data_10106 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 10106 _Entry.Title ; Solution structure of the SWIB/MDM2 domain of the hypothetical protein At5g08430 from Arabidopsis thaliana ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2007-02-13 _Entry.Accession_date 2007-02-13 _Entry.Last_release_date 2008-08-15 _Entry.Original_release_date 2008-08-15 _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version . _Entry.Experimental_method NMR _Entry.Experimental_method_subtype . _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.Entry_ID 1 M. Yoneyama . . . 10106 2 N. Tochio . . . 10106 3 S. Koshiba . . . 10106 4 M. Inoue . . . 10106 5 T. Kigawa . . . 10106 6 S. Yokoyama . . . 10106 stop_ loop_ _Entry_src.ID _Entry_src.Project_name _Entry_src.Organization_full_name _Entry_src.Organization_initials _Entry_src.Entry_ID 1 . 'Protein Research Group, RIKEN Genomic Sciences Center' . 10106 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 10106 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 446 10106 '15N chemical shifts' 99 10106 '1H chemical shifts' 695 10106 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 . . 2008-08-15 2007-02-13 original author . 10106 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 1V32 'BMRB Entry Tracking System' 10106 stop_ save_ ############### # Citations # ############### save_citation_1 _Citation.Sf_category citations _Citation.Sf_framecode citation_1 _Citation.Entry_ID 10106 _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 ; Solution structure of the SWIB/MDM2 domain of the hypothetical protein At5g08430 from Arabidopsis thaliana ; _Citation.Status 'in preparation' _Citation.Type journal _Citation.Journal_abbrev . _Citation.Journal_name_full . _Citation.Journal_volume . _Citation.Journal_issue . _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first . _Citation.Page_last . _Citation.Year . _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 M. Yoneyama . . . 10106 1 2 N. Tochio . . . 10106 1 3 S. Koshiba . . . 10106 1 4 M. Inoue . . . 10106 1 5 T. Kigawa . . . 10106 1 6 S. Yokoyama . . . 10106 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 10106 _Assembly.ID 1 _Assembly.Name 'hypothetical protein RAFL09-47-K03' _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands 0 _Assembly.Metal_ions 0 _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states no _Assembly.Ambiguous_chem_comp_sites no _Assembly.Molecules_in_chemical_exchange no _Assembly.Paramagnetic no _Assembly.Thiol_state 'all free' _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Assembly_type.Type _Assembly_type.Entry_ID _Assembly_type.Assembly_ID 'protein monomer' 10106 1 stop_ 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 'hypothetical protein RAFL09-47-K03' 1 $entity_1 . . yes native no no . . . 10106 1 stop_ loop_ _Assembly_db_link.Author_supplied _Assembly_db_link.Database_code _Assembly_db_link.Accession_code _Assembly_db_link.Entry_mol_code _Assembly_db_link.Entry_mol_name _Assembly_db_link.Entry_experimental_method _Assembly_db_link.Entry_structure_resolution _Assembly_db_link.Entry_relation_type _Assembly_db_link.Entry_details _Assembly_db_link.Entry_ID _Assembly_db_link.Assembly_ID . PDB 1V32 . . . . . . 10106 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 10106 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name 'SWIB/MDM2 domain' _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; GSSGSSGKRFEFVGWGSRQL IEFLHSLGKDTSEMISRYDV SDTIAKYISKEGLLDPSNKK KVVCDKRLVLLFGTRTIFRM KVYDLLEKHYKENQDSGPSS G ; _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 101 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-11-26 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 no PDB 1V32 . "Solution Structure Of The SwibMDM2 DOMAIN OF THE Hypothetical Protein At5g08430 From Arabidopsis Thaliana" . . . . . 100.00 101 100.00 100.00 1.76e-65 . . . . 10106 1 2 no EMBL CAC08343 . "putative protein [Arabidopsis thaliana]" . . . . . 87.13 509 100.00 100.00 8.04e-53 . . . . 10106 1 3 no GB ACF06124 . "At5g08430 [Arabidopsis thaliana]" . . . . . 87.13 553 100.00 100.00 1.65e-52 . . . . 10106 1 4 no GB AED91300 . "SWIB/MDM2 and Plus-3 and GYF domain-containing protein [Arabidopsis thaliana]" . . . . . 87.13 553 100.00 100.00 1.65e-52 . . . . 10106 1 5 no REF NP_196460 . "SWIB/MDM2 and Plus-3 and GYF domain-containing protein [Arabidopsis thaliana]" . . . . . 87.13 553 100.00 100.00 1.65e-52 . . . . 10106 1 6 no SP Q9FT92 . "RecName: Full=Uncharacterized protein At5g08430" . . . . . 87.13 553 100.00 100.00 1.65e-52 . . . . 10106 1 stop_ loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID 'SWIB/MDM2 domain' . 10106 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 . GLY . 10106 1 2 . SER . 10106 1 3 . SER . 10106 1 4 . GLY . 10106 1 5 . SER . 10106 1 6 . SER . 10106 1 7 . GLY . 10106 1 8 . LYS . 10106 1 9 . ARG . 10106 1 10 . PHE . 10106 1 11 . GLU . 10106 1 12 . PHE . 10106 1 13 . VAL . 10106 1 14 . GLY . 10106 1 15 . TRP . 10106 1 16 . GLY . 10106 1 17 . SER . 10106 1 18 . ARG . 10106 1 19 . GLN . 10106 1 20 . LEU . 10106 1 21 . ILE . 10106 1 22 . GLU . 10106 1 23 . PHE . 10106 1 24 . LEU . 10106 1 25 . HIS . 10106 1 26 . SER . 10106 1 27 . LEU . 10106 1 28 . GLY . 10106 1 29 . LYS . 10106 1 30 . ASP . 10106 1 31 . THR . 10106 1 32 . SER . 10106 1 33 . GLU . 10106 1 34 . MET . 10106 1 35 . ILE . 10106 1 36 . SER . 10106 1 37 . ARG . 10106 1 38 . TYR . 10106 1 39 . ASP . 10106 1 40 . VAL . 10106 1 41 . SER . 10106 1 42 . ASP . 10106 1 43 . THR . 10106 1 44 . ILE . 10106 1 45 . ALA . 10106 1 46 . LYS . 10106 1 47 . TYR . 10106 1 48 . ILE . 10106 1 49 . SER . 10106 1 50 . LYS . 10106 1 51 . GLU . 10106 1 52 . GLY . 10106 1 53 . LEU . 10106 1 54 . LEU . 10106 1 55 . ASP . 10106 1 56 . PRO . 10106 1 57 . SER . 10106 1 58 . ASN . 10106 1 59 . LYS . 10106 1 60 . LYS . 10106 1 61 . LYS . 10106 1 62 . VAL . 10106 1 63 . VAL . 10106 1 64 . CYS . 10106 1 65 . ASP . 10106 1 66 . LYS . 10106 1 67 . ARG . 10106 1 68 . LEU . 10106 1 69 . VAL . 10106 1 70 . LEU . 10106 1 71 . LEU . 10106 1 72 . PHE . 10106 1 73 . GLY . 10106 1 74 . THR . 10106 1 75 . ARG . 10106 1 76 . THR . 10106 1 77 . ILE . 10106 1 78 . PHE . 10106 1 79 . ARG . 10106 1 80 . MET . 10106 1 81 . LYS . 10106 1 82 . VAL . 10106 1 83 . TYR . 10106 1 84 . ASP . 10106 1 85 . LEU . 10106 1 86 . LEU . 10106 1 87 . GLU . 10106 1 88 . LYS . 10106 1 89 . HIS . 10106 1 90 . TYR . 10106 1 91 . LYS . 10106 1 92 . GLU . 10106 1 93 . ASN . 10106 1 94 . GLN . 10106 1 95 . ASP . 10106 1 96 . SER . 10106 1 97 . GLY . 10106 1 98 . PRO . 10106 1 99 . SER . 10106 1 100 . SER . 10106 1 101 . GLY . 10106 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 10106 1 . SER 2 2 10106 1 . SER 3 3 10106 1 . GLY 4 4 10106 1 . SER 5 5 10106 1 . SER 6 6 10106 1 . GLY 7 7 10106 1 . LYS 8 8 10106 1 . ARG 9 9 10106 1 . PHE 10 10 10106 1 . GLU 11 11 10106 1 . PHE 12 12 10106 1 . VAL 13 13 10106 1 . GLY 14 14 10106 1 . TRP 15 15 10106 1 . GLY 16 16 10106 1 . SER 17 17 10106 1 . ARG 18 18 10106 1 . GLN 19 19 10106 1 . LEU 20 20 10106 1 . ILE 21 21 10106 1 . GLU 22 22 10106 1 . PHE 23 23 10106 1 . LEU 24 24 10106 1 . HIS 25 25 10106 1 . SER 26 26 10106 1 . LEU 27 27 10106 1 . GLY 28 28 10106 1 . LYS 29 29 10106 1 . ASP 30 30 10106 1 . THR 31 31 10106 1 . SER 32 32 10106 1 . GLU 33 33 10106 1 . MET 34 34 10106 1 . ILE 35 35 10106 1 . SER 36 36 10106 1 . ARG 37 37 10106 1 . TYR 38 38 10106 1 . ASP 39 39 10106 1 . VAL 40 40 10106 1 . SER 41 41 10106 1 . ASP 42 42 10106 1 . THR 43 43 10106 1 . ILE 44 44 10106 1 . ALA 45 45 10106 1 . LYS 46 46 10106 1 . TYR 47 47 10106 1 . ILE 48 48 10106 1 . SER 49 49 10106 1 . LYS 50 50 10106 1 . GLU 51 51 10106 1 . GLY 52 52 10106 1 . LEU 53 53 10106 1 . LEU 54 54 10106 1 . ASP 55 55 10106 1 . PRO 56 56 10106 1 . SER 57 57 10106 1 . ASN 58 58 10106 1 . LYS 59 59 10106 1 . LYS 60 60 10106 1 . LYS 61 61 10106 1 . VAL 62 62 10106 1 . VAL 63 63 10106 1 . CYS 64 64 10106 1 . ASP 65 65 10106 1 . LYS 66 66 10106 1 . ARG 67 67 10106 1 . LEU 68 68 10106 1 . VAL 69 69 10106 1 . LEU 70 70 10106 1 . LEU 71 71 10106 1 . PHE 72 72 10106 1 . GLY 73 73 10106 1 . THR 74 74 10106 1 . ARG 75 75 10106 1 . THR 76 76 10106 1 . ILE 77 77 10106 1 . PHE 78 78 10106 1 . ARG 79 79 10106 1 . MET 80 80 10106 1 . LYS 81 81 10106 1 . VAL 82 82 10106 1 . TYR 83 83 10106 1 . ASP 84 84 10106 1 . LEU 85 85 10106 1 . LEU 86 86 10106 1 . GLU 87 87 10106 1 . LYS 88 88 10106 1 . HIS 89 89 10106 1 . TYR 90 90 10106 1 . LYS 91 91 10106 1 . GLU 92 92 10106 1 . ASN 93 93 10106 1 . GLN 94 94 10106 1 . ASP 95 95 10106 1 . SER 96 96 10106 1 . GLY 97 97 10106 1 . PRO 98 98 10106 1 . SER 99 99 10106 1 . SER 100 100 10106 1 . GLY 101 101 10106 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 10106 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Subvariant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Cellular_location _Entity_natural_src.Fragment _Entity_natural_src.Fraction _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Plasmid_details _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Dev_stage _Entity_natural_src.Details _Entity_natural_src.Citation_ID _Entity_natural_src.Citation_label _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $entity_1 . 3702 . . . 'thale cress' . . Eukaryota Viridiplantae Arabidopsis thaliana . . . . . . . . . . . . . . . . . . . . . 10106 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 10106 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_subvariant _Entity_experimental_src.Host_org_organ _Entity_experimental_src.Host_org_tissue _Entity_experimental_src.Host_org_tissue_fraction _Entity_experimental_src.Host_org_cell_line _Entity_experimental_src.Host_org_cell_type _Entity_experimental_src.Host_org_cellular_location _Entity_experimental_src.Host_org_organelle _Entity_experimental_src.Host_org_gene _Entity_experimental_src.Host_org_culture_collection _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Host_org_dev_stage _Entity_experimental_src.Details _Entity_experimental_src.Citation_ID _Entity_experimental_src.Citation_label _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $entity_1 . 'cell free synthesis' . . . . . . . . . . . . . . . . . . . plasmid . . P030128-16 . . . . . . 10106 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 10106 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system . _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 'SWIB/MDM2 domain' '[U-13C; U-15N]' . . 1 $entity_1 . . 0.4 . . mM . . . . 10106 1 2 phosphate . . . . . . buffer 20 . . mM . . . . 10106 1 3 NaCl . . . . . . salt 100 . . mM . . . . 10106 1 4 d-DTT . . . . . . salt 1 . . mM . . . . 10106 1 5 NaN3 . . . . . . . 0.02 . . % . . . . 10106 1 6 H2O . . . . . . solvent 90 . . % . . . . 10106 1 7 D2O . . . . . . solvent 10 . . % . . . . 10106 1 stop_ save_ ####################### # Sample conditions # ####################### save_condition_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode condition_1 _Sample_condition_list.Entry_ID 10106 _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' 120 0.1 mM 10106 1 pH 6.0 0.05 pH 10106 1 pressure 1 0.001 atm 10106 1 temperature 298 0.1 K 10106 1 stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID 10106 _Software.ID 1 _Software.Name xwinnmr _Software.Version 2.6 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Bruker . . 10106 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection 10106 1 stop_ save_ save_software_2 _Software.Sf_category software _Software.Sf_framecode software_2 _Software.Entry_ID 10106 _Software.ID 2 _Software.Name NMRPipe _Software.Version 20020425 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, F.' . . 10106 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 10106 2 stop_ save_ save_software_3 _Software.Sf_category software _Software.Sf_framecode software_3 _Software.Entry_ID 10106 _Software.ID 3 _Software.Name NMRView _Software.Version 5.0.4 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Jhonson, B.A.' . . 10106 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 10106 3 stop_ save_ save_software_4 _Software.Sf_category software _Software.Sf_framecode software_4 _Software.Entry_ID 10106 _Software.ID 4 _Software.Name Kujira _Software.Version 0.815 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Kobayashi, N.' . . 