0 . . . . . . . . . . . . A . 10 MET O . . . . . . . . . c25520_2n0c 1 . 16 . 2400 . 1 1 10 MET SD S 10.199 -11.489 -2.116 . . . 1.0 . . . . . . . . . . . . A . 10 MET SD . . . . . . . . . c25520_2n0c 1 . 17 . 2401 . 1 1 1 GLY C C -8.776 4.229 3.534 . . . 1.0 . . . . . . . . . . . . A . 1 GLY C . . . . . . . . . c25520_2n0c 1 . 17 . 2402 . 1 1 1 GLY CA C -9.642 3.531 4.562 . . . 1.0 . . . . . . . . . . . . A . 1 GLY CA . . . . . . . . . c25520_2n0c 1 . 17 . 2403 . 1 1 1 GLY H1 H -11.542 4.241 4.849 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H1 . . . . . . . . . c25520_2n0c 1 . 17 . 2404 . 1 1 1 GLY H2 H -11.464 2.623 4.335 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H2 . . . . . . . . . c25520_2n0c 1 . 17 . 2405 . 1 1 1 GLY H3 H -11.160 3.884 3.236 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H3 . . . . . . . . . c25520_2n0c 1 . 17 . 2406 . 1 1 1 GLY HA2 H -9.498 4.013 5.528 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA2 . . . . . . . . . c25520_2n0c 1 . 17 . 2407 . 1 1 1 GLY HA3 H -9.330 2.489 4.636 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA3 . . . . . . . . . c25520_2n0c 1 . 17 . 2408 . 1 1 1 GLY N N -11.052 3.573 4.222 . . . 1.0 . . . . . . . . . . . . A . 1 GLY N . . . . . . . . . c25520_2n0c 1 . 17 . 2409 . 1 1 1 GLY O O -9.285 4.814 2.578 . . . 1.0 . . . . . . . . . . . . A . 1 GLY O . . . . . . . . . c25520_2n0c 1 . 17 . 2410 . 1 1 2 ASN C C -5.713 3.761 2.054 . . . 1.0 . . . . . . . . . . . . A . 2 ASN C . . . . . . . . . c25520_2n0c 1 . 17 . 2411 . 1 1 2 ASN CA C -6.524 4.807 2.812 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CA . . . . . . . . . c25520_2n0c 1 . 17 . 2412 . 1 1 2 ASN CB C -5.584 5.741 3.576 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CB . . . . . . . . . c25520_2n0c 1 . 17 . 2413 . 1 1 2 ASN CG C -4.734 5.003 4.592 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CG . . . . . . . . . c25520_2n0c 1 . 17 . 2414 . 1 1 2 ASN H H -7.103 3.673 4.544 . . . 1.0 . . . . . . . . . . . . A . 2 ASN H . . . . . . . . . c25520_2n0c 1 . 17 . 2415 . 1 1 2 ASN HA H -7.073 5.401 2.077 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HA . . . . . . . . . c25520_2n0c 1 . 17 . 2416 . 1 1 2 ASN HB2 H -4.922 6.233 2.864 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HB2 . . . . . . . . . c25520_2n0c 1 . 17 . 2417 . 1 1 2 ASN HB3 H -6.179 6.498 4.087 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HB3 . . . . . . . . . c25520_2n0c 1 . 17 . 2418 . 1 1 2 ASN HD21 H -5.490 6.147 6.111 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HD21 . . . . . . . . . c25520_2n0c 1 . 17 . 2419 . 1 1 2 ASN HD22 H -4.311 4.916 6.578 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HD22 . . . . . . . . . c25520_2n0c 1 . 17 . 2420 . 1 1 2 ASN N N -7.463 4.171 3.730 . . . 1.0 . . . . . . . . . . . . A . 2 ASN N . . . . . . . . . c25520_2n0c 1 . 17 . 2421 . 1 1 2 ASN ND2 N -4.858 5.387 5.857 . . . 1.0 . . . . . . . . . . . . A . 2 ASN ND2 . . . . . . . . . c25520_2n0c 1 . 17 . 2422 . 1 1 2 ASN O O -5.780 2.568 2.355 . . . 1.0 . . . . . . . . . . . . A . 2 ASN O . . . . . . . . . c25520_2n0c 1 . 17 . 2423 . 1 1 2 ASN OD1 O -3.976 4.098 4.242 . . . 1.0 . . . . . . . . . . . . A . 2 ASN OD1 . . . . . . . . . c25520_2n0c 1 . 17 . 2424 . 1 1 3 HIS C C -2.645 3.702 0.369 . . . 1.0 . . . . . . . . . . . . A . 3 HIS C . . . . . . . . . c25520_2n0c 1 . 17 . 2425 . 1 1 3 HIS CA C -4.119 3.318 0.268 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CA . . . . . . . . . c25520_2n0c 1 . 17 . 2426 . 1 1 3 HIS CB C -4.567 3.349 -1.195 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CB . . . . . . . . . c25520_2n0c 1 . 17 . 2427 . 1 1 3 HIS CD2 C -7.065 3.405 -1.901 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CD2 . . . . . . . . . c25520_2n0c 1 . 17 . 2428 . 1 1 3 HIS CE1 C -7.563 1.331 -1.403 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CE1 . . . . . . . . . c25520_2n0c 1 . 17 . 2429 . 1 1 3 HIS CG C -5.950 2.797 -1.407 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CG . . . . . . . . . c25520_2n0c 1 . 17 . 2430 . 1 1 3 HIS H H -4.932 5.214 0.864 . . . 1.0 . . . . . . . . . . . . A . 3 HIS H . . . . . . . . . c25520_2n0c 1 . 17 . 2431 . 1 1 3 HIS HA H -4.226 2.292 0.628 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HA . . . . . . . . . c25520_2n0c 1 . 17 . 2432 . 1 1 3 HIS HB2 H -4.547 4.382 -1.541 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HB2 . . . . . . . . . c25520_2n0c 1 . 