10106 4 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 10106 4 stop_ save_ save_software_5 _Software.Sf_category software _Software.Sf_framecode software_5 _Software.Entry_ID 10106 _Software.ID 5 _Software.Name CYANA _Software.Version 1.0.7 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Guntert, P.' . . 10106 5 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID refinement 10106 5 'structure solution' 10106 5 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 10106 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model AVANCE _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ ############################# # NMR applied experiments # ############################# save_NMR_experiment_list _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode NMR_experiment_list _Experiment_list.Entry_ID 10106 _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 '3D 15N-separated NOESY' no . . . . . . . . . . 1 $sample_1 . . . 1 $condition_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 10106 1 2 '3D 13C-separated NOESY' no . . . . . . . . . . 1 $sample_1 . . . 1 $condition_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 10106 1 stop_ save_ save_3D_15N-separated_NOESY _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode 3D_15N-separated_NOESY _NMR_spec_expt.Entry_ID 10106 _NMR_spec_expt.ID 1 _NMR_spec_expt.Name '3D 15N-separated NOESY' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID 1 _NMR_spec_expt.NMR_spectrometer_label $spectrometer_1 _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_3D_13C-separated_NOESY _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode 3D_13C-separated_NOESY _NMR_spec_expt.Entry_ID 10106 _NMR_spec_expt.ID 2 _NMR_spec_expt.Name '3D 13C-separated NOESY' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID 1 _NMR_spec_expt.NMR_spectrometer_label $spectrometer_1 _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode reference_1 _Chem_shift_reference.Entry_ID 10106 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details ; Chemical shift reference of 1H was based on the proton of water (4.784ppm at 298K) and then those of 15N and 13C were calculated based on their gyromagnetic ratios. ; loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.0 . indirect 0.251449530 . . . . . . . . . 10106 1 H 1 DSS 'methyl protons' . . . . ppm 0.0 . indirect 1.0 . . . . . . . . . 10106 1 N 15 DSS 'methyl protons' . . . . ppm 0.0 . indirect 0.101329118 . . . . . . . . . 10106 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_chemical_shift_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode chemical_shift_1 _Assigned_chem_shift_list.Entry_ID 10106 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $condition_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $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 '3D 15N-separated NOESY' 1 $sample_1 isotropic 10106 1 2 '3D 13C-separated NOESY' 1 $sample_1 isotropic 10106 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 3 3 SER HA H 1 4.531 0.030 . 1 . . . . 3 SER HA . 10106 1 2 . 1 1 3 3 SER HB2 H 1 3.908 0.030 . 1 . . . . 3 SER HB2 . 10106 1 3 . 1 1 3 3 SER HB3 H 1 3.908 0.030 . 1 . . . . 3 SER HB3 . 10106 1 4 . 1 1 3 3 SER C C 13 175.159 0.300 . 1 . . . . 3 SER C . 10106 1 5 . 1 1 3 3 SER CA C 13 58.676 0.300 . 1 . . . . 3 SER CA . 10106 1 6 . 1 1 3 3 SER CB C 13 63.899 0.300 . 1 . . . . 3 SER CB . 10106 1 7 . 1 1 4 4 GLY H H 1 8.497 0.030 . 1 . . . . 4 GLY H . 10106 1 8 . 1 1 4 4 GLY HA2 H 1 4.043 0.030 . 1 . . . . 4 GLY HA2 . 10106 1 9 . 1 1 4 4 GLY HA3 H 1 4.043 0.030 . 1 . . . . 4 GLY HA3 . 10106 1 10 . 1 1 4 4 GLY C C 13 174.423 0.300 . 1 . . . . 4 GLY C . 10106 1 11 . 1 1 4 4 GLY CA C 13 45.491 0.300 . 1 . . . . 4 GLY CA . 10106 1 12 . 1 1 4 4 GLY N N 15 110.991 0.300 . 1 . . . . 4 GLY N . 10106 1 13 . 1 1 5 5 SER H H 1 8.311 0.030 . 1 . . . . 5 SER H . 10106 1 14 . 1 1 5 5 SER HA H 1 4.505 0.030 . 1 . . . . 5 SER HA . 10106 1 15 . 1 1 5 5 SER HB2 H 1 3.908 0.030 . 1 . . . . 5 SER HB2 . 10106 1 16 . 1 1 5 5 SER HB3 H 1 3.908 0.030 . 1 . . . . 5 SER HB3 . 10106 1 17 . 1 1 5 5 SER C C 13 174.970 0.300 . 1 . . . . 5 SER C . 10106 1 18 . 1 1 5 5 SER CA C 13 58.411 0.300 . 1 . . . . 5 SER CA . 10106 1 19 . 1 1 5 5 SER CB C 13 64.097 0.300 . 1 . . . . 5 SER CB . 10106 1 20 . 1 1 5 5 SER N N 15 115.791 0.300 . 1 . . . . 5 SER N . 10106 1 21 . 1 1 6 6 SER H H 1 8.448 0.030 . 1 . . . . 6 SER H . 10106 1 22 . 1 1 6 6 SER HA H 1 4.490 0.030 . 1 . . . . 6 SER HA . 10106 1 23 . 1 1 6 6 SER HB2 H 1 3.920 0.030 . 1 . . . . 6 SER HB2 . 10106 1 24 . 1 1 6 6 SER HB3 H 1 3.920 0.030 . 1 . . . . 6 SER HB3 . 10106 1 25 . 1 1 6 6 SER C C 13 175.069 0.300 . 1 . . . . 6 SER C . 10106 1 26 . 1 1 6 6 SER CA C 13 58.800 0.300 . 1 . . . . 6 SER CA . 10106 1 27 . 1 1 6 6 SER CB C 13 63.869 0.300 . 1 . . . . 6 SER CB . 10106 1 28 . 1 1 6 6 SER N N 15 117.891 0.300 . 1 . . . . 6 SER N . 10106 1 29 . 1 1 7 7 GLY H H 1 8.394 0.030 . 1 . . . . 7 GLY H . 10106 1 30 . 1 1 7 7 GLY HA2 H 1 3.961 0.030 . 1 . . . . 7 GLY HA2 . 10106 1 31 . 1 1 7 7 GLY HA3 H 1 3.961 0.030 . 1 . . . . 7 GLY HA3 . 10106 1 32 . 1 1 7 7 GLY C C 13 173.915 0.300 . 1 . . . . 7 GLY C . 10106 1 33 . 1 1 7 7 GLY CA C 13 45.324 0.300 . 1 . . . . 7 GLY CA . 10106 1 34 . 1 1 7 7 GLY N N 15 110.691 0.300 . 1 . . . . 7 GLY N . 10106 1 35 . 1 1 8 8 LYS H H 1 8.094 0.030 . 1 . . . . 8 LYS H . 10106 1 36 . 1 1 8 8 LYS HA H 1 4.285 0.030 . 1 . . . . 8 LYS HA . 10106 1 37 . 1 1 8 8 LYS HB2 H 1 1.694 0.030 . 2 . . . . 8 LYS HB2 . 10106 1 38 . 1 1 8 8 LYS HB3 H 1 1.761 0.030 . 2 . . . . 8 LYS HB3 . 10106 1 39 . 1 1 8 8 LYS HG2 H 1 1.351 0.030 . 2 . . . . 8 LYS HG2 . 10106 1 40 . 1 1 8 8 LYS HG3 H 1 1.392 0.030 . 2 . . . . 8 LYS HG3 . 10106 1 41 . 1 1 8 8 LYS HD2 H 1 1.674 0.030 . 1 . . . . 8 LYS HD2 . 10106 1 42 . 1 1 8 8 LYS HD3 H 1 1.674 0.030 . 1 . . . . 8 LYS HD3 . 10106 1 43 . 1 1 8 8 LYS HE2 H 1 2.987 0.030 . 1 . . . . 8 LYS HE2 . 10106 1 44 . 1 1 8 8 LYS HE3 H 1 2.987 0.030 . 1 . . . . 8 LYS HE3 . 10106 1 45 . 1 1 8 8 LYS C C 13 176.335 0.300 . 1 . . . . 8 LYS C . 10106 1 46 . 1 1 8 8 LYS CA C 13 56.174 0.300 . 1 . . . . 8 LYS CA . 10106 1 47 . 1 1 8 8 LYS CB C 13 33.115 0.300 . 1 . . . . 8 LYS CB . 10106 1 48 . 1 1 8 8 LYS CG C 13 24.687 0.300 . 1 . . . . 8 LYS CG . 10106 1 49 . 1 1 8 8 LYS CD C 13 29.053 0.300 . 1 . . . . 8 LYS CD . 10106 1 50 . 1 1 8 8 LYS CE C 13 42.316 0.300 . 1 . . . . 8 LYS CE . 10106 1 51 . 1 1 8 8 LYS N N 15 120.955 0.300 . 1 . . . . 8 LYS N . 10106 1 52 . 1 1 9 9 ARG H H 1 8.295 0.030 . 1 . . . . 9 ARG H . 10106 1 53 . 1 1 9 9 ARG HA H 1 4.271 0.030 . 1 . . . . 9 ARG HA . 10106 1 54 . 1 1 9 9 ARG HB2 H 1 1.722 0.030 . 2 . . . . 9 ARG HB2 . 10106 1 55 . 1 1 9 9 ARG HB3 H 1 1.806 0.030 . 2 . . . . 9 ARG HB3 . 10106 1 56 . 1 1 9 9 ARG HG2 H 1 1.595 0.030 . 1 . . . . 9 ARG HG2 . 10106 1 57 . 1 1 9 9 ARG HG3 H 1 1.595 0.030 . 1 . . . . 9 ARG HG3 . 10106 1 58 . 1 1 9 9 ARG HD2 H 1 3.200 0.030 . 1 . . . . 9 ARG HD2 . 10106 1 59 . 1 1 9 9 ARG HD3 H 1 3.200 0.030 . 1 . . . . 9 ARG HD3 . 10106 1 60 . 1 1 9 9 ARG C C 13 176.136 0.300 . 1 . . . . 9 ARG C . 10106 1 61 . 1 1 9 9 ARG CA C 13 55.728 0.300 . 1 . . . . 9 ARG CA . 10106 1 62 . 1 1 9 9 ARG CB C 13 31.214 0.300 . 1 . . . . 9 ARG CB . 10106 1 63 . 1 1 9 9 ARG CG C 13 26.911 0.300 . 1 . . . . 9 ARG CG . 10106 1 64 . 1 1 9 9 ARG CD C 13 43.538 0.300 . 1 . . . . 9 ARG CD . 10106 1 65 . 1 1 9 9 ARG N N 15 122.654 0.300 . 1 . . . . 9 ARG N . 10106 1 66 . 1 1 10 10 PHE H H 1 8.254 0.030 . 1 . . . . 10 PHE H . 10106 1 67 . 1 1 10 10 PHE HA H 1 4.671 0.030 . 1 . . . . 10 PHE HA . 10106 1 68 . 1 1 10 10 PHE HB2 H 1 2.736 0.030 . 2 . . . . 10 PHE HB2 . 10106 1 69 . 1 1 10 10 PHE HB3 H 1 2.543 0.030 . 2 . . . . 10 PHE HB3 . 10106 1 70 . 1 1 10 10 PHE HD1 H 1 7.065 0.030 . 1 . . . . 10 PHE HD1 . 10106 1 71 . 1 1 10 10 PHE HD2 H 1 7.065 0.030 . 1 . . . . 10 PHE HD2 . 10106 1 72 . 1 1 10 10 PHE HE1 H 1 6.820 0.030 . 1 . . . . 10 PHE HE1 . 10106 1 73 . 1 1 10 10 PHE HE2 H 1 6.820 0.030 . 1 . . . . 10 PHE HE2 . 10106 1 74 . 1 1 10 10 PHE HZ H 1 7.029 0.030 . 1 . . . . 10 PHE HZ . 10106 1 75 . 1 1 10 10 PHE C C 13 175.081 0.300 . 1 . . . . 10 PHE C . 10106 1 76 . 1 1 10 10 PHE CA C 13 56.139 0.300 . 1 . . . . 10 PHE CA . 10106 1 77 . 1 1 10 10 PHE CB C 13 39.440 0.300 . 1 . . . . 10 PHE CB . 10106 1 78 . 1 1 10 10 PHE CD1 C 13 130.758 0.300 . 1 . . . . 10 PHE CD1 . 10106 1 79 . 1 1 10 10 PHE CD2 C 13 130.758 0.300 . 1 . . . . 10 PHE CD2 . 10106 1 80 . 1 1 10 10 PHE CE1 C 13 130.913 0.300 . 1 . . . . 10 PHE CE1 . 10106 1 81 . 1 1 10 10 PHE CE2 C 13 130.913 0.300 . 1 . . . . 10 PHE CE2 . 10106 1 82 . 1 1 10 10 PHE CZ C 13 129.461 0.300 . 1 . . . . 10 PHE CZ . 10106 1 83 . 1 1 10 10 PHE N N 15 121.941 0.300 . 1 . . . . 10 PHE N . 10106 1 84 . 1 1 11 11 GLU H H 1 8.660 0.030 . 1 . . . . 11 GLU H . 10106 1 85 . 1 1 11 11 GLU HA H 1 4.358 0.030 . 1 . . . . 11 GLU HA . 10106 1 86 . 1 1 11 11 GLU HB2 H 1 1.825 0.030 . 2 . . . . 11 GLU HB2 . 10106 1 87 . 1 1 11 11 GLU HB3 H 1 1.937 0.030 . 2 . . . . 11 GLU HB3 . 10106 1 88 . 1 1 11 11 GLU HG2 H 1 2.084 0.030 . 2 . . . . 11 GLU HG2 . 10106 1 89 . 1 1 11 11 GLU HG3 H 1 2.293 0.030 . 2 . . . . 11 GLU HG3 . 10106 1 90 . 1 1 11 11 GLU C C 13 175.453 0.300 . 1 . . . . 11 GLU C . 10106 1 91 . 1 1 11 11 GLU CA C 13 55.293 0.300 . 1 . . . . 11 GLU CA . 10106 1 92 . 1 1 11 11 GLU CB C 13 31.101 0.300 . 1 . . . . 11 GLU CB . 10106 1 93 . 1 1 11 11 GLU CG C 13 36.137 0.300 . 1 . . . . 11 GLU CG . 10106 1 94 . 1 1 11 11 GLU N N 15 121.448 0.300 . 1 . . . . 11 GLU N . 10106 1 95 . 1 1 12 12 PHE H H 1 8.787 0.030 . 1 . . . . 12 PHE H . 10106 1 96 . 1 1 12 12 PHE HA H 1 4.580 0.030 . 1 . . . . 12 PHE HA . 10106 1 97 . 1 1 12 12 PHE HB2 H 1 2.811 0.030 . 1 . . . . 12 PHE HB2 . 10106 1 98 . 1 1 12 12 PHE HB3 H 1 2.811 0.030 . 1 . . . . 12 PHE HB3 . 10106 1 99 . 1 1 12 12 PHE HD1 H 1 6.918 0.030 . 1 . . . . 12 PHE HD1 . 10106 1 100 . 1 1 12 12 PHE HD2 H 1 6.918 0.030 . 1 . . . . 12 PHE HD2 . 10106 1 101 . 1 1 12 12 PHE HE1 H 1 7.125 0.030 . 1 . . . . 12 PHE HE1 . 10106 1 102 . 1 1 12 12 PHE HE2 H 1 7.125 0.030 . 1 . . . . 12 PHE HE2 . 10106 1 103 . 1 1 12 12 PHE HZ H 1 7.329 0.030 . 1 . . . . 12 PHE HZ . 10106 1 104 . 1 1 12 12 PHE C C 13 175.578 0.300 . 1 . . . . 12 PHE C . 10106 1 105 . 1 1 12 12 PHE CA C 13 58.394 0.300 . 1 . . . . 12 PHE CA . 10106 1 106 . 1 1 12 12 PHE CB C 13 41.095 0.300 . 1 . . . . 12 PHE CB . 10106 1 107 . 1 1 12 12 PHE CD1 C 13 131.220 0.300 . 1 . . . . 12 PHE CD1 . 10106 1 108 . 1 1 12 12 PHE CD2 C 13 131.220 0.300 . 1 . . . . 12 PHE CD2 . 10106 1 109 . 1 1 12 12 PHE CE1 C 13 131.177 0.300 . 1 . . . . 12 PHE CE1 . 10106 1 110 . 1 1 12 12 PHE CE2 C 13 131.177 0.300 . 1 . . . . 12 PHE CE2 . 10106 1 111 . 1 1 12 12 PHE CZ C 13 129.913 0.300 . 1 . . . . 12 PHE CZ . 10106 1 112 . 1 1 12 12 PHE N N 15 122.447 0.300 . 1 . . . . 12 PHE N . 10106 1 113 . 1 1 13 13 VAL H H 1 8.787 0.030 . 1 . . . . 13 VAL H . 10106 1 114 . 1 1 13 13 VAL HA H 1 4.103 0.030 . 1 . . . . 13 VAL HA . 10106 1 115 . 1 1 13 13 VAL HB H 1 1.812 0.030 . 1 . . . . 13 VAL HB . 10106 1 116 . 1 1 13 13 VAL HG11 H 1 0.736 0.030 . 1 . . . . 13 VAL HG1 . 10106 1 117 . 1 1 13 13 VAL HG12 H 1 0.736 0.030 . 1 . . . . 13 VAL HG1 . 10106 1 118 . 1 1 13 13 VAL HG13 H 1 0.736 0.030 . 1 . . . . 13 VAL HG1 . 10106 1 119 . 1 1 13 13 VAL HG21 H 1 0.824 0.030 . 1 . . . . 13 VAL HG2 . 10106 1 120 . 1 1 13 13 VAL HG22 H 1 0.824 0.030 . 1 . . . . 13 VAL HG2 . 10106 1 121 . 1 1 13 13 VAL HG23 H 1 0.824 0.030 . 1 . . . . 13 VAL HG2 . 10106 1 122 . 1 1 13 13 VAL C C 13 175.629 0.300 . 1 . . . . 13 VAL C . 10106 1 123 . 1 1 13 13 VAL CA C 13 61.071 0.300 . 1 . . . . 13 VAL CA . 10106 1 124 . 1 1 13 13 VAL CB C 13 31.583 0.300 . 1 . . . . 13 VAL CB . 10106 1 125 . 1 1 13 13 VAL CG1 C 13 19.810 0.300 . 2 . . . . 13 VAL CG1 . 10106 1 126 . 1 1 13 13 VAL CG2 C 13 20.755 0.300 . 2 . . . . 13 VAL CG2 . 10106 1 127 . 1 1 13 13 VAL N N 15 124.791 0.300 . 1 . . . . 13 VAL N . 10106 1 128 . 1 1 14 14 GLY H H 1 8.426 0.030 . 1 . . . . 14 GLY H . 10106 1 129 . 1 1 14 14 GLY HA2 H 1 4.060 0.030 . 2 . . . . 14 GLY HA2 . 10106 1 130 . 1 1 14 14 GLY HA3 H 1 3.671 0.030 . 2 . . . . 14 GLY HA3 . 10106 1 131 . 1 1 14 14 GLY C C 13 174.001 0.300 . 1 . . . . 14 GLY C . 10106 1 132 . 1 1 14 14 GLY CA C 13 47.078 0.300 . 1 . . . . 14 GLY CA . 10106 1 133 . 1 1 14 14 GLY N N 15 114.290 0.300 . 1 . . . . 14 GLY N . 10106 1 134 . 1 1 15 15 TRP H H 1 7.043 0.030 . 1 . . . . 15 TRP H . 10106 1 135 . 1 1 15 15 TRP HA H 1 4.539 0.030 . 1 . . . . 15 TRP HA . 10106 1 136 . 1 1 15 15 TRP HB2 H 1 3.696 0.030 . 2 . . . . 15 TRP HB2 . 10106 1 137 . 1 1 15 15 TRP HB3 H 1 3.300 0.030 . 2 . . . . 15 TRP HB3 . 10106 1 138 . 1 1 15 15 TRP HD1 H 1 7.593 0.030 . 1 . . . . 15 TRP HD1 . 10106 1 139 . 1 1 15 15 TRP HE1 H 1 10.115 0.030 . 1 . . . . 15 TRP HE1 . 10106 1 140 . 1 1 15 15 TRP HE3 H 1 7.324 0.030 . 1 . . . . 15 TRP HE3 . 10106 1 141 . 1 1 15 15 TRP HZ2 H 1 7.108 0.030 . 1 . . . . 15 TRP HZ2 . 10106 1 142 . 1 1 15 15 TRP HZ3 H 1 6.880 0.030 . 1 . . . . 15 TRP HZ3 . 10106 1 143 . 1 1 15 15 TRP HH2 H 1 6.900 0.030 . 1 . . . . 15 TRP HH2 . 10106 1 144 . 1 1 15 15 TRP C C 13 176.087 0.300 . 1 . . . . 15 TRP C . 10106 1 145 . 1 1 15 15 TRP CA C 13 56.408 0.300 . 1 . . . . 15 TRP CA . 10106 1 146 . 1 1 15 15 TRP CB C 13 30.235 0.300 . 1 . . . . 15 TRP CB . 10106 1 147 . 1 1 15 15 TRP CD1 C 13 128.820 0.300 . 1 . . . . 15 TRP CD1 . 10106 1 148 . 1 1 15 15 TRP CE3 C 13 122.085 0.300 . 1 . . . . 15 TRP CE3 . 10106 1 149 . 1 1 15 15 TRP CZ2 C 13 114.040 0.300 . 1 . . . . 15 TRP CZ2 . 10106 1 150 . 1 1 15 15 TRP CZ3 C 13 123.460 0.300 . 1 . . . . 15 TRP CZ3 . 10106 1 151 . 1 1 15 15 TRP CH2 C 13 123.600 0.300 . 1 . . . . 15 TRP CH2 . 10106 1 152 . 1 1 15 15 TRP N N 15 122.391 0.300 . 1 . . . . 15 TRP N . 10106 1 153 . 1 1 15 15 TRP NE1 N 15 131.117 0.300 . 1 . . . . 15 TRP NE1 . 10106 1 154 . 1 1 16 16 GLY H H 1 6.697 0.030 . 1 . . . . 16 GLY H . 10106 1 155 . 1 1 16 16 GLY HA2 H 1 5.313 0.030 . 2 . . . . 16 GLY HA2 . 10106 1 156 . 1 1 16 16 GLY HA3 H 1 2.521 0.030 . 2 . . . . 16 GLY HA3 . 10106 1 157 . 1 1 16 16 GLY C C 13 171.533 0.300 . 1 . . . . 16 GLY C . 10106 1 158 . 1 1 16 16 GLY CA C 13 43.552 0.300 . 1 . . . . 16 GLY CA . 10106 1 159 . 1 1 16 16 GLY N N 15 107.773 0.300 . 1 . . . . 16 GLY N . 10106 1 160 . 1 1 17 17 SER H H 1 8.628 0.030 . 1 . . . . 17 SER H . 10106 1 161 . 1 1 17 17 SER HA H 1 3.931 0.030 . 1 . . . . 17 SER HA . 10106 1 162 . 1 1 17 17 SER HB2 H 1 3.586 0.030 . 2 . . . . 17 SER HB2 . 10106 1 163 . 1 1 17 17 SER HB3 H 1 3.868 0.030 . 2 . . . . 17 SER HB3 . 10106 1 164 . 1 1 17 17 SER C C 13 173.667 0.300 . 1 . . . . 17 SER C . 10106 1 165 . 1 1 17 17 SER CA C 13 57.513 0.300 . 1 . . . . 17 SER CA . 10106 1 166 . 1 1 17 17 SER CB C 13 63.731 0.300 . 1 . . . . 17 SER CB . 10106 1 167 . 1 1 17 17 SER N N 15 117.591 0.300 . 1 . . . . 17 SER N . 10106 1 168 . 1 1 18 18 ARG H H 1 8.631 0.030 . 1 . . . . 18 ARG H . 10106 1 169 . 1 1 18 18 ARG HA H 1 3.577 0.030 . 1 . . . . 18 ARG HA . 10106 1 170 . 1 1 18 18 ARG HB2 H 1 1.533 0.030 . 2 . . . . 18 ARG HB2 . 10106 1 171 . 1 1 18 18 ARG HB3 H 1 1.620 0.030 . 2 . . . . 18 ARG HB3 . 10106 1 172 . 1 1 18 18 ARG HG2 H 1 1.474 0.030 . 1 . . . . 18 ARG HG2 . 10106 1 173 . 1 1 18 18 ARG HG3 H 1 1.474 0.030 . 1 . . . . 18 ARG HG3 . 10106 1 174 . 1 1 18 18 ARG HD2 H 1 3.111 0.030 . 2 . . . . 18 ARG HD2 . 10106 1 175 . 1 1 18 18 ARG HD3 H 1 3.058 0.030 . 2 . . . . 18 ARG HD3 . 10106 1 176 . 1 1 18 18 ARG HE H 1 7.358 0.030 . 1 . . . . 18 ARG HE . 10106 1 177 . 1 1 18 18 ARG C C 13 177.898 0.300 . 1 . . . . 18 ARG C . 10106 1 178 . 1 1 18 18 ARG CA C 13 60.017 0.300 . 1 . . . . 18 ARG CA . 10106 1 179 . 1 1 18 18 ARG CB C 13 29.634 0.300 . 1 . . . . 18 ARG CB . 10106 1 180 . 1 1 18 18 ARG CG C 13 26.674 0.300 . 1 . . . . 18 ARG CG . 10106 1 181 . 1 1 18 18 ARG CD C 13 42.959 0.300 . 1 . . . . 18 ARG CD . 10106 1 182 . 1 1 18 18 ARG N N 15 120.674 0.300 . 1 . . . . 18 ARG N . 10106 1 183 . 1 1 18 18 ARG NE N 15 83.158 0.300 . 1 . . . . 18 ARG NE . 10106 1 184 . 1 1 19 19 GLN H H 1 9.278 0.030 . 1 . . . . 19 GLN H . 10106 1 185 . 1 1 19 19 GLN HA H 1 3.904 0.030 . 1 . . . . 19 GLN HA . 10106 1 186 . 1 1 19 19 GLN HB2 H 1 1.897 0.030 . 2 . . . . 19 GLN HB2 . 10106 1 187 . 1 1 19 19 GLN HB3 H 1 1.951 0.030 . 2 . . . . 19 GLN HB3 . 10106 1 188 . 1 1 19 19 GLN HG2 H 1 2.391 0.030 . 2 . . . . 19 GLN HG2 . 10106 1 189 . 1 1 19 19 GLN HG3 H 1 2.675 0.030 . 2 . . . . 19 GLN HG3 . 10106 1 190 . 1 1 19 19 GLN HE21 H 1 5.781 0.030 . 2 . . . . 19 GLN HE21 . 10106 1 191 . 1 1 19 19 GLN HE22 H 1 7.634 0.030 . 2 . . . . 19 GLN HE22 . 10106 1 192 . 1 1 19 19 GLN C C 13 178.643 0.300 . 1 . . . . 19 GLN C . 10106 1 193 . 1 1 19 19 GLN CA C 13 59.508 0.300 . 1 . . . . 19 GLN CA . 10106 1 194 . 1 1 19 19 GLN CB C 13 28.455 0.300 . 1 . . . . 19 GLN CB . 10106 1 195 . 1 1 19 19 GLN CG C 13 34.325 0.300 . 1 . . . . 19 GLN CG . 10106 1 196 . 1 1 19 19 GLN N N 15 115.834 0.300 . 1 . . . . 19 GLN N . 10106 1 197 . 1 1 19 19 GLN NE2 N 15 111.502 0.300 . 1 . . . . 19 GLN NE2 . 10106 1 198 . 1 1 20 20 LEU H H 1 8.470 0.030 . 1 . . . . 20 LEU H . 10106 1 199 . 1 1 20 20 LEU HA H 1 3.820 0.030 . 1 . . . . 20 LEU HA . 10106 1 200 . 1 1 20 20 LEU HB2 H 1 1.855 0.030 . 2 . . . . 20 LEU HB2 . 10106 1 201 . 1 1 20 20 LEU HB3 H 1 1.123 0.030 . 2 . . . . 20 LEU HB3 . 10106 1 202 . 1 1 20 20 LEU HG H 1 1.362 0.030 . 1 . . . . 20 LEU HG . 10106 1 203 . 1 1 20 20 LEU HD11 H 1 0.817 0.030 . 1 . . . . 20 LEU HD1 . 10106 1 204 . 1 1 20 20 LEU HD12 H 1 0.817 0.030 . 1 . . . . 20 LEU HD1 . 10106 1 205 . 1 1 20 20 LEU HD13 H 1 0.817 0.030 . 1 . . . . 20 LEU HD1 . 10106 1 206 . 1 1 20 20 LEU HD21 H 1 0.824 0.030 . 1 . . . . 20 LEU HD2 . 10106 1 207 . 1 1 20 20 LEU HD22 H 1 0.824 0.030 . 1 . . . . 20 LEU HD2 . 10106 1 208 . 1 1 20 20 LEU HD23 H 1 0.824 0.030 . 1 . . . . 20 LEU HD2 . 10106 1 209 . 1 1 20 20 LEU C C 13 177.774 0.300 . 1 . . . . 20 LEU C . 10106 1 210 . 1 1 20 20 LEU CA C 13 57.959 0.300 . 1 . . . . 20 LEU CA . 10106 1 211 . 1 1 20 20 LEU CB C 13 41.469 0.300 . 1 . . . . 20 LEU CB . 10106 1 212 . 1 1 20 20 LEU CG C 13 27.360 0.300 . 1 . . . . 20 LEU CG . 10106 1 213 . 1 1 20 20 LEU CD1 C 13 23.535 0.300 . 2 . . . . 20 LEU CD1 . 10106 1 214 . 1 1 20 20 LEU CD2 C 13 27.447 0.300 . 2 . . . . 20 LEU CD2 . 10106 1 215 . 1 1 20 20 LEU N N 15 125.321 0.300 . 1 . . . . 20 LEU N . 10106 1 216 . 1 1 21 21 ILE H H 1 8.432 0.030 . 1 . . . . 21 ILE H . 10106 1 217 . 1 1 21 21 ILE HA H 1 3.364 0.030 . 1 . . . . 21 ILE HA . 10106 1 218 . 1 1 21 21 ILE HB H 1 1.806 0.030 . 1 . . . . 21 ILE HB . 10106 1 219 . 1 1 21 21 ILE HG12 H 1 1.225 0.030 . 2 . . . . 21 ILE HG12 . 10106 1 220 . 1 1 21 21 ILE HG13 H 1 1.005 0.030 . 2 . . . . 21 ILE HG13 . 10106 1 221 . 1 1 21 21 ILE HG21 H 1 0.502 0.030 . 1 . . . . 21 ILE HG2 . 10106 1 222 . 1 1 21 21 ILE HG22 H 1 0.502 0.030 . 1 . . . . 21 ILE HG2 . 10106 1 223 . 1 1 21 21 ILE HG23 H 1 0.502 0.030 . 1 . . . . 21 ILE HG2 . 10106 1 224 . 1 1 21 21 ILE HD11 H 1 -0.331 0.030 . 1 . . . . 21 ILE HD1 . 10106 1 225 . 1 1 21 21 ILE HD12 H 1 -0.331 0.030 . 1 . . . . 21 ILE HD1 . 10106 1 226 . 1 1 21 21 ILE HD13 H 1 -0.331 0.030 . 1 . . . . 21 ILE HD1 . 10106 1 227 . 1 1 21 21 ILE C C 13 178.220 0.300 . 1 . . . . 21 ILE C . 10106 1 228 . 1 1 21 21 ILE CA C 13 62.852 0.300 . 1 . . . . 21 ILE CA . 10106 1 229 . 1 1 21 21 ILE CB C 13 34.881 0.300 . 1 . . . . 21 ILE CB . 10106 1 230 . 1 1 21 21 ILE CG1 C 13 27.788 0.300 . 1 . . . . 21 ILE CG1 . 10106 1 231 . 1 1 21 21 ILE CG2 C 13 17.689 0.300 . 1 . . . . 21 ILE CG2 . 10106 1 232 . 1 1 21 21 ILE CD1 C 13 8.483 0.300 . 1 . . . . 21 ILE CD1 . 10106 1 233 . 1 1 21 21 ILE N N 15 120.591 0.300 . 1 . . . . 21 ILE N . 10106 1 234 . 1 1 22 22 GLU H H 1 8.477 0.030 . 1 . . . . 22 GLU H . 10106 1 235 . 1 1 22 22 GLU HA H 1 3.927 0.030 . 1 . . . . 22 GLU HA . 10106 1 236 . 1 1 22 22 GLU HB2 H 1 1.956 0.030 . 2 . . . . 22 GLU HB2 . 10106 1 237 . 1 1 22 22 GLU HB3 H 1 2.017 0.030 . 2 . . . . 22 GLU HB3 . 10106 1 238 . 1 1 22 22 GLU HG2 H 1 2.229 0.030 . 2 . . . . 22 GLU HG2 . 10106 1 239 . 1 1 22 22 GLU HG3 H 1 2.400 0.030 . 2 . . . . 22 GLU HG3 . 10106 1 240 . 1 1 22 22 GLU C C 13 179.920 0.300 . 1 . . . . 22 GLU C . 10106 1 241 . 1 1 22 22 GLU CA C 13 59.734 0.300 . 1 . . . . 22 GLU CA . 10106 1 242 . 1 1 22 22 GLU CB C 13 29.117 0.300 . 1 . . . . 22 GLU CB . 10106 1 243 . 1 1 22 22 GLU CG C 13 36.879 0.300 . 1 . . . . 22 GLU CG . 10106 1 244 . 1 1 22 22 GLU N N 15 118.791 0.300 . 1 . . . . 22 GLU N . 10106 1 245 . 1 1 23 23 PHE H H 1 8.040 0.030 . 1 . . . . 23 PHE H . 10106 1 246 . 1 1 23 23 PHE HA H 1 4.091 0.030 . 1 . . . . 23 PHE HA . 10106 1 247 . 1 1 23 23 PHE HB2 H 1 3.219 0.030 . 2 . . . . 23 PHE HB2 . 10106 1 248 . 1 1 23 23 PHE HB3 H 1 3.095 0.030 . 2 . . . . 23 PHE HB3 . 10106 1 249 . 1 1 23 23 PHE HD1 H 1 6.931 0.030 . 1 . . . . 23 PHE HD1 . 10106 1 250 . 1 1 23 23 PHE HD2 H 1 6.931 0.030 . 1 . . . . 23 PHE HD2 . 10106 1 251 . 1 1 23 23 PHE HE1 H 1 6.460 0.030 . 1 . . . . 23 PHE HE1 . 10106 1 252 . 1 1 23 23 PHE HE2 H 1 6.460 0.030 . 1 . . . . 23 PHE HE2 . 10106 1 253 . 1 1 23 23 PHE HZ H 1 6.300 0.030 . 1 . . . . 23 PHE HZ . 10106 1 254 . 1 1 23 23 PHE C C 13 178.345 0.300 . 1 . . . . 23 PHE C . 10106 1 255 . 1 1 23 23 PHE CA C 13 61.296 0.300 . 1 . . . . 23 PHE CA . 10106 1 256 . 1 1 23 23 PHE CB C 13 38.632 0.300 . 1 . . . . 23 PHE CB . 10106 1 257 . 1 1 23 23 PHE CD1 C 13 131.523 0.300 . 1 . . . . 23 PHE CD1 . 10106 1 258 . 1 1 23 23 PHE CD2 C 13 131.523 0.300 . 1 . . . . 23 PHE CD2 . 10106 1 259 . 1 1 23 23 PHE CE1 C 13 130.294 0.300 . 1 . . . . 23 PHE CE1 . 10106 1 260 . 1 1 23 23 PHE CE2 C 13 130.294 0.300 . 1 . . . . 23 PHE CE2 . 10106 1 261 . 1 1 23 23 PHE CZ C 13 129.164 0.300 . 1 . . . . 23 PHE CZ . 10106 1 262 . 1 1 23 23 PHE N N 15 121.873 0.300 . 1 . . . . 23 PHE N . 10106 1 263 . 1 1 24 24 LEU H H 1 8.601 0.030 . 1 . . . . 24 LEU H . 10106 1 264 . 1 1 24 24 LEU HA H 1 3.608 0.030 . 1 . . . . 24 LEU HA . 10106 1 265 . 1 1 24 24 LEU HB2 H 1 1.909 0.030 . 2 . . . . 24 LEU HB2 . 10106 1 266 . 1 1 24 24 LEU HB3 H 1 1.151 0.030 . 2 . . . . 24 LEU HB3 . 10106 1 267 . 1 1 24 24 LEU HG H 1 2.110 0.030 . 1 . . . . 24 LEU HG . 10106 1 268 . 1 1 24 24 LEU HD11 H 1 1.125 0.030 . 1 . . . . 24 LEU HD1 . 10106 1 269 . 1 1 24 24 LEU HD12 H 1 1.125 0.030 . 1 . . . . 24 LEU HD1 . 10106 1 270 . 1 1 24 24 LEU HD13 H 1 1.125 0.030 . 1 . . . . 24 LEU HD1 . 10106 1 271 . 1 1 24 24 LEU HD21 H 1 0.947 0.030 . 1 . . . . 24 LEU HD2 . 10106 1 272 . 1 1 24 24 LEU HD22 H 1 0.947 0.030 . 1 . . . . 24 LEU HD2 . 10106 1 273 . 1 1 24 24 LEU HD23 H 1 0.947 0.030 . 1 . . . . 24 LEU HD2 . 10106 1 274 . 1 1 24 24 LEU C C 13 180.057 0.300 . 1 . . . . 24 LEU C . 10106 1 275 . 1 1 24 24 LEU CA C 13 57.942 0.300 . 1 . . . . 24 LEU CA . 10106 1 276 . 1 1 24 24 LEU CB C 13 40.882 0.300 . 1 . . . . 24 LEU CB . 10106 1 277 . 1 1 24 24 LEU CG C 13 27.342 0.300 . 1 . . . . 24 LEU CG . 10106 1 278 . 1 1 24 24 LEU CD1 C 13 27.574 0.300 . 2 . . . . 24 LEU CD1 . 10106 1 279 . 1 1 24 24 LEU CD2 C 13 21.797 0.300 . 2 . . . . 24 LEU CD2 . 10106 1 280 . 1 1 24 24 LEU N N 15 120.741 0.300 . 1 . . . . 24 LEU N . 10106 1 281 . 1 1 25 25 HIS H H 1 9.069 0.030 . 1 . . . . 25 HIS H . 10106 1 282 . 1 1 25 25 HIS HA H 1 4.583 0.030 . 1 . . . . 25 HIS HA . 10106 1 283 . 1 1 25 25 HIS HB2 H 1 3.331 0.030 . 2 . . . . 25 HIS HB2 . 10106 1 284 . 1 1 25 25 HIS HB3 H 1 3.253 0.030 . 2 . . . . 25 HIS HB3 . 10106 1 285 . 1 1 25 25 HIS HD2 H 1 7.348 0.030 . 1 . . . . 25 HIS HD2 . 10106 1 286 . 1 1 25 25 HIS HE1 H 1 8.312 0.030 . 1 . . . . 25 HIS HE1 . 10106 1 287 . 1 1 25 25 HIS C C 13 179.547 0.300 . 1 . . . . 25 HIS C . 10106 1 288 . 1 1 25 25 HIS CA C 13 58.178 0.300 . 1 . . . . 25 HIS CA . 10106 1 289 . 1 1 25 25 HIS CB C 13 28.448 0.300 . 1 . . . . 25 HIS CB . 10106 1 290 . 1 1 25 25 HIS CD2 C 13 119.053 0.300 . 1 . . . . 25 HIS CD2 . 10106 1 291 . 1 1 25 25 HIS CE1 C 13 136.947 0.300 . 1 . . . . 25 HIS CE1 . 10106 1 292 . 1 1 25 25 HIS N N 15 119.573 0.300 . 1 . . . . 25 HIS N . 10106 1 293 . 1 1 26 26 SER H H 1 8.342 0.030 . 1 . . . . 26 SER H . 10106 1 294 . 1 1 26 26 SER HA H 1 4.318 0.030 . 1 . . . . 26 SER HA . 10106 1 295 . 1 1 26 26 SER HB2 H 1 4.033 0.030 . 1 . . . . 