17 . 2433 . 1 1 3 HIS HB3 H -3.862 2.766 -1.789 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HB3 . . . . . . . . . c25520_2n0c 1 . 17 . 2434 . 1 1 3 HIS HD1 H -5.663 0.779 -0.711 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HD1 . . . . . . . . . c25520_2n0c 1 . 17 . 2435 . 1 1 3 HIS HD2 H -7.088 4.348 -2.427 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HD2 . . . . . . . . . c25520_2n0c 1 . 17 . 2436 . 1 1 3 HIS HE1 H -8.112 0.410 -1.275 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HE1 . . . . . . . . . c25520_2n0c 1 . 17 . 2437 . 1 1 3 HIS N N -4.945 4.215 1.068 . . . 1.0 . . . . . . . . . . . . A . 3 HIS N . . . . . . . . . c25520_2n0c 1 . 17 . 2438 . 1 1 3 HIS ND1 N -6.284 1.489 -1.098 . . . 1.0 . . . . . . . . . . . . A . 3 HIS ND1 . . . . . . . . . c25520_2n0c 1 . 17 . 2439 . 1 1 3 HIS NE2 N -8.079 2.462 -1.891 . . . 1.0 . . . . . . . . . . . . A . 3 HIS NE2 . . . . . . . . . c25520_2n0c 1 . 17 . 2440 . 1 1 3 HIS O O -1.919 3.681 -0.626 . . . 1.0 . . . . . . . . . . . . A . 3 HIS O . . . . . . . . . c25520_2n0c 1 . 17 . 2441 . 1 1 4 TRP C C 0.133 3.380 1.273 . . . 1.0 . . . . . . . . . . . . A . 4 TRP C . . . . . . . . . c25520_2n0c 1 . 17 . 2442 . 1 1 4 TRP CA C -0.825 4.441 1.804 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CA . . . . . . . . . c25520_2n0c 1 . 17 . 2443 . 1 1 4 TRP CB C -0.578 4.668 3.296 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CB . . . . . . . . . c25520_2n0c 1 . 17 . 2444 . 1 1 4 TRP CD1 C -1.461 6.659 4.647 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CD1 . . . . . . . . . c25520_2n0c 1 . 17 . 2445 . 1 1 4 TRP CD2 C 0.128 7.187 3.158 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CD2 . . . . . . . . . c25520_2n0c 1 . 17 . 2446 . 1 1 4 TRP CE2 C -0.269 8.361 3.829 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CE2 . . . . . . . . . c25520_2n0c 1 . 17 . 2447 . 1 1 4 TRP CE3 C 1.117 7.275 2.175 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CE3 . . . . . . . . . c25520_2n0c 1 . 17 . 2448 . 1 1 4 TRP CG C -0.647 6.110 3.697 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CG . . . . . . . . . c25520_2n0c 1 . 17 . 2449 . 1 1 4 TRP CH2 C 1.258 9.660 2.579 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CH2 . . . . . . . . . c25520_2n0c 1 . 17 . 2450 . 1 1 4 TRP CZ2 C 0.291 9.604 3.545 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CZ2 . . . . . . . . . c25520_2n0c 1 . 17 . 2451 . 1 1 4 TRP CZ3 C 1.671 8.508 1.896 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CZ3 . . . . . . . . . c25520_2n0c 1 . 17 . 2452 . 1 1 4 TRP H H -2.863 4.046 2.359 . . . 1.0 . . . . . . . . . . . . A . 4 TRP H . . . . . . . . . c25520_2n0c 1 . 17 . 2453 . 1 1 4 TRP HA H -0.637 5.371 1.268 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HA . . . . . . . . . c25520_2n0c 1 . 17 . 2454 . 1 1 4 TRP HB2 H -1.339 4.126 3.854 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HB2 . . . . . . . . . c25520_2n0c 1 . 17 . 2455 . 1 1 4 TRP HB3 H 0.405 4.278 3.578 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HB3 . . . . . . . . . c25520_2n0c 1 . 17 . 2456 . 1 1 4 TRP HD1 H -2.174 6.110 5.244 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HD1 . . . . . . . . . c25520_2n0c 1 . 17 . 2457 . 1 1 4 TRP HE1 H -1.711 8.663 5.358 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HE1 . . . . . . . . . c25520_2n0c 1 . 17 . 2458 . 1 1 4 TRP HE3 H 1.443 6.391 1.649 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HE3 . . . . . . . . . c25520_2n0c 1 . 17 . 2459 . 1 1 4 TRP HH2 H 1.710 10.612 2.340 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HH2 . . . . . . . . . c25520_2n0c 1 . 17 . 2460 . 1 1 4 TRP HZ2 H -0.025 10.494 4.068 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HZ2 . . . . . . . . . c25520_2n0c 1 . 17 . 2461 . 1 1 4 TRP HZ3 H 2.436 8.580 1.137 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HZ3 . . . . . . . . . c25520_2n0c 1 . 17 . 2462 . 1 1 4 TRP N N -2.212 4.052 1.574 . . . 1.0 . . . . . . . . . . . . A . 4 TRP N . . . . . . . . . c25520_2n0c 1 . 17 . 2463 . 1 1 4 TRP NE1 N -1.238 8.013 4.731 . . . 1.0 . . . . . . . . . . . . A . 4 TRP NE1 . . . . . . . . . c25520_2n0c 1 . 17 . 2464 . 1 1 4 TRP O O 0.786 3.579 0.249 . . . 1.0 . . . . . . . . . . . . A . 4 TRP O . . . . . . . . . c25520_2n0c 1 . 17 . 2465 . 1 1 5 ALA C C 0.286 -0.085 1.223 . . . 1.0 . . . . . . . . . . . . A . 5 ALA C . . . . . . . . . c25520_2n0c 1 . 17 . 2466 . 