26 SER HB2 . 10106 1 296 . 1 1 26 26 SER HB3 H 1 4.033 0.030 . 1 . . . . 26 SER HB3 . 10106 1 297 . 1 1 26 26 SER C C 13 174.701 0.300 . 1 . . . . 26 SER C . 10106 1 298 . 1 1 26 26 SER CA C 13 61.425 0.300 . 1 . . . . 26 SER CA . 10106 1 299 . 1 1 26 26 SER CB C 13 62.476 0.300 . 1 . . . . 26 SER CB . 10106 1 300 . 1 1 26 26 SER N N 15 119.091 0.300 . 1 . . . . 26 SER N . 10106 1 301 . 1 1 27 27 LEU H H 1 7.024 0.030 . 1 . . . . 27 LEU H . 10106 1 302 . 1 1 27 27 LEU HA H 1 4.370 0.030 . 1 . . . . 27 LEU HA . 10106 1 303 . 1 1 27 27 LEU HB2 H 1 1.666 0.030 . 2 . . . . 27 LEU HB2 . 10106 1 304 . 1 1 27 27 LEU HB3 H 1 1.422 0.030 . 2 . . . . 27 LEU HB3 . 10106 1 305 . 1 1 27 27 LEU HG H 1 1.118 0.030 . 1 . . . . 27 LEU HG . 10106 1 306 . 1 1 27 27 LEU HD11 H 1 0.207 0.030 . 1 . . . . 27 LEU HD1 . 10106 1 307 . 1 1 27 27 LEU HD12 H 1 0.207 0.030 . 1 . . . . 27 LEU HD1 . 10106 1 308 . 1 1 27 27 LEU HD13 H 1 0.207 0.030 . 1 . . . . 27 LEU HD1 . 10106 1 309 . 1 1 27 27 LEU HD21 H 1 0.526 0.030 . 1 . . . . 27 LEU HD2 . 10106 1 310 . 1 1 27 27 LEU HD22 H 1 0.526 0.030 . 1 . . . . 27 LEU HD2 . 10106 1 311 . 1 1 27 27 LEU HD23 H 1 0.526 0.030 . 1 . . . . 27 LEU HD2 . 10106 1 312 . 1 1 27 27 LEU C C 13 177.364 0.300 . 1 . . . . 27 LEU C . 10106 1 313 . 1 1 27 27 LEU CA C 13 54.394 0.300 . 1 . . . . 27 LEU CA . 10106 1 314 . 1 1 27 27 LEU CB C 13 42.440 0.300 . 1 . . . . 27 LEU CB . 10106 1 315 . 1 1 27 27 LEU CG C 13 26.635 0.300 . 1 . . . . 27 LEU CG . 10106 1 316 . 1 1 27 27 LEU CD1 C 13 25.340 0.300 . 2 . . . . 27 LEU CD1 . 10106 1 317 . 1 1 27 27 LEU CD2 C 13 22.459 0.300 . 2 . . . . 27 LEU CD2 . 10106 1 318 . 1 1 27 27 LEU N N 15 121.493 0.300 . 1 . . . . 27 LEU N . 10106 1 319 . 1 1 28 28 GLY H H 1 7.985 0.030 . 1 . . . . 28 GLY H . 10106 1 320 . 1 1 28 28 GLY HA2 H 1 4.102 0.030 . 2 . . . . 28 GLY HA2 . 10106 1 321 . 1 1 28 28 GLY HA3 H 1 3.780 0.030 . 2 . . . . 28 GLY HA3 . 10106 1 322 . 1 1 28 28 GLY C C 13 174.809 0.300 . 1 . . . . 28 GLY C . 10106 1 323 . 1 1 28 28 GLY CA C 13 45.678 0.300 . 1 . . . . 28 GLY CA . 10106 1 324 . 1 1 28 28 GLY N N 15 108.140 0.300 . 1 . . . . 28 GLY N . 10106 1 325 . 1 1 29 29 LYS H H 1 7.699 0.030 . 1 . . . . 29 LYS H . 10106 1 326 . 1 1 29 29 LYS HA H 1 4.441 0.030 . 1 . . . . 29 LYS HA . 10106 1 327 . 1 1 29 29 LYS HB2 H 1 1.590 0.030 . 2 . . . . 29 LYS HB2 . 10106 1 328 . 1 1 29 29 LYS HB3 H 1 1.690 0.030 . 2 . . . . 29 LYS HB3 . 10106 1 329 . 1 1 29 29 LYS HG2 H 1 1.325 0.030 . 2 . . . . 29 LYS HG2 . 10106 1 330 . 1 1 29 29 LYS HG3 H 1 1.394 0.030 . 2 . . . . 29 LYS HG3 . 10106 1 331 . 1 1 29 29 LYS HD2 H 1 1.644 0.030 . 1 . . . . 29 LYS HD2 . 10106 1 332 . 1 1 29 29 LYS HD3 H 1 1.644 0.030 . 1 . . . . 29 LYS HD3 . 10106 1 333 . 1 1 29 29 LYS HE2 H 1 2.894 0.030 . 2 . . . . 29 LYS HE2 . 10106 1 334 . 1 1 29 29 LYS HE3 H 1 3.000 0.030 . 2 . . . . 29 LYS HE3 . 10106 1 335 . 1 1 29 29 LYS C C 13 175.677 0.300 . 1 . . . . 29 LYS C . 10106 1 336 . 1 1 29 29 LYS CA C 13 54.183 0.300 . 1 . . . . 29 LYS CA . 10106 1 337 . 1 1 29 29 LYS CB C 13 32.224 0.300 . 1 . . . . 29 LYS CB . 10106 1 338 . 1 1 29 29 LYS CG C 13 24.440 0.300 . 1 . . . . 29 LYS CG . 10106 1 339 . 1 1 29 29 LYS CD C 13 28.007 0.300 . 1 . . . . 29 LYS CD . 10106 1 340 . 1 1 29 29 LYS CE C 13 42.061 0.300 . 1 . . . . 29 LYS CE . 10106 1 341 . 1 1 29 29 LYS N N 15 118.085 0.300 . 1 . . . . 29 LYS N . 10106 1 342 . 1 1 30 30 ASP H H 1 8.591 0.030 . 1 . . . . 30 ASP H . 10106 1 343 . 1 1 30 30 ASP HA H 1 4.720 0.030 . 1 . . . . 30 ASP HA . 10106 1 344 . 1 1 30 30 ASP HB2 H 1 2.758 0.030 . 2 . . . . 30 ASP HB2 . 10106 1 345 . 1 1 30 30 ASP HB3 H 1 2.892 0.030 . 2 . . . . 30 ASP HB3 . 10106 1 346 . 1 1 30 30 ASP C C 13 177.811 0.300 . 1 . . . . 30 ASP C . 10106 1 347 . 1 1 30 30 ASP CA C 13 54.113 0.300 . 1 . . . . 30 ASP CA . 10106 1 348 . 1 1 30 30 ASP CB C 13 41.855 0.300 . 1 . . . . 30 ASP CB . 10106 1 349 . 1 1 30 30 ASP N N 15 123.206 0.300 . 1 . . . . 30 ASP N . 10106 1 350 . 1 1 31 31 THR H H 1 8.822 0.030 . 1 . . . . 31 THR H . 10106 1 351 . 1 1 31 31 THR HA H 1 4.770 0.030 . 1 . . . . 31 THR HA . 10106 1 352 . 1 1 31 31 THR HB H 1 4.959 0.030 . 1 . . . . 31 THR HB . 10106 1 353 . 1 1 31 31 THR HG21 H 1 1.272 0.030 . 1 . . . . 31 THR HG2 . 10106 1 354 . 1 1 31 31 THR HG22 H 1 1.272 0.030 . 1 . . . . 31 THR HG2 . 10106 1 355 . 1 1 31 31 THR HG23 H 1 1.272 0.030 . 1 . . . . 31 THR HG2 . 10106 1 356 . 1 1 31 31 THR C C 13 175.280 0.300 . 1 . . . . 31 THR C . 10106 1 357 . 1 1 31 31 THR CA C 13 61.407 0.300 . 1 . . . . 31 THR CA . 10106 1 358 . 1 1 31 31 THR CB C 13 68.168 0.300 . 1 . . . . 31 THR CB . 10106 1 359 . 1 1 31 31 THR CG2 C 13 22.103 0.300 . 1 . . . . 31 THR CG2 . 10106 1 360 . 1 1 31 31 THR N N 15 115.492 0.300 . 1 . . . . 31 THR N . 10106 1 361 . 1 1 32 32 SER H H 1 8.827 0.030 . 1 . . . . 32 SER H . 10106 1 362 . 1 1 32 32 SER HA H 1 4.249 0.030 . 1 . . . . 32 SER HA . 10106 1 363 . 1 1 32 32 SER HB2 H 1 4.072 0.030 . 2 . . . . 32 SER HB2 . 10106 1 364 . 1 1 32 32 SER HB3 H 1 4.017 0.030 . 2 . . . . 32 SER HB3 . 10106 1 365 . 1 1 32 32 SER C C 13 174.699 0.300 . 1 . . . . 32 SER C . 10106 1 366 . 1 1 32 32 SER CA C 13 62.573 0.300 . 1 . . . . 32 SER CA . 10106 1 367 . 1 1 32 32 SER CB C 13 62.830 0.300 . 1 . . . . 32 SER CB . 10106 1 368 . 1 1 32 32 SER N N 15 120.591 0.300 . 1 . . . . 32 SER N . 10106 1 369 . 1 1 33 33 GLU H H 1 7.750 0.030 . 1 . . . . 33 GLU H . 10106 1 370 . 1 1 33 33 GLU HA H 1 4.531 0.030 . 1 . . . . 33 GLU HA . 10106 1 371 . 1 1 33 33 GLU HB2 H 1 1.913 0.030 . 2 . . . . 33 GLU HB2 . 10106 1 372 . 1 1 33 33 GLU HB3 H 1 1.696 0.030 . 2 . . . . 33 GLU HB3 . 10106 1 373 . 1 1 33 33 GLU HG2 H 1 2.196 0.030 . 1 . . . . 33 GLU HG2 . 10106 1 374 . 1 1 33 33 GLU HG3 H 1 2.196 0.030 . 1 . . . . 33 GLU HG3 . 10106 1 375 . 1 1 33 33 GLU C C 13 174.648 0.300 . 1 . . . . 33 GLU C . 10106 1 376 . 1 1 33 33 GLU CA C 13 53.743 0.300 . 1 . . . . 33 GLU CA . 10106 1 377 . 1 1 33 33 GLU CB C 13 32.019 0.300 . 1 . . . . 33 GLU CB . 10106 1 378 . 1 1 33 33 GLU CG C 13 35.808 0.300 . 1 . . . . 33 GLU CG . 10106 1 379 . 1 1 33 33 GLU N N 15 118.960 0.300 . 1 . . . . 33 GLU N . 10106 1 380 . 1 1 34 34 MET H H 1 8.117 0.030 . 1 . . . . 34 MET H . 10106 1 381 . 1 1 34 34 MET HA H 1 1.127 0.030 . 1 . . . . 34 MET HA . 10106 1 382 . 1 1 34 34 MET HB2 H 1 1.312 0.030 . 2 . . . . 34 MET HB2 . 10106 1 383 . 1 1 34 34 MET HB3 H 1 1.564 0.030 . 2 . . . . 34 MET HB3 . 10106 1 384 . 1 1 34 34 MET HG2 H 1 1.715 0.030 . 2 . . . . 34 MET HG2 . 10106 1 385 . 1 1 34 34 MET HG3 H 1 1.924 0.030 . 2 . . . . 34 MET HG3 . 10106 1 386 . 1 1 34 34 MET HE1 H 1 2.127 0.030 . 1 . . . . 34 MET HE . 10106 1 387 . 1 1 34 34 MET HE2 H 1 2.127 0.030 . 1 . . . . 34 MET HE . 10106 1 388 . 1 1 34 34 MET HE3 H 1 2.127 0.030 . 1 . . . . 34 MET HE . 10106 1 389 . 1 1 34 34 MET C C 13 174.869 0.300 . 1 . . . . 34 MET C . 10106 1 390 . 1 1 34 34 MET CA C 13 56.879 0.300 . 1 . . . . 34 MET CA . 10106 1 391 . 1 1 34 34 MET CB C 13 32.792 0.300 . 1 . . . . 34 MET CB . 10106 1 392 . 1 1 34 34 MET CG C 13 31.330 0.300 . 1 . . . . 34 MET CG . 10106 1 393 . 1 1 34 34 MET CE C 13 17.580 0.300 . 1 . . . . 34 MET CE . 10106 1 394 . 1 1 34 34 MET N N 15 121.343 0.300 . 1 . . . . 34 MET N . 10106 1 395 . 1 1 35 35 ILE HA H 1 4.104 0.030 . 1 . . . . 35 ILE HA . 10106 1 396 . 1 1 35 35 ILE HB H 1 1.474 0.030 . 1 . . . . 35 ILE HB . 10106 1 397 . 1 1 35 35 ILE HG12 H 1 1.840 0.030 . 2 . . . . 35 ILE HG12 . 10106 1 398 . 1 1 35 35 ILE HG13 H 1 1.030 0.030 . 2 . . . . 35 ILE HG13 . 10106 1 399 . 1 1 35 35 ILE HG21 H 1 1.150 0.030 . 1 . . . . 35 ILE HG2 . 10106 1 400 . 1 1 35 35 ILE HG22 H 1 1.150 0.030 . 1 . . . . 35 ILE HG2 . 10106 1 401 . 1 1 35 35 ILE HG23 H 1 1.150 0.030 . 1 . . . . 35 ILE HG2 . 10106 1 402 . 1 1 35 35 ILE HD11 H 1 1.099 0.030 . 1 . . . . 35 ILE HD1 . 10106 1 403 . 1 1 35 35 ILE HD12 H 1 1.099 0.030 . 1 . . . . 35 ILE HD1 . 10106 1 404 . 1 1 35 35 ILE HD13 H 1 1.099 0.030 . 1 . . . . 35 ILE HD1 . 10106 1 405 . 1 1 35 35 ILE C C 13 175.437 0.300 . 1 . . . . 35 ILE C . 10106 1 406 . 1 1 35 35 ILE CA C 13 60.165 0.300 . 1 . . . . 35 ILE CA . 10106 1 407 . 1 1 35 35 ILE CB C 13 39.543 0.300 . 1 . . . . 35 ILE CB . 10106 1 408 . 1 1 35 35 ILE CG1 C 13 26.894 0.300 . 1 . . . . 35 ILE CG1 . 10106 1 409 . 1 1 35 35 ILE CG2 C 13 19.028 0.300 . 1 . . . . 35 ILE CG2 . 10106 1 410 . 1 1 35 35 ILE CD1 C 13 14.154 0.300 . 1 . . . . 35 ILE CD1 . 10106 1 411 . 1 1 36 36 SER H H 1 9.503 0.030 . 1 . . . . 36 SER H . 10106 1 412 . 1 1 36 36 SER HA H 1 4.172 0.030 . 1 . . . . 36 SER HA . 10106 1 413 . 1 1 36 36 SER HB2 H 1 4.337 0.030 . 2 . . . . 36 SER HB2 . 10106 1 414 . 1 1 36 36 SER HB3 H 1 4.117 0.030 . 2 . . . . 36 SER HB3 . 10106 1 415 . 1 1 36 36 SER C C 13 173.716 0.300 . 1 . . . . 36 SER C . 10106 1 416 . 1 1 36 36 SER CA C 13 58.587 0.300 . 1 . . . . 36 SER CA . 10106 1 417 . 1 1 36 36 SER CB C 13 64.617 0.300 . 1 . . . . 36 SER CB . 10106 1 418 . 1 1 36 36 SER N N 15 125.842 0.300 . 1 . . . . 36 SER N . 10106 1 419 . 1 1 37 37 ARG H H 1 8.841 0.030 . 1 . . . . 37 ARG H . 10106 1 420 . 1 1 37 37 ARG HA H 1 4.239 0.030 . 1 . . . . 37 ARG HA . 10106 1 421 . 1 1 37 37 ARG HB2 H 1 1.605 0.030 . 2 . . . . 37 ARG HB2 . 10106 1 422 . 1 1 37 37 ARG HB3 H 1 0.746 0.030 . 2 . . . . 37 ARG HB3 . 10106 1 423 . 1 1 37 37 ARG HG2 H 1 1.223 0.030 . 1 . . . . 37 ARG HG2 . 10106 1 424 . 1 1 37 37 ARG HG3 H 1 1.223 0.030 . 1 . . . . 37 ARG HG3 . 10106 1 425 . 1 1 37 37 ARG HD2 H 1 2.528 0.030 . 2 . . . . 37 ARG HD2 . 10106 1 426 . 1 1 37 37 ARG HD3 H 1 2.825 0.030 . 2 . . . . 37 ARG HD3 . 10106 1 427 . 1 1 37 37 ARG HE H 1 6.446 0.030 . 1 . . . . 37 ARG HE . 10106 1 428 . 1 1 37 37 ARG C C 13 179.399 0.300 . 1 . . . . 37 ARG C . 10106 1 429 . 1 1 37 37 ARG CA C 13 60.381 0.300 . 1 . . . . 37 ARG CA . 10106 1 430 . 1 1 37 37 ARG CB C 13 30.513 0.300 . 1 . . . . 37 ARG CB . 10106 1 431 . 1 1 37 37 ARG CG C 13 26.738 0.300 . 1 . . . . 37 ARG CG . 10106 1 432 . 1 1 37 37 ARG CD C 13 43.763 0.300 . 1 . . . . 37 ARG CD . 10106 1 433 . 1 1 37 37 ARG N N 15 124.861 0.300 . 1 . . . . 37 ARG N . 10106 1 434 . 1 1 37 37 ARG NE N 15 79.745 0.300 . 1 . . . . 37 ARG NE . 10106 1 435 . 1 1 38 38 TYR H H 1 8.442 0.030 . 1 . . . . 38 TYR H . 10106 1 436 . 1 1 38 38 TYR HA H 1 4.260 0.030 . 1 . . . . 38 TYR HA . 10106 1 437 . 1 1 38 38 TYR HB2 H 1 3.041 0.030 . 2 . . . . 38 TYR HB2 . 10106 1 438 . 1 1 38 38 TYR HB3 H 1 3.087 0.030 . 2 . . . . 38 TYR HB3 . 10106 1 439 . 1 1 38 38 TYR HD1 H 1 7.100 0.030 . 1 . . . . 38 TYR HD1 . 10106 1 440 . 1 1 38 38 TYR HD2 H 1 7.100 0.030 . 1 . . . . 38 TYR HD2 . 10106 1 441 . 1 1 38 38 TYR HE1 H 1 6.696 0.030 . 1 . . . . 38 TYR HE1 . 10106 1 442 . 1 1 38 38 TYR HE2 H 1 6.696 0.030 . 1 . . . . 38 TYR HE2 . 10106 1 443 . 1 1 38 38 TYR C C 13 177.961 0.300 . 1 . . . . 38 TYR C . 10106 1 444 . 1 1 38 38 TYR CA C 13 62.836 0.300 . 1 . . . . 38 TYR CA . 10106 1 445 . 1 1 38 38 TYR CB C 13 38.422 0.300 . 1 . . . . 38 TYR CB . 10106 1 446 . 1 1 38 38 TYR CD1 C 13 133.108 0.300 . 1 . . . . 38 TYR CD1 . 10106 1 447 . 1 1 38 38 TYR CD2 C 13 133.108 0.300 . 1 . . . . 38 TYR CD2 . 10106 1 448 . 1 1 38 38 TYR CE1 C 13 118.457 0.300 . 1 . . . . 38 TYR CE1 . 10106 1 449 . 1 1 38 38 TYR CE2 C 13 118.457 0.300 . 1 . . . . 38 TYR CE2 . 10106 1 450 . 1 1 38 38 TYR N N 15 118.791 0.300 . 1 . . . . 38 TYR N . 10106 1 451 . 1 1 39 39 ASP H H 1 7.974 0.030 . 1 . . . . 39 ASP H . 10106 1 452 . 1 1 39 39 ASP HA H 1 4.539 0.030 . 1 . . . . 39 ASP HA . 10106 1 453 . 1 1 39 39 ASP HB2 H 1 2.971 0.030 . 2 . . . . 39 ASP HB2 . 10106 1 454 . 1 1 39 39 ASP HB3 H 1 2.679 0.030 . 2 . . . . 39 ASP HB3 . 10106 1 455 . 1 1 39 39 ASP C C 13 180.430 0.300 . 1 . . . . 39 ASP C . 10106 1 456 . 1 1 39 39 ASP CA C 13 57.929 0.300 . 1 . . . . 39 ASP CA . 10106 1 457 . 1 1 39 39 ASP CB C 13 40.098 0.300 . 1 . . . . 39 ASP CB . 10106 1 458 . 1 1 39 39 ASP N N 15 122.919 0.300 . 1 . . . . 39 ASP N . 10106 1 459 . 1 1 40 40 VAL H H 1 9.204 0.030 . 1 . . . . 40 VAL H . 10106 1 460 . 1 1 40 40 VAL HA H 1 3.657 0.030 . 1 . . . . 40 VAL HA . 10106 1 461 . 1 1 40 40 VAL HB H 1 2.351 0.030 . 1 . . . . 40 VAL HB . 10106 1 462 . 1 1 40 40 VAL HG11 H 1 1.138 0.030 . 1 . . . . 40 VAL HG1 . 10106 1 463 . 1 1 40 40 VAL HG12 H 1 1.138 0.030 . 1 . . . . 40 VAL HG1 . 10106 1 464 . 1 1 40 40 VAL HG13 H 1 1.138 0.030 . 1 . . . . 40 VAL HG1 . 10106 1 465 . 1 1 40 40 VAL HG21 H 1 1.287 0.030 . 1 . . . . 40 VAL HG2 . 10106 1 466 . 1 1 40 40 VAL HG22 H 1 1.287 0.030 . 1 . . . . 40 VAL HG2 . 10106 1 467 . 1 1 40 40 VAL HG23 H 1 1.287 0.030 . 1 . . . . 40 VAL HG2 . 10106 1 468 . 1 1 40 40 VAL C C 13 178.146 0.300 . 1 . . . . 40 VAL C . 10106 1 469 . 1 1 40 40 VAL CA C 13 67.954 0.300 . 1 . . . . 40 VAL CA . 10106 1 470 . 1 1 40 40 VAL CB C 13 31.337 0.300 . 1 . . . . 40 VAL CB . 10106 1 471 . 1 1 40 40 VAL CG1 C 13 24.014 0.300 . 2 . . . . 40 VAL CG1 . 10106 1 472 . 1 1 40 40 VAL CG2 C 13 25.880 0.300 . 2 . . . . 40 VAL CG2 . 10106 1 473 . 1 1 40 40 VAL N N 15 123.323 0.300 . 1 . . . . 40 VAL N . 10106 1 474 . 1 1 41 41 SER H H 1 8.545 0.030 . 1 . . . . 41 SER H . 10106 1 475 . 1 1 41 41 SER HA H 1 4.070 0.030 . 1 . . . . 41 SER HA . 10106 1 476 . 1 1 41 41 SER HB2 H 1 4.217 0.030 . 2 . . . . 41 SER HB2 . 10106 1 477 . 1 1 41 41 SER HB3 H 1 4.121 0.030 . 2 . . . . 41 SER HB3 . 10106 1 478 . 1 1 41 41 SER C C 13 176.880 0.300 . 1 . . . . 41 SER C . 10106 1 479 . 1 1 41 41 SER CA C 13 62.846 0.300 . 1 . . . . 41 SER CA . 10106 1 480 . 1 1 41 41 SER CB C 13 62.836 0.300 . 1 . . . . 41 SER CB . 10106 1 481 . 1 1 41 41 SER N N 15 117.061 0.300 . 1 . . . . 41 SER N . 10106 1 482 . 1 1 42 42 ASP H H 1 8.015 0.030 . 1 . . . . 42 ASP H . 10106 1 483 . 1 1 42 42 ASP HA H 1 4.539 0.030 . 1 . . . . 42 ASP HA . 10106 1 484 . 1 1 42 42 ASP HB2 H 1 2.721 0.030 . 2 . . . . 42 ASP HB2 . 10106 1 485 . 1 1 42 42 ASP HB3 H 1 2.849 0.030 . 2 . . . . 42 ASP HB3 . 10106 1 486 . 1 1 42 42 ASP C C 13 177.898 0.300 . 1 . . . . 42 ASP C . 10106 1 487 . 1 1 42 42 ASP CA C 13 57.752 0.300 . 1 . . . . 42 ASP CA . 10106 1 488 . 1 1 42 42 ASP CB C 13 41.757 0.300 . 1 . . . . 42 ASP CB . 10106 1 489 . 1 1 42 42 ASP N N 15 123.207 0.300 . 1 . . . . 42 ASP N . 10106 1 490 . 1 1 43 43 THR H H 1 8.341 0.030 . 1 . . . . 43 THR H . 10106 1 491 . 1 1 43 43 THR HA H 1 3.986 0.030 . 1 . . . . 43 THR HA . 10106 1 492 . 1 1 43 43 THR HB H 1 4.647 0.030 . 1 . . . . 43 THR HB . 10106 1 493 . 1 1 43 43 THR HG21 H 1 1.198 0.030 . 1 . . . . 43 THR HG2 . 10106 1 494 . 1 1 43 43 THR HG22 H 1 1.198 0.030 . 1 . . . . 43 THR HG2 . 10106 1 495 . 1 1 43 43 THR HG23 H 1 1.198 0.030 . 1 . . . . 43 THR HG2 . 10106 1 496 . 1 1 43 43 THR C C 13 177.457 0.300 . 1 . . . . 43 THR C . 10106 1 497 . 1 1 43 43 THR CA C 13 67.551 0.300 . 1 . . . . 43 THR CA . 10106 1 498 . 1 1 43 43 THR CB C 13 68.695 0.300 . 1 . . . . 43 THR CB . 10106 1 499 . 1 1 43 43 THR CG2 C 13 21.355 0.300 . 1 . . . . 43 THR CG2 . 10106 1 500 . 1 1 43 43 THR N N 15 118.341 0.300 . 1 . . . . 43 THR N . 10106 1 501 . 1 1 44 44 ILE H H 1 8.721 0.030 . 1 . . . . 44 ILE H . 10106 1 502 . 1 1 44 44 ILE HA H 1 3.814 0.030 . 1 . . . . 44 ILE HA . 10106 1 503 . 1 1 44 44 ILE HB H 1 2.067 0.030 . 1 . . . . 44 ILE HB . 10106 1 504 . 1 1 44 44 ILE HG12 H 1 0.799 0.030 . 2 . . . . 44 ILE HG12 . 10106 1 505 . 1 1 44 44 ILE HG13 H 1 1.967 0.030 . 2 . . . . 44 ILE HG13 . 10106 1 506 . 1 1 44 44 ILE HG21 H 1 1.057 0.030 . 1 . . . . 44 ILE HG2 . 10106 1 507 . 1 1 44 44 ILE HG22 H 1 1.057 0.030 . 1 . . . . 44 ILE HG2 . 10106 1 508 . 1 1 44 44 ILE HG23 H 1 1.057 0.030 . 1 . . . . 44 ILE HG2 . 10106 1 509 . 1 1 44 44 ILE HD11 H 1 0.601 0.030 . 1 . . . . 44 ILE HD1 . 10106 1 510 . 1 1 44 44 ILE HD12 H 1 0.601 0.030 . 1 . . . . 44 ILE HD1 . 10106 1 511 . 1 1 44 44 ILE HD13 H 1 0.601 0.030 . 1 . . . . 44 ILE HD1 . 10106 1 512 . 1 1 44 44 ILE C C 13 176.855 0.300 . 1 . . . . 44 ILE C . 10106 1 513 . 1 1 44 44 ILE CA C 13 66.587 0.300 . 1 . . . . 44 ILE CA . 10106 1 514 . 1 1 44 44 ILE CB C 13 37.544 0.300 . 1 . . . . 44 ILE CB . 10106 1 515 . 1 1 44 44 ILE CG1 C 13 31.105 0.300 . 1 . . . . 44 ILE CG1 . 10106 1 516 . 1 1 44 44 ILE CG2 C 13 17.812 0.300 . 1 . . . . 44 ILE CG2 . 10106 1 517 . 1 1 44 44 ILE CD1 C 13 15.133 0.300 . 1 . . . . 44 ILE CD1 . 10106 1 518 . 1 1 44 44 ILE N N 15 123.123 0.300 . 1 . . . . 44 ILE N . 10106 1 519 . 1 1 45 45 ALA H H 1 8.680 0.030 . 1 . . . . 45 ALA H . 10106 1 520 . 1 1 45 45 ALA HA H 1 4.128 0.030 . 1 . . . . 45 ALA HA . 10106 1 521 . 1 1 45 45 ALA HB1 H 1 1.718 0.030 . 1 . . . . 45 ALA HB . 10106 1 522 . 1 1 45 45 ALA HB2 H 1 1.718 0.030 . 1 . . . . 45 ALA HB . 10106 1 523 . 1 1 45 45 ALA HB3 H 1 1.718 0.030 . 1 . . . . 45 ALA HB . 10106 1 524 . 1 1 45 45 ALA C C 13 181.273 0.300 . 1 . . . . 45 ALA C . 10106 1 525 . 1 1 45 45 ALA CA C 13 56.333 0.300 . 1 . . . . 45 ALA CA . 10106 1 526 . 1 1 45 45 ALA CB C 13 18.017 0.300 . 1 . . . . 45 ALA CB . 10106 1 527 . 1 1 45 45 ALA N N 15 124.839 0.300 . 1 . . . . 45 ALA N . 10106 1 528 . 1 1 46 46 LYS H H 1 8.400 0.030 . 1 . . . . 46 LYS H . 10106 1 529 . 1 1 46 46 LYS HA H 1 4.116 0.030 . 1 . . . . 46 LYS HA . 10106 1 530 . 1 1 46 46 LYS HB2 H 1 2.006 0.030 . 1 . . . . 46 LYS HB2 . 10106 1 531 . 1 1 46 46 LYS HB3 H 1 2.006 0.030 . 1 . . . . 46 LYS HB3 . 10106 1 532 . 1 1 46 46 LYS HG2 H 1 1.720 0.030 . 2 . . . . 46 LYS HG2 . 10106 1 533 . 1 1 46 46 LYS HG3 H 1 1.533 0.030 . 2 . . . . 46 LYS HG3 . 10106 1 534 . 1 1 46 46 LYS HD2 H 1 1.673 0.030 . 2 . . . . 46 LYS HD2 . 10106 1 535 . 1 1 46 46 LYS HD3 H 1 1.740 0.030 . 2 . . . . 46 LYS HD3 . 10106 1 536 . 1 1 46 46 LYS HE2 H 1 3.012 0.030 . 1 . . . . 46 LYS HE2 . 10106 1 537 . 1 1 46 46 LYS HE3 H 1 3.012 0.030 . 1 . . . . 46 LYS HE3 . 10106 1 538 . 1 1 46 46 LYS C C 13 178.768 0.300 . 1 . . . . 46 LYS C . 10106 1 539 . 1 1 46 46 LYS CA C 13 59.751 0.300 . 1 . . . . 46 LYS CA . 10106 1 540 . 1 1 46 46 LYS CB C 13 32.490 0.300 . 1 . . . . 46 LYS CB . 10106 1 541 . 1 1 46 46 LYS CG C 13 26.454 0.300 . 1 . . . . 46 LYS CG . 10106 1 542 . 1 1 46 46 LYS CD C 13 28.971 0.300 . 1 . . . . 46 LYS CD . 10106 1 543 . 1 1 46 46 LYS CE C 13 42.316 0.300 . 1 . . . . 46 LYS CE . 10106 1 544 . 1 1 46 46 LYS N N 15 118.941 0.300 . 1 . . . . 46 LYS N . 10106 1 545 . 1 1 47 47 TYR H H 1 8.279 0.030 . 1 . . . . 47 TYR H . 10106 1 546 . 1 1 47 47 TYR HA H 1 4.252 0.030 . 1 . . . . 47 TYR HA . 10106 1 547 . 1 1 47 47 TYR HB2 H 1 3.565 0.030 . 2 . . . . 47 TYR HB2 . 10106 1 548 . 1 1 47 47 TYR HB3 H 1 3.233 0.030 . 2 . . . . 47 TYR HB3 . 10106 1 549 . 1 1 47 47 TYR HD1 H 1 7.059 0.030 . 1 . . . . 47 TYR HD1 . 10106 1 550 . 1 1 47 47 TYR HD2 H 1 7.059 0.030 . 1 . . . . 47 TYR HD2 . 10106 1 551 . 1 1 47 47 TYR HE1 H 1 6.967 0.030 . 1 . . . . 47 TYR HE1 . 10106 1 552 . 1 1 47 47 TYR HE2 H 1 6.967 0.030 . 1 . . . . 47 TYR HE2 . 10106 1 553 . 1 1 47 47 TYR C C 13 176.546 0.300 . 1 . . . . 47 TYR C . 10106 1 554 . 1 1 47 47 TYR CA C 13 62.396 0.300 . 1 . . . . 47 TYR CA . 10106 1 555 . 1 1 47 47 TYR CB C 13 39.328 0.300 . 1 . . . . 47 TYR CB . 10106 1 556 . 1 1 47 47 TYR CD1 C 13 132.735 0.300 . 1 . . . . 47 TYR CD1 . 10106 1 557 . 1 1 47 47 TYR CD2 C 13 132.735 0.300 . 1 . . . . 47 TYR CD2 . 10106 1 558 . 1 1 47 47 TYR CE1 C 13 118.820 0.300 . 1 . . . . 47 TYR CE1 . 10106 1 559 . 1 1 47 47 TYR CE2 C 13 118.820 0.300 . 1 . . . . 47 TYR CE2 . 10106 1 560 . 1 1 47 47 TYR N N 15 124.104 0.300 . 1 . . . . 47 TYR N . 10106 1 561 . 1 1 48 48 ILE H H 1 8.866 0.030 . 1 . . . . 48 ILE H . 10106 1 562 . 1 1 48 48 ILE HA H 1 3.418 0.030 . 1 . . . . 48 ILE HA . 10106 1 563 . 1 1 48 48 ILE HB H 1 2.122 0.030 . 1 . . . . 48 ILE HB . 10106 1 564 . 1 1 48 48 ILE HG12 H 1 1.036 0.030 . 2 . . . . 48 ILE HG12 . 10106 1 565 . 1 1 48 48 ILE HG13 H 1 2.141 0.030 . 2 . . . . 48 ILE HG13 . 10106 1 566 . 1 1 48 48 ILE HG21 H 1 0.870 0.030 . 1 . . . . 48 ILE HG2 . 10106 1 567 . 1 1 48 48 ILE HG22 H 1 0.870 0.030 . 1 . . . . 48 ILE HG2 . 10106 1 568 . 1 1 48 48 ILE HG23 H 1 0.870 0.030 . 1 . . . . 48 ILE HG2 . 10106 1 569 . 1 1 48 48 ILE HD11 H 1 0.928 0.030 . 1 . . . . 48 ILE HD1 . 10106 1 570 . 1 1 48 48 ILE HD12 H 1 0.928 0.030 . 1 . . . . 48 ILE HD1 . 10106 1 571 . 1 1 48 48 ILE HD13 H 1 0.928 0.030 . 1 . . . . 48 ILE HD1 . 10106 1 572 . 1 1 48 48 ILE C C 13 178.232 0.300 . 1 . . . . 48 ILE C . 10106 1 573 . 1 1 48 48 ILE CA C 13 65.935 0.300 . 1 . . . . 48 ILE CA . 10106 1 574 . 1 1 48 48 ILE CB C 13 38.654 0.300 . 1 . . . . 48 ILE CB . 10106 1 575 . 1 1 48 48 ILE CG1 C 13 30.622 0.300 . 1 . . . . 48 ILE CG1 . 10106 1 576 . 1 1 48 48 ILE CG2 C 13 18.029 0.300 . 1 . . . . 48 ILE CG2 . 10106 1 577 . 1 1 48 48 ILE CD1 C 13 15.355 0.300 . 1 . . . . 48 ILE CD1 . 10106 1 578 . 1 1 48 48 ILE N N 15 118.798 0.300 . 1 . . . . 48 ILE N . 10106 1 579 . 1 1 49 49 SER H H 1 7.667 0.030 . 1 . . . . 49 SER H . 10106 1 580 . 1 1 49 49 SER HA H 1 4.284 0.030 . 1 . . . . 49 SER HA . 10106 1 581 . 1 1 49 49 SER HB2 H 1 4.005 0.030 . 1 . . . . 49 SER HB2 . 10106 1 582 . 1 1 49 49 SER HB3 H 1 4.005 0.030 . 1 . . . . 49 SER HB3 . 10106 1 583 . 1 1 49 49 SER C C 13 177.054 0.300 . 1 . . . . 49 SER C . 10106 1 584 . 1 1 49 49 SER CA C 13 61.425 0.300 . 1 . . . . 49 SER CA . 10106 1 585 . 1 1 49 49 SER CB C 13 63.050 0.300 . 1 . . . . 49 SER CB . 10106 1 586 . 1 1 49 49 SER N N 15 112.883 0.300 . 1 . . . . 49 SER N . 10106 1 587 . 1 1 50 50 LYS H H 1 8.503 0.030 . 1 . . . . 50 LYS H . 10106 1 588 . 1 1 50 50 LYS HA H 1 4.054 0.030 . 1 . . . . 50 LYS HA . 10106 1 589 . 1 1 50 50 LYS HB2 H 1 1.900 0.030 . 2 . . . . 50 LYS HB2 . 10106 1 590 . 1 1 50 50 LYS HB3 H 1 1.996 0.030 . 2 . . . . 50 LYS HB3 . 10106 1 591 . 1 1 50 50 LYS HG2 H 1 1.469 0.030 . 1 . . . . 50 LYS HG2 . 10106 1 592 . 1 1 50 50 LYS HG3 H 1 1.469 0.030 . 1 . . . . 50 LYS HG3 . 10106 1 593 . 1 1 50 50 LYS HD2 H 1 1.733 0.030 . 1 . . . . 50 LYS HD2 . 10106 1 594 . 1 1 50 50 LYS HD3 H 1 1.733 0.030 . 1 . . . . 50 LYS HD3 . 10106 1 595 . 1 1 50 50 LYS HE2 H 1 3.012 0.030 . 1 . . . . 50 LYS HE2 . 10106 1 596 . 1 1 50 50 LYS HE3 H 1 3.012 0.030 . 1 . . . . 50 LYS HE3 . 10106 1 597 . 1 1 50 50 LYS C C 13 178.791 0.300 . 1 . . . . 50 LYS C . 10106 1 598 . 1 1 50 50 LYS CA C 13 59.289 0.300 . 1 . . . . 50 LYS CA . 10106 1 599 . 1 1 50 50 LYS CB C 13 32.655 0.300 . 1 . . . . 50 LYS CB . 10106 1 600 . 1 1 50 50 LYS CG C 13 24.678 0.300 . 1 . . . . 50 LYS CG . 10106 1 601 . 1 1 50 50 LYS CD C 13 29.135 0.300 . 1 . . . . 50 LYS CD . 10106 1 602 . 1 1 50 50 LYS CE C 13 42.316 0.300 . 1 . . . . 50 LYS CE . 10106 1 603 . 1 1 50 50 LYS N N 15 123.498 0.300 . 1 . . . . 50 LYS N . 10106 1 604 . 1 1 51 51 GLU H H 1 8.290 0.030 . 1 . . . . 51 GLU H . 10106 1 605 . 1 1 51 51 GLU HA H 1 4.072 0.030 . 1 . . . . 51 GLU HA . 10106 1 606 . 1 1 51 51 GLU HB2 H 1 2.101 0.030 . 2 . . . . 51 GLU HB2 . 10106 1 607 . 1 1 51 51 GLU HB3 H 1 1.375 0.030 . 2 . . . . 51 GLU HB3 . 10106 1 608 . 1 1 51 51 GLU HG2 H 1 1.626 0.030 . 2 . . . . 51 GLU HG2 . 10106 1 609 . 1 1 51 51 GLU HG3 H 1 1.452 0.030 . 2 . . . . 51 GLU HG3 . 10106 1 610 . 1 1 51 51 GLU C C 13 176.806 0.300 . 1 . . . . 51 GLU C . 10106 1 611 . 1 1 51 51 GLU CA C 13 55.745 0.300 . 1 . . . . 51 GLU CA . 10106 1 612 . 1 1 51 51 GLU CB C 13 29.320 0.300 . 1 . . . . 51 GLU CB . 10106 1 613 . 1 1 51 51 GLU CG C 13 35.702 0.300 . 1 . . . . 51 GLU CG . 10106 1 614 . 1 1 51 51 GLU N N 15 114.591 0.300 . 1 . . . . 51 GLU N . 10106 1 615 . 1 1 52 52 GLY H H 1 7.544 0.030 . 1 . . . . 52 GLY H . 10106 1 616 . 1 1 52 52 GLY HA2 H 1 4.108 0.030 . 2 . . . . 52 GLY HA2 . 10106 1 617 . 1 1 52 52 GLY HA3 H 1 3.917 0.030 . 2 . . . . 52 GLY HA3 . 10106 1 618 . 1 1 52 52 GLY C C 13 176.632 0.300 . 1 . . . . 52 GLY C . 10106 1 619 . 1 1 52 52 GLY CA C 13 47.743 0.300 . 1 . . . . 52 GLY CA . 10106 1 620 . 1 1 52 52 GLY N N 15 108.747 0.300 . 1 . . . . 52 GLY N . 10106 1 621 . 1 1 53 53 LEU H H 1 7.646 0.030 . 1 . . . . 53 LEU H . 10106 1 622 . 1 1 53 53 LEU HA H 1 4.451 0.030 . 1 . . . . 53 LEU HA . 10106 1 623 . 1 1 53 53 LEU HB2 H 1 2.298 0.030 . 2 . . . . 53 LEU HB2 . 10106 1 624 . 1 1 53 53 LEU HB3 H 1 1.485 0.030 . 2 . . . . 53 LEU HB3 . 10106 1 625 . 1 1 53 53 LEU HG H 1 1.485 0.030 . 1 . . . . 53 LEU HG . 10106 1 626 . 1 1 53 53 LEU HD11 H 1 0.905 0.030 . 1 . . . . 53 LEU HD1 . 10106 1 627 . 1 1 53 53 LEU HD12 H 1 0.905 0.030 . 1 . . . . 53 LEU HD1 . 10106 1 628 . 1 1 53 53 LEU HD13 H 1 0.905 0.030 . 1 . . . . 53 LEU HD1 . 10106 1 629 . 1 1 53 53 LEU HD21 H 1 0.977 0.030 . 1 . . . . 53 LEU HD2 . 10106 1 630 . 