1 1 5 ALA CA C 1.089 1.163 1.572 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CA . . . . . . . . . c25520_2n0c 1 . 17 . 2467 . 1 1 5 ALA CB C 2.091 0.857 2.675 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CB . . . . . . . . . c25520_2n0c 1 . 17 . 2468 . 1 1 5 ALA H H -0.354 2.153 2.818 . . . 1.0 . . . . . . . . . . . . A . 5 ALA H . . . . . . . . . c25520_2n0c 1 . 17 . 2469 . 1 1 5 ALA HA H 1.654 1.454 0.682 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HA . . . . . . . . . c25520_2n0c 1 . 17 . 2470 . 1 1 5 ALA HB1 H 2.739 1.720 2.830 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB1 . . . . . . . . . c25520_2n0c 1 . 17 . 2471 . 1 1 5 ALA HB2 H 2.694 -0.006 2.394 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB2 . . . . . . . . . c25520_2n0c 1 . 17 . 2472 . 1 1 5 ALA HB3 H 1.552 0.639 3.597 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB3 . . . . . . . . . c25520_2n0c 1 . 17 . 2473 . 1 1 5 ALA N N 0.211 2.255 1.975 . . . 1.0 . . . . . . . . . . . . A . 5 ALA N . . . . . . . . . c25520_2n0c 1 . 17 . 2474 . 1 1 5 ALA O O -0.114 -0.845 2.105 . . . 1.0 . . . . . . . . . . . . A . 5 ALA O . . . . . . . . . c25520_2n0c 1 . 17 . 2475 . 1 1 6 VAL C C 0.045 -2.182 -1.642 . . . 1.0 . . . . . . . . . . . . A . 6 VAL C . . . . . . . . . c25520_2n0c 1 . 17 . 2476 . 1 1 6 VAL CA C -0.703 -1.448 -0.536 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CA . . . . . . . . . c25520_2n0c 1 . 17 . 2477 . 1 1 6 VAL CB C -2.093 -1.039 -1.053 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CB . . . . . . . . . c25520_2n0c 1 . 17 . 2478 . 1 1 6 VAL CG1 C -1.966 -0.114 -2.254 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CG1 . . . . . . . . . c25520_2n0c 1 . 17 . 2479 . 1 1 6 VAL CG2 C -2.915 -2.271 -1.404 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CG2 . . . . . . . . . c25520_2n0c 1 . 17 . 2480 . 1 1 6 VAL H H 0.414 0.374 -0.755 . . . 1.0 . . . . . . . . . . . . A . 6 VAL H . . . . . . . . . c25520_2n0c 1 . 17 . 2481 . 1 1 6 VAL HA H -0.843 -2.150 0.290 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HA . . . . . . . . . c25520_2n0c 1 . 17 . 2482 . 1 1 6 VAL HB H -2.607 -0.497 -0.258 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HB . . . . . . . . . c25520_2n0c 1 . 17 . 2483 . 1 1 6 VAL HG11 H -2.929 0.353 -2.463 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG11 . . . . . . . . . c25520_2n0c 1 . 17 . 2484 . 1 1 6 VAL HG12 H -1.649 -0.697 -3.120 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG12 . . . . . . . . . c25520_2n0c 1 . 17 . 2485 . 1 1 6 VAL HG13 H -1.226 0.660 -2.046 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG13 . . . . . . . . . c25520_2n0c 1 . 17 . 2486 . 1 1 6 VAL HG21 H -2.933 -2.955 -0.556 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG21 . . . . . . . . . c25520_2n0c 1 . 17 . 2487 . 1 1 6 VAL HG22 H -2.462 -2.768 -2.261 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG22 . . . . . . . . . c25520_2n0c 1 . 17 . 2488 . 1 1 6 VAL HG23 H -3.934 -1.973 -1.653 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG23 . . . . . . . . . c25520_2n0c 1 . 17 . 2489 . 1 1 6 VAL N N 0.052 -0.291 -0.070 . . . 1.0 . . . . . . . . . . . . A . 6 VAL N . . . . . . . . . c25520_2n0c 1 . 17 . 2490 . 1 1 6 VAL O O 0.694 -1.563 -2.484 . . . 1.0 . . . . . . . . . . . . A . 6 VAL O . . . . . . . . . c25520_2n0c 1 . 17 . 2491 . 1 1 7 GLY C C 2.101 -4.458 -2.374 . . . 1.0 . . . . . . . . . . . . A . 7 GLY C . . . . . . . . . c25520_2n0c 1 . 17 . 2492 . 1 1 7 GLY CA C 0.618 -4.306 -2.647 . . . 1.0 . . . . . . . . . . . . A . 7 GLY CA . . . . . . . . . c25520_2n0c 1 . 17 . 2493 . 1 1 7 GLY H H -0.605 -3.970 -0.916 . . . 1.0 . . . . . . . . . . . . A . 7 GLY H . . . . . . . . . c25520_2n0c 1 . 17 . 2494 . 1 1 7 GLY HA2 H 0.164 -5.296 -2.667 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA2 . . . . . . . . . c25520_2n0c 1 . 17 . 2495 . 1 1 7 GLY HA3 H 0.484 -3.838 -3.624 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA3 . . . . . . . . . c25520_2n0c 1 . 17 . 2496 . 1 1 7 GLY N N -0.052 -3.509 -1.638 . . . 1.0 . . . . . . . . . . . . A . 7 GLY N . . . . . . . . . c25520_2n0c 1 . 17 . 2497 . 1 1 7 GLY O O 2.870 -3.510 -2.534 . . . 1.0 . . . . . . . . . . . . A . 7 GLY O . . . . . . . . . c25520_2n0c 1 . 17 . 2498 . 1 1 8 HIS C C 4.407 -7.131 -2.453 . . . 1.0 . . . . . . . . . . . . A . 8 HIS C . . . . . . . . . c25520_2n0c 1 . 17 . 2499 . 1 1 8 HIS CA C 3.908 -5.927 -1.661 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CA . . . . . . . . . c25520_2n0c 1 . 17 . 2500 . 1 1 8 HIS CB C 4.093 -6.174 -0.163 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CB . . . . . . . . . c25520_2n0c 1 . 17 . 2501 . 1 1 8 HIS CD2 C 2.683 -4.815 1.541 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CD2 . . . . . . . . . c25520_2n0c 1 . 17 . 2502 . 1 1 8 HIS CE1 C 3.899 -2.993 1.551 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CE1 . . . . . . . . . c25520_2n0c 1 . 17 . 2503 . 1 1 8 HIS CG C 3.731 -4.989 0.688 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CG . . . . . . . . . c25520_2n0c 1 . 17 . 2504 . 1 1 8 HIS H H 1.821 -6.402 -1.845 . . . 1.0 . . . . . . . . . . . . A . 8 HIS H . . . . . . . . . c25520_2n0c 1 . 17 . 2505 . 1 1 8 HIS HA H 4.520 -5.064 -1.936 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HA . . . . . . . . . c25520_2n0c 1 . 17 . 2506 . 1 1 8 HIS HB2 H 3.467 -7.016 0.128 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HB2 . . . . . . . . . c25520_2n0c 1 . 17 . 2507 . 1 1 8 HIS HB3 H 5.137 -6.431 0.022 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HB3 . . . . . . . . . c25520_2n0c 1 . 17 . 2508 . 1 1 8 HIS HD1 H 5.339 -3.649 0.176 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HD1 . . . . . . . . . c25520_2n0c 1 . 17 . 2509 . 1 1 8 HIS HD2 H 1.802 -5.437 1.593 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HD2 . . . . . . . . . c25520_2n0c 1 . 17 . 2510 . 1 1 8 HIS HE1 H 4.259 -2.001 1.777 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HE1 . . . . . . . . . c25520_2n0c 1 . 17 . 2511 . 1 1 8 HIS N N 2.506 -5.655 -1.958 . . . 1.0 . . . . . . . . . . . . A . 8 HIS N . . . . . . . . . c25520_2n0c 1 . 17 . 2512 . 1 1 8 HIS ND1 N 4.488 -3.828 0.708 . . . 1.0 . . . . . . . . . . . . A . 8 HIS ND1 . . . . . . . . . c25520_2n0c 1 . 17 . 2513 . 1 1 8 HIS NE2 N 2.804 -3.545 2.080 . . . 1.0 . . . . . . . . . . . . A . 8 HIS NE2 . . . . . . . . . c25520_2n0c 1 . 17 . 2514 . 1 1 8 HIS O O 5.081 -8.009 -1.911 . . . 1.0 . . . . . . . . . . . . A . 8 HIS O . . . . . . . . . c25520_2n0c 1 . 17 . 2515 . 1 1 9 LEU C C 5.408 -7.767 -5.714 . . . 1.0 . . . . . . . . . . . . A . 9 LEU C . . . . . . . . . c25520_2n0c 1 . 17 . 2516 . 1 1 9 LEU CA C 4.485 -8.266 -4.606 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CA . . . . . . . . . c25520_2n0c 1 . 17 . 2517 . 1 1 9 LEU CB C 3.260 -8.949 -5.216 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CB . . . . . . . . . c25520_2n0c 1 . 17 . 2518 . 1 1 9 LEU CD1 C 3.912 -11.326 -4.760 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD1 . . . . . . . . . c25520_2n0c 1 . 17 . 2519 . 1 1 9 LEU CD2 C 2.251 -10.812 -6.556 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD2 . . . . . . . . . c25520_2n0c 1 . 17 . 2520 . 1 1 9 LEU CG C 3.498 -10.329 -5.831 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CG . . . . . . . . . c25520_2n0c 1 . 17 . 2521 . 1 1 9 LEU H H 3.514 -6.410 -4.130 . . . 1.0 . . . . . . . . . . . . A . 9 LEU H . . . . . . . . . c25520_2n0c 1 . 17 . 2522 . 1 1 9 LEU HA H 5.027 -9.008 -4.023 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HA . . . . . . . . . c25520_2n0c 1 . 17 . 2523 . 1 1 9 LEU HB2 H 2.507 -9.055 -4.437 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB2 . . . . . . . . . c25520_2n0c 1 . 17 . 2524 . 1 1 9 LEU HB3 H 2.860 -8.292 -5.991 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB3 . . . . . . . . . c25520_2n0c 1 . 17 . 2525 . 1 1 9 LEU HD11 H 3.356 -11.134 -3.841 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD11 . . . . . . . . . c25520_2n0c 1 . 17 . 2526 . 1 1 9 LEU HD12 H 4.981 -11.245 -4.560 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD12 . . . . . . . . . c25520_2n0c 1 . 17 . 2527 . 1 1 9 LEU HD13 H 3.697 -12.340 -5.102 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD13 . . . . . . . . . c25520_2n0c 1 . 17 . 2528 . 1 1 9 LEU HD21 H 2.468 -11.742 -7.079 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD21 . . . . . . . . . c25520_2n0c 1 . 17 . 2529 . 1 1 9 LEU HD22 H 1.928 -10.057 -7.272 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD22 . . . . . . . . . c25520_2n0c 1 . 17 . 2530 . 1 1 9 LEU HD23 H 1.459 -10.983 -5.827 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD23 . . . . . . . . . c25520_2n0c 1 . 17 . 2531 . 1 1 9 LEU HG H 4.309 -10.241 -6.556 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HG . . . . . . . . . c25520_2n0c 1 . 17 . 2532 . 1 1 9 LEU N N 4.072 -7.169 -3.738 . . . 