1 1 53 53 LEU HD22 H 1 0.977 0.030 . 1 . . . . 53 LEU HD2 . 10106 1 631 . 1 1 53 53 LEU HD23 H 1 0.977 0.030 . 1 . . . . 53 LEU HD2 . 10106 1 632 . 1 1 53 53 LEU C C 13 176.236 0.300 . 1 . . . . 53 LEU C . 10106 1 633 . 1 1 53 53 LEU CA C 13 54.588 0.300 . 1 . . . . 53 LEU CA . 10106 1 634 . 1 1 53 53 LEU CB C 13 41.542 0.300 . 1 . . . . 53 LEU CB . 10106 1 635 . 1 1 53 53 LEU CG C 13 26.897 0.300 . 1 . . . . 53 LEU CG . 10106 1 636 . 1 1 53 53 LEU CD1 C 13 21.823 0.300 . 2 . . . . 53 LEU CD1 . 10106 1 637 . 1 1 53 53 LEU CD2 C 13 27.125 0.300 . 2 . . . . 53 LEU CD2 . 10106 1 638 . 1 1 53 53 LEU N N 15 115.384 0.300 . 1 . . . . 53 LEU N . 10106 1 639 . 1 1 54 54 LEU H H 1 7.848 0.030 . 1 . . . . 54 LEU H . 10106 1 640 . 1 1 54 54 LEU HA H 1 4.504 0.030 . 1 . . . . 54 LEU HA . 10106 1 641 . 1 1 54 54 LEU HB2 H 1 1.719 0.030 . 2 . . . . 54 LEU HB2 . 10106 1 642 . 1 1 54 54 LEU HB3 H 1 1.335 0.030 . 2 . . . . 54 LEU HB3 . 10106 1 643 . 1 1 54 54 LEU HG H 1 1.666 0.030 . 1 . . . . 54 LEU HG . 10106 1 644 . 1 1 54 54 LEU HD11 H 1 0.802 0.030 . 1 . . . . 54 LEU HD1 . 10106 1 645 . 1 1 54 54 LEU HD12 H 1 0.802 0.030 . 1 . . . . 54 LEU HD1 . 10106 1 646 . 1 1 54 54 LEU HD13 H 1 0.802 0.030 . 1 . . . . 54 LEU HD1 . 10106 1 647 . 1 1 54 54 LEU HD21 H 1 0.952 0.030 . 1 . . . . 54 LEU HD2 . 10106 1 648 . 1 1 54 54 LEU HD22 H 1 0.952 0.030 . 1 . . . . 54 LEU HD2 . 10106 1 649 . 1 1 54 54 LEU HD23 H 1 0.952 0.030 . 1 . . . . 54 LEU HD2 . 10106 1 650 . 1 1 54 54 LEU C C 13 177.947 0.300 . 1 . . . . 54 LEU C . 10106 1 651 . 1 1 54 54 LEU CA C 13 55.293 0.300 . 1 . . . . 54 LEU CA . 10106 1 652 . 1 1 54 54 LEU CB C 13 41.548 0.300 . 1 . . . . 54 LEU CB . 10106 1 653 . 1 1 54 54 LEU CG C 13 27.115 0.300 . 1 . . . . 54 LEU CG . 10106 1 654 . 1 1 54 54 LEU CD1 C 13 23.287 0.300 . 2 . . . . 54 LEU CD1 . 10106 1 655 . 1 1 54 54 LEU CD2 C 13 25.099 0.300 . 2 . . . . 54 LEU CD2 . 10106 1 656 . 1 1 54 54 LEU N N 15 118.522 0.300 . 1 . . . . 54 LEU N . 10106 1 657 . 1 1 55 55 ASP H H 1 8.542 0.030 . 1 . . . . 55 ASP H . 10106 1 658 . 1 1 55 55 ASP HA H 1 4.470 0.030 . 1 . . . . 55 ASP HA . 10106 1 659 . 1 1 55 55 ASP HB2 H 1 3.577 0.030 . 2 . . . . 55 ASP HB2 . 10106 1 660 . 1 1 55 55 ASP HB3 H 1 2.109 0.030 . 2 . . . . 55 ASP HB3 . 10106 1 661 . 1 1 55 55 ASP C C 13 175.787 0.300 . 1 . . . . 55 ASP C . 10106 1 662 . 1 1 55 55 ASP CA C 13 51.875 0.300 . 1 . . . . 55 ASP CA . 10106 1 663 . 1 1 55 55 ASP CB C 13 41.894 0.300 . 1 . . . . 55 ASP CB . 10106 1 664 . 1 1 55 55 ASP N N 15 126.901 0.300 . 1 . . . . 55 ASP N . 10106 1 665 . 1 1 56 56 PRO HA H 1 4.263 0.030 . 1 . . . . 56 PRO HA . 10106 1 666 . 1 1 56 56 PRO HB2 H 1 2.364 0.030 . 2 . . . . 56 PRO HB2 . 10106 1 667 . 1 1 56 56 PRO HB3 H 1 1.991 0.030 . 2 . . . . 56 PRO HB3 . 10106 1 668 . 1 1 56 56 PRO HG2 H 1 2.059 0.030 . 1 . . . . 56 PRO HG2 . 10106 1 669 . 1 1 56 56 PRO HG3 H 1 2.059 0.030 . 1 . . . . 56 PRO HG3 . 10106 1 670 . 1 1 56 56 PRO HD2 H 1 4.029 0.030 . 2 . . . . 56 PRO HD2 . 10106 1 671 . 1 1 56 56 PRO HD3 H 1 3.871 0.030 . 2 . . . . 56 PRO HD3 . 10106 1 672 . 1 1 56 56 PRO C C 13 178.190 0.300 . 1 . . . . 56 PRO C . 10106 1 673 . 1 1 56 56 PRO CA C 13 64.607 0.300 . 1 . . . . 56 PRO CA . 10106 1 674 . 1 1 56 56 PRO CB C 13 32.093 0.300 . 1 . . . . 56 PRO CB . 10106 1 675 . 1 1 56 56 PRO CG C 13 27.329 0.300 . 1 . . . . 56 PRO CG . 10106 1 676 . 1 1 56 56 PRO CD C 13 50.781 0.300 . 1 . . . . 56 PRO CD . 10106 1 677 . 1 1 57 57 SER H H 1 8.758 0.030 . 1 . . . . 57 SER H . 10106 1 678 . 1 1 57 57 SER HA H 1 4.496 0.030 . 1 . . . . 57 SER HA . 10106 1 679 . 1 1 57 57 SER HB2 H 1 3.870 0.030 . 2 . . . . 57 SER HB2 . 10106 1 680 . 1 1 57 57 SER HB3 H 1 3.921 0.030 . 2 . . . . 57 SER HB3 . 10106 1 681 . 1 1 57 57 SER C C 13 174.523 0.300 . 1 . . . . 57 SER C . 10106 1 682 . 1 1 57 57 SER CA C 13 58.738 0.300 . 1 . . . . 57 SER CA . 10106 1 683 . 1 1 57 57 SER CB C 13 64.583 0.300 . 1 . . . . 57 SER CB . 10106 1 684 . 1 1 57 57 SER N N 15 113.090 0.300 . 1 . . . . 57 SER N . 10106 1 685 . 1 1 58 58 ASN H H 1 7.679 0.030 . 1 . . . . 58 ASN H . 10106 1 686 . 1 1 58 58 ASN HA H 1 4.629 0.030 . 1 . . . . 58 ASN HA . 10106 1 687 . 1 1 58 58 ASN HB2 H 1 2.874 0.030 . 2 . . . . 58 ASN HB2 . 10106 1 688 . 1 1 58 58 ASN HB3 H 1 2.758 0.030 . 2 . . . . 58 ASN HB3 . 10106 1 689 . 1 1 58 58 ASN HD21 H 1 7.034 0.030 . 2 . . . . 58 ASN HD21 . 10106 1 690 . 1 1 58 58 ASN HD22 H 1 7.791 0.030 . 2 . . . . 58 ASN HD22 . 10106 1 691 . 1 1 58 58 ASN C C 13 174.503 0.300 . 1 . . . . 58 ASN C . 10106 1 692 . 1 1 58 58 ASN CA C 13 53.144 0.300 . 1 . . . . 58 ASN CA . 10106 1 693 . 1 1 58 58 ASN CB C 13 37.859 0.300 . 1 . . . . 58 ASN CB . 10106 1 694 . 1 1 58 58 ASN N N 15 119.091 0.300 . 1 . . . . 58 ASN N . 10106 1 695 . 1 1 58 58 ASN ND2 N 15 110.715 0.300 . 1 . . . . 58 ASN ND2 . 10106 1 696 . 1 1 59 59 LYS H H 1 8.797 0.030 . 1 . . . . 59 LYS H . 10106 1 697 . 1 1 59 59 LYS HA H 1 4.293 0.030 . 1 . . . . 59 LYS HA . 10106 1 698 . 1 1 59 59 LYS HB2 H 1 2.060 0.030 . 2 . . . . 59 LYS HB2 . 10106 1 699 . 1 1 59 59 LYS HB3 H 1 1.848 0.030 . 2 . . . . 59 LYS HB3 . 10106 1 700 . 1 1 59 59 LYS HG2 H 1 1.493 0.030 . 2 . . . . 59 LYS HG2 . 10106 1 701 . 1 1 59 59 LYS HG3 H 1 1.548 0.030 . 2 . . . . 59 LYS HG3 . 10106 1 702 . 1 1 59 59 LYS HD2 H 1 1.666 0.030 . 2 . . . . 59 LYS HD2 . 10106 1 703 . 1 1 59 59 LYS HD3 H 1 1.722 0.030 . 2 . . . . 59 LYS HD3 . 10106 1 704 . 1 1 59 59 LYS HE2 H 1 3.012 0.030 . 1 . . . . 59 LYS HE2 . 10106 1 705 . 1 1 59 59 LYS HE3 H 1 3.012 0.030 . 1 . . . . 59 LYS HE3 . 10106 1 706 . 1 1 59 59 LYS C C 13 176.160 0.300 . 1 . . . . 59 LYS C . 10106 1 707 . 1 1 59 59 LYS CA C 13 58.401 0.300 . 1 . . . . 59 LYS CA . 10106 1 708 . 1 1 59 59 LYS CB C 13 31.776 0.300 . 1 . . . . 59 LYS CB . 10106 1 709 . 1 1 59 59 LYS CG C 13 25.346 0.300 . 1 . . . . 59 LYS CG . 10106 1 710 . 1 1 59 59 LYS CD C 13 29.218 0.300 . 1 . . . . 59 LYS CD . 10106 1 711 . 1 1 59 59 LYS CE C 13 42.203 0.300 . 1 . . . . 59 LYS CE . 10106 1 712 . 1 1 59 59 LYS N N 15 122.687 0.300 . 1 . . . . 59 LYS N . 10106 1 713 . 1 1 60 60 LYS H H 1 7.842 0.030 . 1 . . . . 60 LYS H . 10106 1 714 . 1 1 60 60 LYS HA H 1 4.361 0.030 . 1 . . . . 60 LYS HA . 10106 1 715 . 1 1 60 60 LYS HB2 H 1 2.096 0.030 . 2 . . . . 60 LYS HB2 . 10106 1 716 . 1 1 60 60 LYS HB3 H 1 1.980 0.030 . 2 . . . . 60 LYS HB3 . 10106 1 717 . 1 1 60 60 LYS HG2 H 1 1.521 0.030 . 2 . . . . 60 LYS HG2 . 10106 1 718 . 1 1 60 60 LYS HG3 H 1 1.648 0.030 . 2 . . . . 60 LYS HG3 . 10106 1 719 . 1 1 60 60 LYS HD2 H 1 1.780 0.030 . 1 . . . . 60 LYS HD2 . 10106 1 720 . 1 1 60 60 LYS HD3 H 1 1.780 0.030 . 1 . . . . 60 LYS HD3 . 10106 1 721 . 1 1 60 60 LYS HE2 H 1 3.052 0.030 . 1 . . . . 60 LYS HE2 . 10106 1 722 . 1 1 60 60 LYS HE3 H 1 3.052 0.030 . 1 . . . . 60 LYS HE3 . 10106 1 723 . 1 1 60 60 LYS C C 13 177.377 0.300 . 1 . . . . 60 LYS C . 10106 1 724 . 1 1 60 60 LYS CA C 13 57.495 0.300 . 1 . . . . 60 LYS CA . 10106 1 725 . 1 1 60 60 LYS CB C 13 33.110 0.300 . 1 . . . . 60 LYS CB . 10106 1 726 . 1 1 60 60 LYS CG C 13 25.996 0.300 . 1 . . . . 60 LYS CG . 10106 1 727 . 1 1 60 60 LYS CD C 13 29.340 0.300 . 1 . . . . 60 LYS CD . 10106 1 728 . 1 1 60 60 LYS CE C 13 42.262 0.300 . 1 . . . . 60 LYS CE . 10106 1 729 . 1 1 60 60 LYS N N 15 115.130 0.300 . 1 . . . . 60 LYS N . 10106 1 730 . 1 1 61 61 LYS H H 1 8.591 0.030 . 1 . . . . 61 LYS H . 10106 1 731 . 1 1 61 61 LYS HA H 1 4.744 0.030 . 1 . . . . 61 LYS HA . 10106 1 732 . 1 1 61 61 LYS HB2 H 1 1.783 0.030 . 2 . . . . 61 LYS HB2 . 10106 1 733 . 1 1 61 61 LYS HB3 H 1 1.656 0.030 . 2 . . . . 61 LYS HB3 . 10106 1 734 . 1 1 61 61 LYS HG2 H 1 0.653 0.030 . 2 . . . . 61 LYS HG2 . 10106 1 735 . 1 1 61 61 LYS HG3 H 1 1.065 0.030 . 2 . . . . 61 LYS HG3 . 10106 1 736 . 1 1 61 61 LYS HD2 H 1 1.350 0.030 . 2 . . . . 61 LYS HD2 . 10106 1 737 . 1 1 61 61 LYS HD3 H 1 1.414 0.030 . 2 . . . . 61 LYS HD3 . 10106 1 738 . 1 1 61 61 LYS HE2 H 1 2.538 0.030 . 2 . . . . 61 LYS HE2 . 10106 1 739 . 1 1 61 61 LYS HE3 H 1 2.387 0.030 . 2 . . . . 61 LYS HE3 . 10106 1 740 . 1 1 61 61 LYS C C 13 173.233 0.300 . 1 . . . . 61 LYS C . 10106 1 741 . 1 1 61 61 LYS CA C 13 55.575 0.300 . 1 . . . . 61 LYS CA . 10106 1 742 . 1 1 61 61 LYS CB C 13 35.333 0.300 . 1 . . . . 61 LYS CB . 10106 1 743 . 1 1 61 61 LYS CG C 13 25.346 0.300 . 1 . . . . 61 LYS CG . 10106 1 744 . 1 1 61 61 LYS CD C 13 29.135 0.300 . 1 . . . . 61 LYS CD . 10106 1 745 . 1 1 61 61 LYS CE C 13 41.538 0.300 . 1 . . . . 61 LYS CE . 10106 1 746 . 1 1 61 61 LYS N N 15 121.550 0.300 . 1 . . . . 61 LYS N . 10106 1 747 . 1 1 62 62 VAL H H 1 8.772 0.030 . 1 . . . . 62 VAL H . 10106 1 748 . 1 1 62 62 VAL HA H 1 4.280 0.030 . 1 . . . . 62 VAL HA . 10106 1 749 . 1 1 62 62 VAL HB H 1 1.891 0.030 . 1 . . . . 62 VAL HB . 10106 1 750 . 1 1 62 62 VAL HG11 H 1 0.772 0.030 . 1 . . . . 62 VAL HG1 . 10106 1 751 . 1 1 62 62 VAL HG12 H 1 0.772 0.030 . 1 . . . . 62 VAL HG1 . 10106 1 752 . 1 1 62 62 VAL HG13 H 1 0.772 0.030 . 1 . . . . 62 VAL HG1 . 10106 1 753 . 1 1 62 62 VAL HG21 H 1 0.711 0.030 . 1 . . . . 62 VAL HG2 . 10106 1 754 . 1 1 62 62 VAL HG22 H 1 0.711 0.030 . 1 . . . . 62 VAL HG2 . 10106 1 755 . 1 1 62 62 VAL HG23 H 1 0.711 0.030 . 1 . . . . 62 VAL HG2 . 10106 1 756 . 1 1 62 62 VAL C C 13 175.292 0.300 . 1 . . . . 62 VAL C . 10106 1 757 . 1 1 62 62 VAL CA C 13 60.393 0.300 . 1 . . . . 62 VAL CA . 10106 1 758 . 1 1 62 62 VAL CB C 13 34.613 0.300 . 1 . . . . 62 VAL CB . 10106 1 759 . 1 1 62 62 VAL CG1 C 13 22.068 0.300 . 2 . . . . 62 VAL CG1 . 10106 1 760 . 1 1 62 62 VAL CG2 C 13 21.014 0.300 . 2 . . . . 62 VAL CG2 . 10106 1 761 . 1 1 62 62 VAL N N 15 121.393 0.300 . 1 . . . . 62 VAL N . 10106 1 762 . 1 1 63 63 VAL H H 1 8.803 0.030 . 1 . . . . 63 VAL H . 10106 1 763 . 1 1 63 63 VAL HA H 1 4.182 0.030 . 1 . . . . 63 VAL HA . 10106 1 764 . 1 1 63 63 VAL HB H 1 2.134 0.030 . 1 . . . . 63 VAL HB . 10106 1 765 . 1 1 63 63 VAL HG11 H 1 0.921 0.030 . 1 . . . . 63 VAL HG1 . 10106 1 766 . 1 1 63 63 VAL HG12 H 1 0.921 0.030 . 1 . . . . 63 VAL HG1 . 10106 1 767 . 1 1 63 63 VAL HG13 H 1 0.921 0.030 . 1 . . . . 63 VAL HG1 . 10106 1 768 . 1 1 63 63 VAL HG21 H 1 0.915 0.030 . 1 . . . . 63 VAL HG2 . 10106 1 769 . 1 1 63 63 VAL HG22 H 1 0.915 0.030 . 1 . . . . 63 VAL HG2 . 10106 1 770 . 1 1 63 63 VAL HG23 H 1 0.915 0.030 . 1 . . . . 63 VAL HG2 . 10106 1 771 . 1 1 63 63 VAL C C 13 175.285 0.300 . 1 . . . . 63 VAL C . 10106 1 772 . 1 1 63 63 VAL CA C 13 61.681 0.300 . 1 . . . . 63 VAL CA . 10106 1 773 . 1 1 63 63 VAL CB C 13 30.390 0.300 . 1 . . . . 63 VAL CB . 10106 1 774 . 1 1 63 63 VAL CG1 C 13 21.643 0.300 . 2 . . . . 63 VAL CG1 . 10106 1 775 . 1 1 63 63 VAL CG2 C 13 20.092 0.300 . 2 . . . . 63 VAL CG2 . 10106 1 776 . 1 1 63 63 VAL N N 15 127.915 0.300 . 1 . . . . 63 VAL N . 10106 1 777 . 1 1 64 64 CYS H H 1 8.059 0.030 . 1 . . . . 64 CYS H . 10106 1 778 . 1 1 64 64 CYS HA H 1 3.679 0.030 . 1 . . . . 64 CYS HA . 10106 1 779 . 1 1 64 64 CYS HB2 H 1 3.128 0.030 . 2 . . . . 64 CYS HB2 . 10106 1 780 . 1 1 64 64 CYS HB3 H 1 2.967 0.030 . 2 . . . . 64 CYS HB3 . 10106 1 781 . 1 1 64 64 CYS C C 13 174.672 0.300 . 1 . . . . 64 CYS C . 10106 1 782 . 1 1 64 64 CYS CA C 13 59.962 0.300 . 1 . . . . 64 CYS CA . 10106 1 783 . 1 1 64 64 CYS CB C 13 28.667 0.300 . 1 . . . . 64 CYS CB . 10106 1 784 . 1 1 64 64 CYS N N 15 123.441 0.300 . 1 . . . . 64 CYS N . 10106 1 785 . 1 1 65 65 ASP H H 1 7.334 0.030 . 1 . . . . 65 ASP H . 10106 1 786 . 1 1 65 65 ASP HA H 1 4.732 0.030 . 1 . . . . 65 ASP HA . 10106 1 787 . 1 1 65 65 ASP HB2 H 1 3.317 0.030 . 2 . . . . 65 ASP HB2 . 10106 1 788 . 1 1 65 65 ASP HB3 H 1 2.911 0.030 . 2 . . . . 65 ASP HB3 . 10106 1 789 . 1 1 65 65 ASP C C 13 175.181 0.300 . 1 . . . . 65 ASP C . 10106 1 790 . 1 1 65 65 ASP CA C 13 52.104 0.300 . 1 . . . . 65 ASP CA . 10106 1 791 . 1 1 65 65 ASP CB C 13 40.943 0.300 . 1 . . . . 65 ASP CB . 10106 1 792 . 1 1 65 65 ASP N N 15 122.370 0.300 . 1 . . . . 65 ASP N . 10106 1 793 . 1 1 66 66 LYS H H 1 8.407 0.030 . 1 . . . . 66 LYS H . 10106 1 794 . 1 1 66 66 LYS HA H 1 3.948 0.030 . 1 . . . . 66 LYS HA . 10106 1 795 . 1 1 66 66 LYS HB2 H 1 1.842 0.030 . 2 . . . . 66 LYS HB2 . 10106 1 796 . 1 1 66 66 LYS HB3 H 1 1.916 0.030 . 2 . . . . 66 LYS HB3 . 10106 1 797 . 1 1 66 66 LYS HG2 H 1 1.422 0.030 . 