1.0 . . . . . . . . . . . . A . 9 LEU N . . . . . . . . . c25520_2n0c 1 . 17 . 2533 . 1 1 9 LEU O O 6.369 -8.441 -6.085 . . . 1.0 . . . . . . . . . . . . A . 9 LEU O . . . . . . . . . c25520_2n0c 1 . 17 . 2534 . 1 1 10 MET C C 6.212 -4.524 -7.004 . . . 1.0 . . . . . . . . . . . . A . 10 MET C . . . . . . . . . c25520_2n0c 1 . 17 . 2535 . 1 1 10 MET CA C 5.915 -5.991 -7.298 . . . 1.0 . . . . . . . . . . . . A . 10 MET CA . . . . . . . . . c25520_2n0c 1 . 17 . 2536 . 1 1 10 MET CB C 5.196 -6.119 -8.642 . . . 1.0 . . . . . . . . . . . . A . 10 MET CB . . . . . . . . . c25520_2n0c 1 . 17 . 2537 . 1 1 10 MET CE C 1.369 -5.225 -9.931 . . . 1.0 . . . . . . . . . . . . A . 10 MET CE . . . . . . . . . c25520_2n0c 1 . 17 . 2538 . 1 1 10 MET CG C 3.816 -5.482 -8.656 . . . 1.0 . . . . . . . . . . . . A . 10 MET CG . . . . . . . . . c25520_2n0c 1 . 17 . 2539 . 1 1 10 MET H H 4.300 -6.073 -5.882 . . . 1.0 . . . . . . . . . . . . A . 10 MET H . . . . . . . . . c25520_2n0c 1 . 17 . 2540 . 1 1 10 MET HA H 6.871 -6.517 -7.366 . . . 1.0 . . . . . . . . . . . . A . 10 MET HA . . . . . . . . . c25520_2n0c 1 . 17 . 2541 . 1 1 10 MET HB2 H 5.800 -5.638 -9.411 . . . 1.0 . . . . . . . . . . . . A . 10 MET HB2 . . . . . . . . . c25520_2n0c 1 . 17 . 2542 . 1 1 10 MET HB3 H 5.095 -7.177 -8.884 . . . 1.0 . . . . . . . . . . . . A . 10 MET HB3 . . . . . . . . . c25520_2n0c 1 . 17 . 2543 . 1 1 10 MET HE1 H 0.879 -4.624 -10.697 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE1 . . . . . . . . . c25520_2n0c 1 . 17 . 2544 . 1 1 10 MET HE2 H 1.258 -4.738 -8.963 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE2 . . . . . . . . . c25520_2n0c 1 . 17 . 2545 . 1 1 10 MET HE3 H 0.911 -6.213 -9.896 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE3 . . . . . . . . . c25520_2n0c 1 . 17 . 2546 . 1 1 10 MET HG2 H 3.150 -6.076 -8.030 . . . 1.0 . . . . . . . . . . . . A . 10 MET HG2 . . . . . . . . . c25520_2n0c 1 . 17 . 2547 . 1 1 10 MET HG3 H 3.889 -4.476 -8.243 . . . 1.0 . . . . . . . . . . . . A . 10 MET HG3 . . . . . . . . . c25520_2n0c 1 . 17 . 2548 . 1 1 10 MET N N 5.110 -6.582 -6.235 . . . 1.0 . . . . . . . . . . . . A . 10 MET N . . . . . . . . . c25520_2n0c 1 . 17 . 2549 . 1 1 10 MET O O 6.301 -4.182 -5.836 . . . 1.0 . . . . . . . . . . . . A . 10 MET O . . . . . . . . . c25520_2n0c 1 . 17 . 2550 . 1 1 10 MET SD S 3.112 -5.386 -10.313 . . . 1.0 . . . . . . . . . . . . A . 10 MET SD . . . . . . . . . c25520_2n0c 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 c25520_2n0c _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 2n0c.mr . . 'MR format' 1 comment 'Not applicable' 'Not applicable' 0 c25520_2n0c 1 1 2n0c.mr . . DYANA/DIANA 2 distance NOE simple 73 c25520_2n0c 1 1 2n0c.mr . . 'MR format' 3 'nomenclature mapping' 'Not applicable' 'Not applicable' 0 c25520_2n0c 1 stop_ save_ save_DYANA/DIANA_distance_constraints_2 _Gen_dist_constraint_list.Sf_category general_distance_constraints _Gen_dist_constraint_list.Sf_framecode DYANA/DIANA_distance_constraints_2 _Gen_dist_constraint_list.Entry_ID c25520_2n0c _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 . . . . c25520_2n0c 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 6 6 VAL H H . . . 1 1 6 6 VAL HB H . . . . . . . 3.34 . . . . . A . 6 VAL H . . A . 6 VAL HB . . . 6 VAL H . . . . . 6 VAL HB . . c25520_2n0c 1 2 1 . . 1 1 6 6 VAL H H . . . 1 1 6 6 VAL MG1 H . . . . . . . 4.14 . . . . . A . 6 VAL H . . A . 6 VAL MG1 . . . 6 VAL H . . . . . 6 VAL QG1 . . c25520_2n0c 1 3 1 . . 1 1 5 5 ALA H H . . . 1 1 5 5 ALA MB H . . . . . . . 3.30 . . . . . A . 5 ALA H . . A . 5 ALA MB . . . 5 ALA H . . . . . 5 ALA QB . . c25520_2n0c 1 4 1 . . 1 1 8 8 HIS H H . . . 1 1 8 8 HIS HB2 H . . . . . . . 3.85 . . . . . A . 8 HIS H . . A . 8 HIS HB2 . . . 8 HIS H . . . . . 8 HIS HB2 . . c25520_2n0c 1 5 1 . . 1 1 8 8 HIS H H . . . 1 1 8 8 HIS HB3 H . . . . . . . 3.85 . . . . . A . 8 HIS H . . A . 8 HIS HB3 . . . 8 HIS H . . . . . 8 HIS HB3 . . c25520_2n0c 1 6 1 . . 1 1 9 9 LEU HA H . . . 1 1 10 10 MET H H . . . . . . . 3.53 . . . . . A . 9 LEU HA . . A . 10 MET H . . . 9 LEU HA . . . . . 10 MET H . . c25520_2n0c 1 7 1 . . 1 1 9 9 LEU H H . . . 1 1 9 9 LEU HB2 H . . . . . . . 3.90 . . . . . A . 9 LEU H . . A . 9 LEU HB2 . . . 9 LEU H . . . . . 9 LEU HB2 . . c25520_2n0c 1 8 1 . . 1 1 9 9 LEU H H . . . 1 1 9 9 LEU MD1 H . . . . . . . 5.50 . . . . . A . 9 LEU H . . A . 9 LEU MD1 . . . 9 LEU H . . . . . 9 LEU QD1 . . c25520_2n0c 1 9 1 . . 1 1 10 10 MET H H . . . 