2 . . . . 66 LYS HG2 . 10106 1 798 . 1 1 66 66 LYS HG3 H 1 1.510 0.030 . 2 . . . . 66 LYS HG3 . 10106 1 799 . 1 1 66 66 LYS HD2 H 1 1.687 0.030 . 2 . . . . 66 LYS HD2 . 10106 1 800 . 1 1 66 66 LYS HD3 H 1 1.754 0.030 . 2 . . . . 66 LYS HD3 . 10106 1 801 . 1 1 66 66 LYS HE2 H 1 2.949 0.030 . 1 . . . . 66 LYS HE2 . 10106 1 802 . 1 1 66 66 LYS HE3 H 1 2.949 0.030 . 1 . . . . 66 LYS HE3 . 10106 1 803 . 1 1 66 66 LYS C C 13 178.617 0.300 . 1 . . . . 66 LYS C . 10106 1 804 . 1 1 66 66 LYS CA C 13 60.369 0.300 . 1 . . . . 66 LYS CA . 10106 1 805 . 1 1 66 66 LYS CB C 13 32.037 0.300 . 1 . . . . 66 LYS CB . 10106 1 806 . 1 1 66 66 LYS CG C 13 24.605 0.300 . 1 . . . . 66 LYS CG . 10106 1 807 . 1 1 66 66 LYS CD C 13 29.300 0.300 . 1 . . . . 66 LYS CD . 10106 1 808 . 1 1 66 66 LYS CE C 13 42.151 0.300 . 1 . . . . 66 LYS CE . 10106 1 809 . 1 1 66 66 LYS N N 15 118.791 0.300 . 1 . . . . 66 LYS N . 10106 1 810 . 1 1 67 67 ARG H H 1 7.664 0.030 . 1 . . . . 67 ARG H . 10106 1 811 . 1 1 67 67 ARG HA H 1 4.029 0.030 . 1 . . . . 67 ARG HA . 10106 1 812 . 1 1 67 67 ARG HB2 H 1 2.163 0.030 . 2 . . . . 67 ARG HB2 . 10106 1 813 . 1 1 67 67 ARG HB3 H 1 1.678 0.030 . 2 . . . . 67 ARG HB3 . 10106 1 814 . 1 1 67 67 ARG HG2 H 1 1.597 0.030 . 2 . . . . 67 ARG HG2 . 10106 1 815 . 1 1 67 67 ARG HG3 H 1 1.939 0.030 . 2 . . . . 67 ARG HG3 . 10106 1 816 . 1 1 67 67 ARG HD2 H 1 2.832 0.030 . 2 . . . . 67 ARG HD2 . 10106 1 817 . 1 1 67 67 ARG HD3 H 1 3.040 0.030 . 2 . . . . 67 ARG HD3 . 10106 1 818 . 1 1 67 67 ARG C C 13 179.598 0.300 . 1 . . . . 67 ARG C . 10106 1 819 . 1 1 67 67 ARG CA C 13 60.183 0.300 . 1 . . . . 67 ARG CA . 10106 1 820 . 1 1 67 67 ARG CB C 13 30.232 0.300 . 1 . . . . 67 ARG CB . 10106 1 821 . 1 1 67 67 ARG CG C 13 28.671 0.300 . 1 . . . . 67 ARG CG . 10106 1 822 . 1 1 67 67 ARG CD C 13 43.304 0.300 . 1 . . . . 67 ARG CD . 10106 1 823 . 1 1 67 67 ARG N N 15 114.509 0.300 . 1 . . . . 67 ARG N . 10106 1 824 . 1 1 68 68 LEU H H 1 8.264 0.030 . 1 . . . . 68 LEU H . 10106 1 825 . 1 1 68 68 LEU HA H 1 4.043 0.030 . 1 . . . . 68 LEU HA . 10106 1 826 . 1 1 68 68 LEU HB2 H 1 1.957 0.030 . 1 . . . . 68 LEU HB2 . 10106 1 827 . 1 1 68 68 LEU HB3 H 1 1.957 0.030 . 1 . . . . 68 LEU HB3 . 10106 1 828 . 1 1 68 68 LEU HG H 1 2.195 0.030 . 1 . . . . 68 LEU HG . 10106 1 829 . 1 1 68 68 LEU HD11 H 1 1.030 0.030 . 1 . . . . 68 LEU HD1 . 10106 1 830 . 1 1 68 68 LEU HD12 H 1 1.030 0.030 . 1 . . . . 68 LEU HD1 . 10106 1 831 . 1 1 68 68 LEU HD13 H 1 1.030 0.030 . 1 . . . . 68 LEU HD1 . 10106 1 832 . 1 1 68 68 LEU HD21 H 1 0.634 0.030 . 1 . . . . 68 LEU HD2 . 10106 1 833 . 1 1 68 68 LEU HD22 H 1 0.634 0.030 . 1 . . . . 68 LEU HD2 . 10106 1 834 . 1 1 68 68 LEU HD23 H 1 0.634 0.030 . 1 . . . . 68 LEU HD2 . 10106 1 835 . 1 1 68 68 LEU C C 13 179.101 0.300 . 1 . . . . 68 LEU C . 10106 1 836 . 1 1 68 68 LEU CA C 13 57.728 0.300 . 1 . . . . 68 LEU CA . 10106 1 837 . 1 1 68 68 LEU CB C 13 41.315 0.300 . 1 . . . . 68 LEU CB . 10106 1 838 . 1 1 68 68 LEU CG C 13 27.337 0.300 . 1 . . . . 68 LEU CG . 10106 1 839 . 1 1 68 68 LEU CD1 C 13 27.115 0.300 . 2 . . . . 68 LEU CD1 . 10106 1 840 . 1 1 68 68 LEU CD2 C 13 23.128 0.300 . 2 . . . . 68 LEU CD2 . 10106 1 841 . 1 1 68 68 LEU N N 15 117.741 0.300 . 1 . . . . 68 LEU N . 10106 1 842 . 1 1 69 69 VAL H H 1 8.925 0.030 . 1 . . . . 69 VAL H . 10106 1 843 . 1 1 69 69 VAL HA H 1 3.827 0.030 . 1 . . . . 69 VAL HA . 10106 1 844 . 1 1 69 69 VAL HB H 1 2.030 0.030 . 1 . . . . 69 VAL HB . 10106 1 845 . 1 1 69 69 VAL HG11 H 1 0.922 0.030 . 1 . . . . 69 VAL HG1 . 10106 1 846 . 1 1 69 69 VAL HG12 H 1 0.922 0.030 . 1 . . . . 69 VAL HG1 . 10106 1 847 . 1 1 69 69 VAL HG13 H 1 0.922 0.030 . 1 . . . . 69 VAL HG1 . 10106 1 848 . 1 1 69 69 VAL HG21 H 1 0.793 0.030 . 1 . . . . 69 VAL HG2 . 10106 1 849 . 1 1 69 69 VAL HG22 H 1 0.793 0.030 . 1 . . . . 69 VAL HG2 . 10106 1 850 . 1 1 69 69 VAL HG23 H 1 0.793 0.030 . 1 . . . . 69 VAL HG2 . 10106 1 851 . 1 1 69 69 VAL C C 13 179.958 0.300 . 1 . . . . 69 VAL C . 10106 1 852 . 1 1 69 69 VAL CA C 13 66.807 0.300 . 1 . . . . 69 VAL CA . 10106 1 853 . 1 1 69 69 VAL CB C 13 31.498 0.300 . 1 . . . . 69 VAL CB . 10106 1 854 . 1 1 69 69 VAL CG1 C 13 23.568 0.300 . 2 . . . . 69 VAL CG1 . 10106 1 855 . 1 1 69 69 VAL CG2 C 13 21.557 0.300 . 2 . . . . 69 VAL CG2 . 10106 1 856 . 1 1 69 69 VAL N N 15 122.391 0.300 . 1 . . . . 69 VAL N . 10106 1 857 . 1 1 70 70 LEU H H 1 7.619 0.030 . 1 . . . . 70 LEU H . 10106 1 858 . 1 1 70 70 LEU HA H 1 3.980 0.030 . 1 . . . . 70 LEU HA . 10106 1 859 . 1 1 70 70 LEU HB2 H 1 1.895 0.030 . 2 . . . . 70 LEU HB2 . 10106 1 860 . 1 1 70 70 LEU HB3 H 1 1.481 0.030 . 2 . . . . 70 LEU HB3 . 10106 1 861 . 1 1 70 70 LEU HG H 1 1.792 0.030 . 1 . . . . 70 LEU HG . 10106 1 862 . 1 1 70 70 LEU HD11 H 1 0.882 0.030 . 1 . . . . 70 LEU HD1 . 10106 1 863 . 1 1 70 70 LEU HD12 H 1 0.882 0.030 . 1 . . . . 70 LEU HD1 . 10106 1 864 . 1 1 70 70 LEU HD13 H 1 0.882 0.030 . 1 . . . . 70 LEU HD1 . 10106 1 865 . 1 1 70 70 LEU HD21 H 1 0.855 0.030 . 1 . . . . 70 LEU HD2 . 10106 1 866 . 1 1 70 70 LEU HD22 H 1 0.855 0.030 . 1 . . . . 70 LEU HD2 . 10106 1 867 . 1 1 70 70 LEU HD23 H 1 0.855 0.030 . 1 . . . . 70 LEU HD2 . 10106 1 868 . 1 1 70 70 LEU C C 13 177.973 0.300 . 1 . . . . 70 LEU C . 10106 1 869 . 1 1 70 70 LEU CA C 13 57.733 0.300 . 1 . . . . 70 LEU CA . 10106 1 870 . 1 1 70 70 LEU CB C 13 41.536 0.300 . 1 . . . . 70 LEU CB . 10106 1 871 . 1 1 70 70 LEU CG C 13 26.864 0.300 . 1 . . . . 70 LEU CG . 10106 1 872 . 1 1 70 70 LEU CD1 C 13 25.346 0.300 . 2 . . . . 70 LEU CD1 . 10106 1 873 . 1 1 70 70 LEU CD2 C 13 22.710 0.300 . 2 . . . . 70 LEU CD2 . 10106 1 874 . 1 1 70 70 LEU N N 15 120.876 0.300 . 1 . . . . 70 LEU N . 10106 1 875 . 1 1 71 71 LEU H H 1 6.869 0.030 . 1 . . . . 71 LEU H . 10106 1 876 . 1 1 71 71 LEU HA H 1 3.756 0.030 . 1 . . . . 71 LEU HA . 10106 1 877 . 1 1 71 71 LEU HB2 H 1 0.902 0.030 . 2 . . . . 71 LEU HB2 . 10106 1 878 . 1 1 71 71 LEU HB3 H 1 0.649 0.030 . 2 . . . . 71 LEU HB3 . 10106 1 879 . 1 1 71 71 LEU HG H 1 -0.325 0.030 . 1 . . . . 71 LEU HG . 10106 1 880 . 1 1 71 71 LEU HD11 H 1 -0.262 0.030 . 1 . . . . 71 LEU HD1 . 10106 1 881 . 1 1 71 71 LEU HD12 H 1 -0.262 0.030 . 1 . . . . 71 LEU HD1 . 10106 1 882 . 1 1 71 71 LEU HD13 H 1 -0.262 0.030 . 1 . . . . 71 LEU HD1 . 10106 1 883 . 1 1 71 71 LEU HD21 H 1 -0.756 0.030 . 1 . . . . 71 LEU HD2 . 10106 1 884 . 1 1 71 71 LEU HD22 H 1 -0.756 0.030 . 1 . . . . 71 LEU HD2 . 10106 1 885 . 1 1 71 71 LEU HD23 H 1 -0.756 0.030 . 1 . . . . 71 LEU HD2 . 10106 1 886 . 1 1 71 71 LEU C C 13 176.653 0.300 . 1 . . . . 71 LEU C . 10106 1 887 . 1 1 71 71 LEU CA C 13 57.312 0.300 . 1 . . . . 71 LEU CA . 10106 1 888 . 1 1 71 71 LEU CB C 13 42.209 0.300 . 1 . . . . 71 LEU CB . 10106 1 889 . 1 1 71 71 LEU CG C 13 25.774 0.300 . 1 . . . . 71 LEU CG . 10106 1 890 . 1 1 71 71 LEU CD1 C 13 21.572 0.300 . 2 . . . . 71 LEU CD1 . 10106 1 891 . 1 1 71 71 LEU CD2 C 13 25.350 0.300 . 2 . . . . 71 LEU CD2 . 10106 1 892 . 1 1 71 71 LEU N N 15 116.960 0.300 . 1 . . . . 71 LEU N . 10106 1 893 . 1 1 72 72 PHE H H 1 8.347 0.030 . 1 . . . . 72 PHE H . 10106 1 894 . 1 1 72 72 PHE HA H 1 4.914 0.030 . 1 . . . . 72 PHE HA . 10106 1 895 . 1 1 72 72 PHE HB2 H 1 3.357 0.030 . 2 . . . . 72 PHE HB2 . 10106 1 896 . 1 1 72 72 PHE HB3 H 1 2.756 0.030 . 2 . . . . 72 PHE HB3 . 10106 1 897 . 1 1 72 72 PHE HD1 H 1 7.356 0.030 . 1 . . . . 72 PHE HD1 . 10106 1 898 . 1 1 72 72 PHE HD2 H 1 7.356 0.030 . 1 . . . . 72 PHE HD2 . 10106 1 899 . 1 1 72 72 PHE HE1 H 1 6.878 0.030 . 1 . . . . 72 PHE HE1 . 10106 1 900 . 1 1 72 72 PHE HE2 H 1 6.878 0.030 . 1 . . . . 72 PHE HE2 . 10106 1 901 . 1 1 72 72 PHE HZ H 1 6.875 0.030 . 1 . . . . 72 PHE HZ . 10106 1 902 . 1 1 72 72 PHE C C 13 178.506 0.300 . 1 . . . . 72 PHE C . 10106 1 903 . 1 1 72 72 PHE CA C 13 58.605 0.300 . 1 . . . . 72 PHE CA . 10106 1 904 . 1 1 72 72 PHE CB C 13 40.219 0.300 . 1 . . . . 72 PHE CB . 10106 1 905 . 1 1 72 72 PHE CD1 C 13 131.537 0.300 . 1 . . . . 72 PHE CD1 . 10106 1 906 . 1 1 72 72 PHE CD2 C 13 131.537 0.300 . 1 . . . . 72 PHE CD2 . 10106 1 907 . 1 1 72 72 PHE CE1 C 13 128.304 0.300 . 1 . . . . 72 PHE CE1 . 10106 1 908 . 1 1 72 72 PHE CE2 C 13 128.304 0.300 . 1 . . . . 72 PHE CE2 . 10106 1 909 . 1 1 72 72 PHE CZ C 13 130.505 0.300 . 1 . . . . 72 PHE CZ . 10106 1 910 . 1 1 72 72 PHE N N 15 112.191 0.300 . 1 . . . . 72 PHE N . 10106 1 911 . 1 1 73 73 GLY H H 1 8.707 0.030 . 1 . . . . 73 GLY H . 10106 1 912 . 1 1 73 73 GLY HA2 H 1 4.149 0.030 . 2 . . . . 73 GLY HA2 . 10106 1 913 . 1 1 73 73 GLY HA3 H 1 3.989 0.030 . 2 . . . . 73 GLY HA3 . 10106 1 914 . 1 1 73 73 GLY C C 13 173.369 0.300 . 1 . . . . 73 GLY C . 10106 1 915 . 1 1 73 73 GLY CA C 13 46.474 0.300 . 1 . . . . 73 GLY CA . 10106 1 916 . 1 1 73 73 GLY N N 15 109.491 0.300 . 1 . . . . 73 GLY N . 10106 1 917 . 1 1 74 74 THR H H 1 7.123 0.030 . 1 . . . . 74 THR H . 10106 1 918 . 1 1 74 74 THR HA H 1 4.732 0.030 . 1 . . . . 74 THR HA . 10106 1 919 . 1 1 74 74 THR HB H 1 4.429 0.030 . 1 . . . . 74 THR HB . 10106 1 920 . 1 1 74 74 THR HG21 H 1 1.142 0.030 . 1 . . . . 74 THR HG2 . 10106 1 921 . 1 1 74 74 THR HG22 H 1 1.142 0.030 . 1 . . . . 74 THR HG2 . 10106 1 922 . 1 1 74 74 THR HG23 H 1 1.142 0.030 . 1 . . . . 74 THR HG2 . 10106 1 923 . 1 1 74 74 THR C C 13 172.352 0.300 . 1 . . . . 74 THR C . 10106 1 924 . 1 1 74 74 THR CA C 13 59.187 0.300 . 1 . . . . 74 THR CA . 10106 1 925 . 1 1 74 74 THR CB C 13 70.425 0.300 . 1 . . . . 74 THR CB . 10106 1 926 . 1 1 74 74 THR CG2 C 13 21.145 0.300 . 1 . . . . 74 THR CG2 . 10106 1 927 . 1 1 74 74 THR N N 15 109.191 0.300 . 1 . . . . 74 THR N . 10106 1 928 . 1 1 75 75 ARG H H 1 8.404 0.030 . 1 . . . . 75 ARG H . 10106 1 929 . 1 1 75 75 ARG HA H 1 4.141 0.030 . 1 . . . . 75 ARG HA . 10106 1 930 . 1 1 75 75 ARG HB2 H 1 1.903 0.030 . 2 . . . . 75 ARG HB2 . 10106 1 931 . 1 1 75 75 ARG HB3 H 1 1.957 0.030 . 2 . . . . 75 ARG HB3 . 10106 1 932 . 1 1 75 75 ARG HG2 H 1 1.676 0.030 . 2 . . . . 75 ARG HG2 . 10106 1 933 . 1 1 75 75 ARG HG3 H 1 1.804 0.030 . 2 . . . . 75 ARG HG3 . 10106 1 934 . 1 1 75 75 ARG HD2 H 1 3.231 0.030 . 1 . . . . 75 ARG HD2 . 10106 1 935 . 1 1 75 75 ARG HD3 H 1 3.231 0.030 . 1 . . . . 75 ARG HD3 . 10106 1 936 . 1 1 75 75 ARG C C 13 177.054 0.300 . 1 . . . . 75 ARG C . 10106 1 937 . 1 1 75 75 ARG CA C 13 58.180 0.300 . 1 . . . . 75 ARG CA . 10106 1 938 . 1 1 75 75 ARG CB C 13 30.788 0.300 . 1 . . . . 75 ARG CB . 10106 1 939 . 1 1 75 75 ARG CG C 13 28.013 0.300 . 1 . . . . 75 ARG CG . 10106 1 940 . 1 1 75 75 ARG CD C 13 42.870 0.300 . 1 . . . . 75 ARG CD . 10106 1 941 . 1 1 75 75 ARG N N 15 119.249 0.300 . 1 . . . . 75 ARG N . 10106 1 942 . 1 1 76 76 THR H H 1 7.692 0.030 . 1 . . . . 76 THR H . 10106 1 943 . 1 1 76 76 THR HA H 1 5.478 0.030 . 1 . . . . 76 THR HA . 10106 1 944 . 1 1 76 76 THR HB H 1 3.985 0.030 . 1 . . . . 76 THR HB . 10106 1 945 . 1 1 76 76 THR HG21 H 1 1.138 0.030 . 1 . . . . 76 THR HG2 . 10106 1 946 . 1 1 76 76 THR HG22 H 1 1.138 0.030 . 1 . . . . 76 THR HG2 . 10106 1 947 . 1 1 76 76 THR HG23 H 1 1.138 0.030 . 1 . . . . 76 THR HG2 . 10106 1 948 . 1 1 76 76 THR C C 13 173.754 0.300 . 1 . . . . 76 THR C . 10106 1 949 . 1 1 76 76 THR CA C 13 59.733 0.300 . 1 . . . . 76 THR CA . 10106 1 950 . 1 1 76 76 THR CB C 13 72.381 0.300 . 1 . . . . 76 THR CB . 10106 1 951 . 1 1 76 76 THR CG2 C 13 21.362 0.300 . 1 . . . . 76 THR CG2 . 10106 1 952 . 1 1 76 76 THR N N 15 109.520 0.300 . 1 . . . . 76 THR N . 10106 1 953 . 1 1 77 77 ILE H H 1 7.941 0.030 . 1 . . . . 77 ILE H . 10106 1 954 . 1 1 77 77 ILE HA H 1 4.598 0.030 . 1 . . . . 77 ILE HA . 10106 1 955 . 1 1 77 77 ILE HB H 1 1.503 0.030 . 1 . . . . 77 ILE HB . 10106 1 956 . 1 1 77 77 ILE HG12 H 1 0.613 0.030 . 2 . . . . 77 ILE HG12 . 10106 1 957 . 1 1 77 77 ILE HG13 H 1 0.802 0.030 . 2 . . . . 77 ILE HG13 . 10106 1 958 . 1 1 77 77 ILE HG21 H 1 0.352 0.030 . 1 . . . . 77 ILE HG2 . 10106 1 959 . 1 1 77 77 ILE HG22 H 1 0.352 0.030 . 1 . . . . 77 ILE HG2 . 10106 1 960 . 1 1 77 77 ILE HG23 H 1 0.352 0.030 . 1 . . . . 77 ILE HG2 . 10106 1 961 . 1 1 77 77 ILE HD11 H 1 0.240 0.030 . 1 . . . . 77 ILE HD1 . 10106 1 962 . 1 1 77 77 ILE HD12 H 1 0.240 0.030 . 1 . . . . 77 ILE HD1 . 10106 1 963 . 1 1 77 77 ILE HD13 H 1 0.240 0.030 . 1 . . . . 77 ILE HD1 . 10106 1 964 . 