1 1 9 9 LEU MD1 H . . . . . . . 5.50 . . . . . A . 10 MET H . . A . 9 LEU MD1 . . . 10 MET H . . . . . 9 LEU QD1 . . c25520_2n0c 1 10 1 . . 1 1 9 9 LEU H H . . . 1 1 9 9 LEU HB3 H . . . . . . . 3.90 . . . . . A . 9 LEU H . . A . 9 LEU HB3 . . . 9 LEU H . . . . . 9 LEU HB3 . . c25520_2n0c 1 11 1 . . 1 1 4 4 TRP H H . . . 1 1 4 4 TRP HB2 H . . . . . . . 3.56 . . . . . A . 4 TRP H . . A . 4 TRP HB2 . . . 4 TRP H . . . . . 4 TRP HB2 . . c25520_2n0c 1 12 1 . . 1 1 4 4 TRP H H . . . 1 1 4 4 TRP HB3 H . . . . . . . 3.56 . . . . . A . 4 TRP H . . A . 4 TRP HB3 . . . 4 TRP H . . . . . 4 TRP HB3 . . c25520_2n0c 1 13 1 . . 1 1 6 6 VAL H H . . . 1 1 6 6 VAL MG2 H . . . . . . . 4.14 . . . . . A . 6 VAL H . . A . 6 VAL MG2 . . . 6 VAL H . . . . . 6 VAL QG2 . . c25520_2n0c 1 14 1 . . 1 1 9 9 LEU H H . . . 1 1 9 9 LEU MD2 H . . . . . . . 5.50 . . . . . A . 9 LEU H . . A . 9 LEU MD2 . . . 9 LEU H . . . . . 9 LEU QD2 . . c25520_2n0c 1 15 1 . . 1 1 10 10 MET H H . . . 1 1 9 9 LEU MD2 H . . . . . . . 5.50 . . . . . A . 10 MET H . . A . 9 LEU MD2 . . . 10 MET H . . . . . 9 LEU QD2 . . c25520_2n0c 1 16 1 . . 1 1 4 4 TRP H H . . . 1 1 4 4 TRP HD1 H . . . . . . . 4.32 . . . . . A . 4 TRP H . . A . 4 TRP HD1 . . . 4 TRP H . . . . . 4 TRP HD1 . . c25520_2n0c 1 17 1 . . 1 1 7 7 GLY H H . . . 1 1 6 6 VAL MG1 H . . . . . . . 4.35 . . . . . A . 7 GLY H . . A . 6 VAL MG1 . . . 7 GLY H . . . . . 6 VAL QG1 . . c25520_2n0c 1 18 1 . . 1 1 6 6 VAL H H . . . 1 1 5 5 ALA MB H . . . . . . . 3.86 . . . . . A . 6 VAL H . . A . 5 ALA MB . . . 6 VAL H . . . . . 5 ALA QB . . c25520_2n0c 1 19 1 . . 1 1 9 9 LEU H H . . . 1 1 8 8 HIS HA H . . . . . . . 3.07 . . . . . A . 9 LEU H . . A . 8 HIS HA . . . 9 LEU H . . . . . 8 HIS HA . . c25520_2n0c 1 20 1 OR . 1 1 8 8 HIS H H . . . 1 1 7 7 GLY HA2 H . . . . . . . 3.29 . . . . . A . 8 HIS H . . A . 7 GLY HA2 . . . 8 HIS H . . . . . 7 GLY QA . . c25520_2n0c 1 20 2 OR . 1 1 8 8 HIS H H . . . 1 1 7 7 GLY HA3 H . . . . . . . 3.29 . . . . . A . 8 HIS H . . A . 7 GLY HA3 . . . 8 HIS H . . . . . 7 GLY QA . . c25520_2n0c 1 21 1 . . 1 1 6 6 VAL H H . . . 1 1 5 5 ALA HA H . . . . . . . 2.82 . . . . . A . 6 VAL H . . A . 5 ALA HA . . . 6 VAL H . . . . . 5 ALA HA . . c25520_2n0c 1 22 1 . . 1 1 4 4 TRP H H . . . 1 1 3 3 HIS HA H . . . . . . . 2.95 . . . . . A . 4 TRP H . . A . 3 HIS HA . . . 4 TRP H . . . . . 3 HIS HA . . c25520_2n0c 1 23 1 . . 1 1 7 7 GLY H H . . . 1 1 6 6 VAL HA H . . . . . . . 2.80 . . . . . A . 7 GLY H . . A . 6 VAL HA . . . 7 GLY H . . . . . 6 VAL HA . . c25520_2n0c 1 24 1 OR . 1 1 3 3 HIS H H . . . 1 1 2 2 ASN HB2 H . . . . . . . 4.98 . . . . . A . 3 HIS H . . A . 2 ASN HB2 . . . 3 HIS H . . . . . 2 ASN QB . . c25520_2n0c 1 24 2 OR . 1 1 2 2 ASN HB3 H . . . 1 1 3 3 HIS H H . . . . . . . 4.98 . . . . . A . 2 ASN HB3 . . A . 3 HIS H . . . 2 ASN QB . . . . . 3 HIS H . . c25520_2n0c 1 25 1 . . 1 1 4 4 TRP H H . . . 1 1 3 3 HIS HB3 H . . . . . . . 4.66 . . . . . A . 4 TRP H . . A . 3 HIS HB3 . . . 4 TRP H . . . . . 3 HIS HB3 . . c25520_2n0c 1 26 1 . . 1 1 5 5 ALA H H . . . 1 1 4 4 TRP HB2 H . . . . . . . 3.99 . . . . . A . 5 ALA H . . A . 4 TRP HB2 . . . 5 ALA H . . . . . 4 TRP HB2 . . c25520_2n0c 1 27 1 . . 1 1 5 5 ALA H H . . . 1 1 4 4 TRP HB3 H . . . . . . . 3.99 . . . . . A . 5 ALA H . . A . 4 TRP HB3 . . . 5 ALA H . . . . . 4 TRP HB3 . . c25520_2n0c 1 28 1 . . 1 1 5 5 ALA MB H . . . 1 1 8 8 HIS HE1 H . . . . . . . 5.26 . . . . . A . 5 ALA MB . . A . 8 HIS HE1 . . . 5 ALA QB . . . . . 8 HIS HE1 . . c25520_2n0c 1 29 1 . . 1 1 5 5 ALA HA H . . . 1 1 8 8 HIS HE1 H . . . . . . . 5.07 . . . . . A . 5 ALA HA . . A . 8 HIS HE1 . . . 5 ALA HA . . . . . 8 HIS HE1 . . c25520_2n0c 1 30 1 . . 1 1 7 7 GLY H H . . . 1 1 8 8 HIS HA H . . . . . . . 5.50 . . . . . A . 7 GLY H . . A . 8 HIS HA . . . 7 GLY H . . . . . 8 HIS HA . . c25520_2n0c 1 31 1 . . 1 1 8 8 HIS HA H . . . 1 1 8 8 HIS HE1 H . . . . . . . 5.50 . . . . . A . 8 HIS HA . . A . 8 HIS HE1 . . . 8 HIS HA . . . . . 8 HIS HE1 . . c25520_2n0c 1 32 1 . . 1 1 9 9 LEU H H . . . 1 1 8 8 HIS HB2 H . . . . . . . 4.80 . . . . . A . 9 LEU H . . A . 8 HIS HB2 . . . 9 LEU H . . . . . 8 HIS HB2 . . c25520_2n0c 1 33 1 . . 1 1 9 9 LEU H H . . . 1 1 8 8 HIS HB3 H . . . . . . . 4.80 . . . . . A . 9 LEU H . . A . 8 HIS HB3 . . . 9 LEU H . . . . . 8 HIS HB3 . . c25520_2n0c 1 34 1 . . 1 1 4 4 TRP H H . . . 1 1 3 3 HIS H H . . . . . . . 4.11 . . . . . A . 4 TRP H . . A . 3 HIS H . . . 4 TRP H . . . . . 3 HIS H . . c25520_2n0c 1 35 1 . . 1 1 4 4 TRP H H . . . 1 1 4 4 TRP HE3 H . . . . . . . 4.95 . . . . . A . 4 TRP H . . A . 4 TRP HE3 . . . 4 TRP H . . . . . 4 TRP HE3 . . c25520_2n0c 1 36 1 . . 1 1 5 5 ALA H H . . . 1 1 4 4 TRP HD1 H . . . . . . . 5.38 . . . . . A . 5 ALA H . . A . 4 TRP HD1 . . . 5 ALA H . . . . . 4 TRP HD1 . . c25520_2n0c 1 37 1 . . 1 1 6 6 VAL H H . . . 1 1 5 5 ALA H H . . . . . . . 4.10 . . . . . A . 6 VAL H . . A . 5 ALA H . . . 6 VAL H . . . . . 5 ALA H . . c25520_2n0c 1 38 1 . . 1 1 5 5 ALA H H . . . 1 1 4 4 TRP H H . . . . . . . 3.47 . . . . . A . 5 ALA H . . A . 4 TRP H . . . 5 ALA H . . . . . 4 TRP H . . c25520_2n0c 1 39 1 . . 1 1 6 6 VAL H H . . . 1 1 7 7 GLY H H . . . . . . . 4.53 . . . . . A . 6 VAL H . . A . 7 GLY H . . . 6 VAL H . . . . . 7 GLY H . . c25520_2n0c 1 40 1 . . 1 1 8 8 HIS H H . . . 1 1 7 7 GLY H H . . . . . . . 3.63 . . . . . A . 8 HIS H . . A . 7 GLY H . . . 8 HIS H . . . . . 7 GLY H . . c25520_2n0c 1 41 1 . . 1 1 8 8 HIS H H . . . 1 1 8 8 HIS HD2 H . . . . . . . 5.14 . . . . . A . 8 HIS H . . A . 8 HIS HD2 . . . 8 HIS H . . . . . 8 HIS HD2 . . c25520_2n0c 1 42 1 . . 1 1 8 8 HIS H H . . . 1 1 9 9 LEU H H . . . . . . . 3.36 . . . . . A . 8 HIS H . . A . 9 LEU H . . . 8 HIS H . . . . . 9 LEU H . . c25520_2n0c 1 43 1 . . 1 1 5 5 ALA H H . . . 1 1 4 4 TRP HE3 H . . . . . . . 4.75 . . . . . A . 5 ALA H . . A . 4 TRP HE3 . . . 5 ALA H . . . . . 4 TRP HE3 . . c25520_2n0c 1 44 1 . . 1 1 4 4 TRP HE3 H . . . 1 1 4 4 TRP HA H . . . . . . . 3.89 . . . . . A . 4 TRP HE3 . . A . 4 TRP HA . . . 4 TRP HE3 . . . . . 4 TRP HA . . c25520_2n0c 1 45 1 . . 1 1 5 5 ALA HA H . . . 1 1 4 4 TRP HE3 H . . . . . . . 5.04 . . . . . A . 5 ALA HA . . A . 4 TRP HE3 . . . 5 ALA HA . . . . . 4 TRP HE3 . . c25520_2n0c 1 46 1 . . 1 1 6 6 VAL HA H . . . 1 1 6 6 VAL MG1 H . . . . . . . 3.73 . . . . . A . 6 VAL HA . . A . 6 VAL MG1 . . . 6 VAL HA . . . . . 6 VAL QG1 . . c25520_2n0c 1 47 1 . . 1 1 6 6 VAL HA H . . . 1 1 6 6 VAL MG2 H . . . . . . . 3.73 . . . . . A . 6 VAL HA . . A . 6 VAL MG2 . . . 6 VAL HA . . . . . 6 VAL QG2 . . c25520_2n0c 1 48 1 . . 1 1 7 7 GLY H H . . . 1 1 6 6 VAL MG2 H . . . . . . . 4.35 . . . . . A . 7 GLY H . . A . 6 VAL MG2 . . . 7 GLY H . . . . . 6 VAL QG2 . . c25520_2n0c 1 49 1 . . 1 1 4 4 TRP H H . . . 1 1 3 3 HIS HB2 H . . . . . . . 4.66 . . . . . A . 4 TRP H . . A . 3 HIS HB2 . . . 4 TRP H . . . . . 3 HIS HB2 . . c25520_2n0c 1 50 1 . . 1 1 6 6 VAL HB H . . . 1 1 7 7 GLY H H . . . . . . . 4.25 . . . . . A . 6 VAL HB . . A . 7 GLY H . . . 6 VAL HB . . . . . 7 GLY H . . c25520_2n0c 1 51 1 . . 1 1 4 4 TRP HD1 H . . . 1 1 4 4 TRP HB2 H . . . . . . . 3.77 . . . . . A . 4 TRP HD1 . . A . 4 TRP HB2 . . . 4 TRP HD1 . . . . . 4 TRP HB2 . . c25520_2n0c 1 52 1 . . 1 1 4 4 TRP HD1 H . . . 1 1 4 4 TRP HB3 H . . . . . . . 3.77 . . . . . A . 4 TRP HD1 . . A . 4 TRP HB3 . . . 4 TRP HD1 . . . . . 4 TRP HB3 . . c25520_2n0c 1 53 1 . . 1 1 5 5 ALA MB H . . . 1 1 4 4 TRP HA H . . . . . . . 4.67 . . . . . A . 5 ALA MB . . A . 4 TRP HA . . . 5 ALA QB . . . . . 4 TRP HA . . c25520_2n0c 1 54 1 . . 1 1 6 6 VAL HB H . . . 1 1 5 5 ALA HA H . . . . . . . 5.07 . . . . . A . 6 VAL HB . . A . 5 ALA HA . . . 6 VAL HB . . . . . 5 ALA HA . . c25520_2n0c 1 55 1 . . 1 1 5 5 ALA HA H . . . 1 1 4 4 TRP HA H . . . . . . . 4.70 . . . . . A . 5 ALA HA . . A . 4 TRP HA . . . 5 ALA HA . . . . . 4 TRP HA . . c25520_2n0c 1 56 1 . . 1 1 4 4 TRP HD1 H . . . 1 1 4 4 TRP HA H . . . . . . . 4.46 . . . . . A . 4 TRP HD1 . . A . 4 TRP HA . . . 4 TRP HD1 . . . . . 4 TRP HA . . c25520_2n0c 1 57 1 . . 1 1 6 6 VAL HB H . . . 1 1 5 5 ALA MB H . . . . . . . 5.40 . . . . . A . 6 VAL HB . . A . 5 ALA MB . . . 6 VAL HB . . . . . 5 ALA QB . . c25520_2n0c 1 58 1 . . 1 1 5 5 ALA MB H . . . 1 1 6 6 VAL MG1 H . . . . . . . 5.38 . . . . . A . 5 ALA MB . . A . 6 VAL MG1 . . . 5 ALA QB . . . . . 6 VAL QG1 . . c25520_2n0c 1 59 1 . . 1 1 5 5 ALA MB H . . . 1 1 6 6 VAL MG2 H . . . . . . . 5.38 . . . . . A . 5 ALA MB . . A . 6 VAL MG2 . . . 5 ALA QB . . . . . 6 VAL QG2 . . c25520_2n0c 1 60 1 . . 1 1 5 5 ALA HA H . . . 1 1 6 6 VAL HA H . . . . . . . 4.60 . . . . . A . 5 ALA HA . . A . 6 VAL HA . . . 5 ALA HA . . . . . 6 VAL HA . . c25520_2n0c 1 61 1 . . 1 1 5 5 ALA MB H . . . 1 1 6 6 VAL HA H . . . . . . . 5.24 . . . . . A . 5 ALA MB . . A . 6 VAL HA . . . 5 ALA QB . . . . . 6 VAL HA . . c25520_2n0c 1 62 1 OR . 1 1 4 4 TRP H H . . . 1 1 4 4 TRP HB3 H . . . . . . . 3.05 . . . . . A . 4 TRP H . . A . 4 TRP HB3 . . . 4 TRP H . . . . . 4 TRP QB . . c25520_2n0c 1 62 2 OR . 1 1 4 4 TRP H H . . . 1 1 4 4 TRP HB2 H . . . . . . . 3.05 . . . . . A . 4 TRP H . . A . 4 TRP HB2 . . . 4 TRP H . . . . . 4 TRP QB . . c25520_2n0c 1 63 1 OR . 1 1 4 4 TRP HD1 H . . . 1 1 4 4 TRP HB3 H . . . . . . . 3.28 . . . . . A . 4 TRP HD1 . . A . 4 TRP HB3 . . . 4 TRP HD1 . . . . . 4 TRP QB . . c25520_2n0c 1 63 2 OR . 1 1 4 4 TRP HD1 H . . . 1 1 4 4 TRP HB2 H . . . . . . . 3.28 . . . . . A . 4 TRP HD1 . . A . 4 TRP HB2 . . . 4 TRP HD1 . . . . . 4 TRP QB . . c25520_2n0c 1 64 1 OR . 1 1 4 4 TRP HE3 H . . . 1 1 4 4 TRP HB3 H . . . . . . . 3.58 . . . . . A . 4 TRP HE3 . . A . 4 TRP HB3 . . . 4 TRP HE3 . . . . . 4 TRP QB . . c25520_2n0c 1 64 2 OR . 1 1 4 4 TRP HE3 H . . . 1 1 4 4 TRP HB2 H . . . . . . . 3.58 . . . . . A . 4 TRP HE3 . . A . 4 TRP HB2 . . . 4 TRP HE3 . . . . . 4 TRP QB . . c25520_2n0c 1 65 1 OR . 1 1 5 5 ALA H H . . . 1 1 4 4 TRP HB3 H . . . . . . . 3.49 . . . . . A . 5 ALA H . . A . 4 TRP HB3 . . . 5 ALA H . . . . . 4 TRP QB . . c25520_2n0c 1 65 2 OR . 1 1 5 5 ALA H H . . . 1 1 4 4 TRP HB2 H . . . . . . . 3.49 . . . . . A . 5 ALA H . . A . 4 TRP HB2 . . . 5 ALA H . . . . . 4 TRP QB . . c25520_2n0c 1 66 1 OR . 1 1 5 5 ALA HA H . . . 1 1 6 6 VAL MG1 H . . . . . . . 5.44 . . . . . A . 5 ALA HA . . A . 6 VAL MG1 . . . 5 ALA HA . . . . . 6 VAL QQG . . c25520_2n0c 1 66 2 OR . 1 1 5 5 ALA HA H . . . 1 1 6 6 VAL MG2 H . . . . . . . 5.44 . . . . . A . 5 ALA HA . . A . 6 VAL MG2 . . . 5 ALA HA . . . . . 6 VAL QQG . . c25520_2n0c 1 67 1 OR . 1 1 5 5 ALA MB H . . . 1 1 6 6 VAL MG1 H . . . . . . . 4.53 . . . . . A . 5 ALA MB . . A . 6 VAL MG1 . . . 5 ALA QB . . . . . 6 VAL QQG . . c25520_2n0c 1 67 2 OR . 1 1 5 5 ALA MB H . . . 1 1 6 6 VAL MG2 H . . . . . . . 4.53 . . . . . A . 5 ALA MB . . A . 6 VAL MG2 . . . 5 ALA QB . . . . . 6 VAL QQG . . c25520_2n0c 1 68 1 OR . 1 1 6 6 VAL H H . . . 1 1 6 6 VAL MG1 H . . . . . . . 3.40 . . . . . A . 6 VAL H . . A . 6 VAL MG1 . . . 6 VAL H . . . . . 6 VAL QQG . . c25520_2n0c 1 68 2 OR . 1 1 6 6 VAL H H . . . 1 1 6 6 VAL MG2 H . . . . . . . 3.40 . . . . . A . 6 VAL H . . A . 6 VAL MG2 . . . 6 VAL H . . . . . 6 VAL QQG . . c25520_2n0c 1 69 1 OR . 1 1 7 7 GLY H H . . . 1 1 6 6 VAL MG1 H . . . . . . . 3.81 . . . . . A . 7 GLY H . . A . 6 VAL MG1 . . . 7 GLY H . . . . . 6 VAL QQG . . c25520_2n0c 1 69 2 OR . 1 1 7 7 GLY H H . . . 1 1 6 6 VAL MG2 H . . . . . . . 3.81 . . . . . A . 7 GLY H . . A . 6 VAL MG2 . . . 7 GLY H . . . . . 6 VAL QQG . . c25520_2n0c 1 70 1 OR . 1 1 8 8 HIS H H . . . 1 1 8 8 HIS HB3 H . . . . . . . 3.38 . . . . . A . 8 HIS H . . A . 8 HIS HB3 . . . 8 HIS H . . . . . 8 HIS QB . . c25520_2n0c 1 70 2 OR . 1 1 8 8 HIS H H . . . 1 1 8 8 HIS HB2 H . . . . . . . 3.38 . . . . . A . 8 HIS H . . A . 8 HIS HB2 . . . 8 HIS H . . . . . 8 HIS QB . . c25520_2n0c 1 71 1 OR . 1 1 9 9 LEU H H . . . 1 1 8 8 HIS HB3 H . . . . . . . 4.13 . . . . . A . 9 LEU H . . A . 8 HIS HB3 . . . 9 LEU H . . . . . 8 HIS QB . . c25520_2n0c 1 71 2 OR . 1 1 9 9 LEU H H . . . 1 1 8 8 HIS HB2 H . . . . . . . 4.13 . . . . . A . 9 LEU H . . A . 8 HIS HB2 . . . 9 LEU H . . . . . 8 HIS QB . . c25520_2n0c 1 72 1 OR . 1 1 9 9 LEU H H . . . 1 1 9 9 LEU HB2 H . . . . . . . 3.34 . . . . . A . 9 LEU H . . A . 9 LEU HB2 . . . 9 LEU H . . . . . 9 LEU QB . . c25520_2n0c 1 72 2 OR . 1 1 9 9 LEU H H . . . 1 1 9 9 LEU HB3 H . . . . . . . 3.34 . . . . . A . 9 LEU H . . A . 9 LEU HB3 . . . 9 LEU H . . . . . 9 LEU QB . . c25520_2n0c 1 73 1 OR . 1 1 10 10 MET H H . . . 1 1 9 9 LEU HB2 H . . . . . . . 4.14 . . . . . A . 10 MET H . . A . 9 LEU HB2 . . . 10 MET H . . . . . 9 LEU QB . . c25520_2n0c 1 73 2 OR . 1 1 10 10 MET H H . . . 1 1 9 9 LEU HB3 H . . . . . . . 4.14 . . . . . A . 10 MET H . . A . 9 LEU HB3 . . . 10 MET H . . . . . 9 LEU QB . . c25520_2n0c 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 c25520_2n0c _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 05-MAR-15 2N0C *TITLE NMR STRUCTURE OF NEUROMEDIN C IN 10% TFE *COMPND MOL_ID: 1; *COMPND 2 MOLECULE: GASTRIN-RELEASING PEPTIDE; *COMPND 3 CHAIN: A; *COMPND 4 FRAGMENT: UNP RESIDUES 41-50; *COMPND 5 SYNONYM: GRP, NEUROMEDIN-C, GRP-10; *COMPND 6 ENGINEERED: YES *SOURCE MOL_ID: 1; *SOURCE 2 SYNTHETIC: YES; *SOURCE 3 ORGANISM_SCIENTIFIC: HOMO SAPIENS; *SOURCE 4 ORGANISM_COMMON: HUMAN; *SOURCE 5 ORGANISM_TAXID: 9606 *KEYWDS NEUROPEPTIDE, FEEDING REGULATION, HORMONE *EXPDTA SOLUTION NMR *NUMMDL 17 *AUTHOR M.ADROVER, P.SANCHIS, B.VILANOVA, K.PAUWELS, G.MARTORELL, J.PEREZ *REVDAT 1 21-OCT-15 2N0C 0' save_