1 1 77 77 ILE C C 13 174.933 0.300 . 1 . . . . 77 ILE C . 10106 1 965 . 1 1 77 77 ILE CA C 13 59.516 0.300 . 1 . . . . 77 ILE CA . 10106 1 966 . 1 1 77 77 ILE CB C 13 42.870 0.300 . 1 . . . . 77 ILE CB . 10106 1 967 . 1 1 77 77 ILE CG1 C 13 25.770 0.300 . 1 . . . . 77 ILE CG1 . 10106 1 968 . 1 1 77 77 ILE CG2 C 13 18.261 0.300 . 1 . . . . 77 ILE CG2 . 10106 1 969 . 1 1 77 77 ILE CD1 C 13 14.334 0.300 . 1 . . . . 77 ILE CD1 . 10106 1 970 . 1 1 77 77 ILE N N 15 114.371 0.300 . 1 . . . . 77 ILE N . 10106 1 971 . 1 1 78 78 PHE H H 1 8.658 0.030 . 1 . . . . 78 PHE H . 10106 1 972 . 1 1 78 78 PHE HA H 1 4.874 0.030 . 1 . . . . 78 PHE HA . 10106 1 973 . 1 1 78 78 PHE HB2 H 1 3.227 0.030 . 2 . . . . 78 PHE HB2 . 10106 1 974 . 1 1 78 78 PHE HB3 H 1 2.753 0.030 . 2 . . . . 78 PHE HB3 . 10106 1 975 . 1 1 78 78 PHE HD1 H 1 7.337 0.030 . 1 . . . . 78 PHE HD1 . 10106 1 976 . 1 1 78 78 PHE HD2 H 1 7.337 0.030 . 1 . . . . 78 PHE HD2 . 10106 1 977 . 1 1 78 78 PHE C C 13 176.918 0.300 . 1 . . . . 78 PHE C . 10106 1 978 . 1 1 78 78 PHE CA C 13 58.429 0.300 . 1 . . . . 78 PHE CA . 10106 1 979 . 1 1 78 78 PHE CB C 13 38.848 0.300 . 1 . . . . 78 PHE CB . 10106 1 980 . 1 1 78 78 PHE CD1 C 13 131.613 0.300 . 1 . . . . 78 PHE CD1 . 10106 1 981 . 1 1 78 78 PHE CD2 C 13 131.613 0.300 . 1 . . . . 78 PHE CD2 . 10106 1 982 . 1 1 78 78 PHE N N 15 120.522 0.300 . 1 . . . . 78 PHE N . 10106 1 983 . 1 1 79 79 ARG H H 1 8.437 0.030 . 1 . . . . 79 ARG H . 10106 1 984 . 1 1 79 79 ARG HA H 1 3.661 0.030 . 1 . . . . 79 ARG HA . 10106 1 985 . 1 1 79 79 ARG HB2 H 1 1.694 0.030 . 2 . . . . 79 ARG HB2 . 10106 1 986 . 1 1 79 79 ARG HB3 H 1 1.754 0.030 . 2 . . . . 79 ARG HB3 . 10106 1 987 . 1 1 79 79 ARG HG2 H 1 1.496 0.030 . 2 . . . . 79 ARG HG2 . 10106 1 988 . 1 1 79 79 ARG HG3 H 1 1.720 0.030 . 2 . . . . 79 ARG HG3 . 10106 1 989 . 1 1 79 79 ARG HD2 H 1 3.137 0.030 . 2 . . . . 79 ARG HD2 . 10106 1 990 . 1 1 79 79 ARG HD3 H 1 3.277 0.030 . 2 . . . . 79 ARG HD3 . 10106 1 991 . 1 1 79 79 ARG C C 13 177.637 0.300 . 1 . . . . 79 ARG C . 10106 1 992 . 1 1 79 79 ARG CA C 13 59.769 0.300 . 1 . . . . 79 ARG CA . 10106 1 993 . 1 1 79 79 ARG CB C 13 30.663 0.300 . 1 . . . . 79 ARG CB . 10106 1 994 . 1 1 79 79 ARG CG C 13 26.893 0.300 . 1 . . . . 79 ARG CG . 10106 1 995 . 1 1 79 79 ARG CD C 13 43.799 0.300 . 1 . . . . 79 ARG CD . 10106 1 996 . 1 1 79 79 ARG N N 15 124.791 0.300 . 1 . . . . 79 ARG N . 10106 1 997 . 1 1 80 80 MET H H 1 9.142 0.030 . 1 . . . . 80 MET H . 10106 1 998 . 1 1 80 80 MET HA H 1 4.629 0.030 . 1 . . . . 80 MET HA . 10106 1 999 . 1 1 80 80 MET HB2 H 1 2.316 0.030 . 2 . . . . 80 MET HB2 . 10106 1 1000 . 1 1 80 80 MET HB3 H 1 2.109 0.030 . 2 . . . . 80 MET HB3 . 10106 1 1001 . 1 1 80 80 MET HG2 H 1 2.665 0.030 . 2 . . . . 80 MET HG2 . 10106 1 1002 . 1 1 80 80 MET HG3 H 1 2.773 0.030 . 2 . . . . 80 MET HG3 . 10106 1 1003 . 1 1 80 80 MET C C 13 177.302 0.300 . 1 . . . . 80 MET C . 10106 1 1004 . 1 1 80 80 MET CA C 13 56.227 0.300 . 1 . . . . 80 MET CA . 10106 1 1005 . 1 1 80 80 MET CB C 13 31.203 0.300 . 1 . . . . 80 MET CB . 10106 1 1006 . 1 1 80 80 MET CG C 13 32.546 0.300 . 1 . . . . 80 MET CG . 10106 1 1007 . 1 1 80 80 MET N N 15 114.159 0.300 . 1 . . . . 80 MET N . 10106 1 1008 . 1 1 81 81 LYS H H 1 7.748 0.030 . 1 . . . . 81 LYS H . 10106 1 1009 . 1 1 81 81 LYS HA H 1 4.744 0.030 . 1 . . . . 81 LYS HA . 10106 1 1010 . 1 1 81 81 LYS HB2 H 1 2.256 0.030 . 2 . . . . 81 LYS HB2 . 10106 1 1011 . 1 1 81 81 LYS HB3 H 1 1.994 0.030 . 2 . . . . 81 LYS HB3 . 10106 1 1012 . 1 1 81 81 LYS HG2 H 1 1.412 0.030 . 2 . . . . 81 LYS HG2 . 10106 1 1013 . 1 1 81 81 LYS HG3 H 1 1.646 0.030 . 2 . . . . 81 LYS HG3 . 10106 1 1014 . 1 1 81 81 LYS HD2 H 1 1.735 0.030 . 2 . . . . 81 LYS HD2 . 10106 1 1015 . 1 1 81 81 LYS HD3 H 1 1.797 0.030 . 2 . . . . 81 LYS HD3 . 10106 1 1016 . 1 1 81 81 LYS HE2 H 1 2.924 0.030 . 1 . . . . 81 LYS HE2 . 10106 1 1017 . 1 1 81 81 LYS HE3 H 1 2.924 0.030 . 1 . . . . 81 LYS HE3 . 10106 1 1018 . 1 1 81 81 LYS C C 13 175.602 0.300 . 1 . . . . 81 LYS C . 10106 1 1019 . 1 1 81 81 LYS CA C 13 54.588 0.300 . 1 . . . . 81 LYS CA . 10106 1 1020 . 1 1 81 81 LYS CB C 13 32.009 0.300 . 1 . . . . 81 LYS CB . 10106 1 1021 . 1 1 81 81 LYS CG C 13 24.942 0.300 . 1 . . . . 81 LYS CG . 10106 1 1022 . 1 1 81 81 LYS CD C 13 28.229 0.300 . 1 . . . . 81 LYS CD . 10106 1 1023 . 1 1 81 81 LYS CE C 13 41.986 0.300 . 1 . . . . 81 LYS CE . 10106 1 1024 . 1 1 81 81 LYS N N 15 117.591 0.300 . 1 . . . . 81 LYS N . 10106 1 1025 . 1 1 82 82 VAL H H 1 6.994 0.030 . 1 . . . . 82 VAL H . 10106 1 1026 . 1 1 82 82 VAL HA H 1 3.211 0.030 . 1 . . . . 82 VAL HA . 10106 1 1027 . 1 1 82 82 VAL HB H 1 2.204 0.030 . 1 . . . . 82 VAL HB . 10106 1 1028 . 1 1 82 82 VAL HG11 H 1 1.085 0.030 . 1 . . . . 82 VAL HG1 . 10106 1 1029 . 1 1 82 82 VAL HG12 H 1 1.085 0.030 . 1 . . . . 82 VAL HG1 . 10106 1 1030 . 1 1 82 82 VAL HG13 H 1 1.085 0.030 . 1 . . . . 82 VAL HG1 . 10106 1 1031 . 1 1 82 82 VAL HG21 H 1 1.019 0.030 . 1 . . . . 82 VAL HG2 . 10106 1 1032 . 1 1 82 82 VAL HG22 H 1 1.019 0.030 . 1 . . . . 82 VAL HG2 . 10106 1 1033 . 1 1 82 82 VAL HG23 H 1 1.019 0.030 . 1 . . . . 82 VAL HG2 . 10106 1 1034 . 1 1 82 82 VAL C C 13 175.789 0.300 . 1 . . . . 82 VAL C . 10106 1 1035 . 1 1 82 82 VAL CA C 13 68.342 0.300 . 1 . . . . 82 VAL CA . 10106 1 1036 . 1 1 82 82 VAL CB C 13 31.889 0.300 . 1 . . . . 82 VAL CB . 10106 1 1037 . 1 1 82 82 VAL CG1 C 13 22.681 0.300 . 2 . . . . 82 VAL CG1 . 10106 1 1038 . 1 1 82 82 VAL CG2 C 13 23.785 0.300 . 2 . . . . 82 VAL CG2 . 10106 1 1039 . 1 1 82 82 VAL N N 15 119.994 0.300 . 1 . . . . 82 VAL N . 10106 1 1040 . 1 1 83 83 TYR H H 1 8.608 0.030 . 1 . . . . 83 TYR H . 10106 1 1041 . 1 1 83 83 TYR HA H 1 3.996 0.030 . 1 . . . . 83 TYR HA . 10106 1 1042 . 1 1 83 83 TYR HB2 H 1 3.142 0.030 . 1 . . . . 83 TYR HB2 . 10106 1 1043 . 1 1 83 83 TYR HB3 H 1 3.142 0.030 . 1 . . . . 83 TYR HB3 . 10106 1 1044 . 1 1 83 83 TYR HD1 H 1 6.943 0.030 . 1 . . . . 83 TYR HD1 . 10106 1 1045 . 1 1 83 83 TYR HD2 H 1 6.943 0.030 . 1 . . . . 83 TYR HD2 . 10106 1 1046 . 1 1 83 83 TYR HE1 H 1 6.405 0.030 . 1 . . . . 83 TYR HE1 . 10106 1 1047 . 1 1 83 83 TYR HE2 H 1 6.405 0.030 . 1 . . . . 83 TYR HE2 . 10106 1 1048 . 1 1 83 83 TYR C C 13 179.027 0.300 . 1 . . . . 83 TYR C . 10106 1 1049 . 1 1 83 83 TYR CA C 13 63.079 0.300 . 1 . . . . 83 TYR CA . 10106 1 1050 . 1 1 83 83 TYR CB C 13 37.999 0.300 . 1 . . . . 83 TYR CB . 10106 1 1051 . 1 1 83 83 TYR CD1 C 13 133.253 0.300 . 1 . . . . 83 TYR CD1 . 10106 1 1052 . 1 1 83 83 TYR CD2 C 13 133.253 0.300 . 1 . . . . 83 TYR CD2 . 10106 1 1053 . 1 1 83 83 TYR CE1 C 13 118.016 0.300 . 1 . . . . 83 TYR CE1 . 10106 1 1054 . 1 1 83 83 TYR CE2 C 13 118.016 0.300 . 1 . . . . 83 TYR CE2 . 10106 1 1055 . 1 1 83 83 TYR N N 15 117.785 0.300 . 1 . . . . 83 TYR N . 10106 1 1056 . 1 1 84 84 ASP H H 1 8.184 0.030 . 1 . . . . 84 ASP H . 10106 1 1057 . 1 1 84 84 ASP HA H 1 4.324 0.030 . 1 . . . . 84 ASP HA . 10106 1 1058 . 1 1 84 84 ASP HB2 H 1 2.796 0.030 . 1 . . . . 84 ASP HB2 . 10106 1 1059 . 1 1 84 84 ASP HB3 H 1 2.796 0.030 . 1 . . . . 84 ASP HB3 . 10106 1 1060 . 1 1 84 84 ASP C C 13 180.194 0.300 . 1 . . . . 84 ASP C . 10106 1 1061 . 1 1 84 84 ASP CA C 13 57.521 0.300 . 1 . . . . 84 ASP CA . 10106 1 1062 . 1 1 84 84 ASP CB C 13 40.680 0.300 . 1 . . . . 84 ASP CB . 10106 1 1063 . 1 1 84 84 ASP N N 15 120.910 0.300 . 1 . . . . 84 ASP N . 10106 1 1064 . 1 1 85 85 LEU H H 1 8.904 0.030 . 1 . . . . 85 LEU H . 10106 1 1065 . 1 1 85 85 LEU HA H 1 4.202 0.030 . 1 . . . . 85 LEU HA . 10106 1 1066 . 1 1 85 85 LEU HB2 H 1 1.913 0.030 . 2 . . . . 85 LEU HB2 . 10106 1 1067 . 1 1 85 85 LEU HB3 H 1 1.491 0.030 . 2 . . . . 85 LEU HB3 . 10106 1 1068 . 1 1 85 85 LEU HG H 1 1.798 0.030 . 1 . . . . 85 LEU HG . 10106 1 1069 . 1 1 85 85 LEU HD11 H 1 0.936 0.030 . 1 . . . . 85 LEU HD1 . 10106 1 1070 . 1 1 85 85 LEU HD12 H 1 0.936 0.030 . 1 . . . . 85 LEU HD1 . 10106 1 1071 . 1 1 85 85 LEU HD13 H 1 0.936 0.030 . 1 . . . . 85 LEU HD1 . 10106 1 1072 . 1 1 85 85 LEU HD21 H 1 0.427 0.030 . 1 . . . . 85 LEU HD2 . 10106 1 1073 . 1 1 85 85 LEU HD22 H 1 0.427 0.030 . 1 . . . . 85 LEU HD2 . 10106 1 1074 . 1 1 85 85 LEU HD23 H 1 0.427 0.030 . 1 . . . . 85 LEU HD2 . 10106 1 1075 . 1 1 85 85 LEU C C 13 179.871 0.300 . 1 . . . . 85 LEU C . 10106 1 1076 . 1 1 85 85 LEU CA C 13 57.519 0.300 . 1 . . . . 85 LEU CA . 10106 1 1077 . 1 1 85 85 LEU CB C 13 42.872 0.300 . 1 . . . . 85 LEU CB . 10106 1 1078 . 1 1 85 85 LEU CG C 13 26.737 0.300 . 1 . . . . 85 LEU CG . 10106 1 1079 . 1 1 85 85 LEU CD1 C 13 22.234 0.300 . 2 . . . . 85 LEU CD1 . 10106 1 1080 . 1 1 85 85 LEU CD2 C 13 25.340 0.300 . 2 . . . . 85 LEU CD2 . 10106 1 1081 . 1 1 85 85 LEU N N 15 122.154 0.300 . 1 . . . . 85 LEU N . 10106 1 1082 . 1 1 86 86 LEU H H 1 7.807 0.030 . 1 . . . . 86 LEU H . 10106 1 1083 . 1 1 86 86 LEU HA H 1 4.501 0.030 . 1 . . . . 86 LEU HA . 10106 1 1084 . 1 1 86 86 LEU HB2 H 1 2.095 0.030 . 2 . . . . 86 LEU HB2 . 10106 1 1085 . 1 1 86 86 LEU HB3 H 1 1.644 0.030 . 2 . . . . 86 LEU HB3 . 10106 1 1086 . 1 1 86 86 LEU HG H 1 2.177 0.030 . 1 . . . . 86 LEU HG . 10106 1 1087 . 1 1 86 86 LEU HD11 H 1 1.009 0.030 . 1 . . . . 86 LEU HD1 . 10106 1 1088 . 1 1 86 86 LEU HD12 H 1 1.009 0.030 . 1 . . . . 86 LEU HD1 . 10106 1 1089 . 1 1 86 86 LEU HD13 H 1 1.009 0.030 . 1 . . . . 86 LEU HD1 . 10106 1 1090 . 1 1 86 86 LEU HD21 H 1 0.773 0.030 . 1 . . . . 86 LEU HD2 . 10106 1 1091 . 1 1 86 86 LEU HD22 H 1 0.773 0.030 . 1 . . . . 86 LEU HD2 . 10106 1 1092 . 1 1 86 86 LEU HD23 H 1 0.773 0.030 . 1 . . . . 86 LEU HD2 . 10106 1 1093 . 1 1 86 86 LEU C C 13 178.226 0.300 . 1 . . . . 86 LEU C . 10106 1 1094 . 1 1 86 86 LEU CA C 13 56.183 0.300 . 1 . . . . 86 LEU CA . 10106 1 1095 . 1 1 86 86 LEU CB C 13 44.647 0.300 . 1 . . . . 86 LEU CB . 10106 1 1096 . 1 1 86 86 LEU CG C 13 26.900 0.300 . 1 . . . . 86 LEU CG . 10106 1 1097 . 1 1 86 86 LEU CD1 C 13 27.829 0.300 . 2 . . . . 86 LEU CD1 . 10106 1 1098 . 1 1 86 86 LEU CD2 C 13 22.710 0.300 . 2 . . . . 86 LEU CD2 . 10106 1 1099 . 1 1 86 86 LEU N N 15 116.391 0.300 . 1 . . . . 86 LEU N . 10106 1 1100 . 1 1 87 87 GLU H H 1 7.758 0.030 . 1 . . . . 87 GLU H . 10106 1 1101 . 1 1 87 87 GLU HA H 1 3.537 0.030 . 1 . . . . 87 GLU HA . 10106 1 1102 . 1 1 87 87 GLU HB2 H 1 2.221 0.030 . 2 . . . . 87 GLU HB2 . 10106 1 1103 . 1 1 87 87 GLU HB3 H 1 2.316 0.030 . 2 . . . . 87 GLU HB3 . 10106 1 1104 . 1 1 87 87 GLU HG2 H 1 2.228 0.030 . 1 . . . . 87 GLU HG2 . 10106 1 1105 . 1 1 87 87 GLU HG3 H 1 2.228 0.030 . 1 . . . . 87 GLU HG3 . 10106 1 1106 . 1 1 87 87 GLU C C 13 178.593 0.300 . 1 . . . . 87 GLU C . 10106 1 1107 . 1 1 87 87 GLU CA C 13 61.730 0.300 . 1 . . . . 87 GLU CA . 10106 1 1108 . 1 1 87 87 GLU CB C 13 30.565 0.300 . 1 . . . . 87 GLU CB . 10106 1 1109 . 1 1 87 87 GLU CG C 13 36.220 0.300 . 1 . . . . 87 GLU CG . 10106 1 1110 . 1 1 87 87 GLU N N 15 121.886 0.300 . 1 . . . . 87 GLU N . 10106 1 1111 . 1 1 88 88 LYS H H 1 8.209 0.030 . 1 . . . . 88 LYS H . 10106 1 1112 . 1 1 88 88 LYS HA H 1 4.390 0.030 . 1 . . . . 88 LYS HA . 10106 1 1113 . 1 1 88 88 LYS HB2 H 1 1.812 0.030 . 2 . . . . 88 LYS HB2 . 10106 1 1114 . 1 1 88 88 LYS HB3 H 1 1.865 0.030 . 2 . . . . 88 LYS HB3 . 10106 1 1115 . 1 1 88 88 LYS HG2 H 1 1.317 0.030 . 2 . . . . 88 LYS HG2 . 10106 1 1116 . 1 1 88 88 LYS HG3 H 1 1.523 0.030 . 2 . . . . 88 LYS HG3 . 10106 1 1117 . 1 1 88 88 LYS HD2 H 1 1.640 0.030 . 2 . . . . 88 LYS HD2 . 10106 1 1118 . 1 1 88 88 LYS HD3 H 1 1.690 0.030 . 2 . . . . 88 LYS HD3 . 10106 1 1119 . 1 1 88 88 LYS HE2 H 1 2.897 0.030 . 2 . . . . 88 LYS HE2 . 10106 1 1120 . 1 1 88 88 LYS HE3 H 1 2.998 0.030 . 2 . . . . 88 LYS HE3 . 10106 1 1121 . 1 1 88 88 LYS C C 13 176.012 0.300 . 1 . . . . 88 LYS C . 10106 1 1122 . 1 1 88 88 LYS CA C 13 57.055 0.300 . 1 . . . . 88 LYS CA . 10106 1 1123 . 1 1 88 88 LYS CB C 13 31.789 0.300 . 1 . . . . 88 LYS CB . 10106 1 1124 . 1 1 88 88 LYS CG C 13 24.522 0.300 . 1 . . . . 88 LYS CG . 10106 1 1125 . 1 1 88 88 LYS CD C 13 28.669 0.300 . 1 . . . . 88 LYS CD . 10106 1 1126 . 1 1 88 88 LYS CE C 13 42.017 0.300 . 1 . . . . 88 LYS CE . 10106 1 1127 . 1 1 88 88 LYS N N 15 112.732 0.300 . 1 . . . . 88 LYS N . 10106 1 1128 . 1 1 89 89 HIS H H 1 8.005 0.030 . 1 . . . . 89 HIS H . 10106 1 1129 . 1 1 89 89 HIS HA H 1 4.332 0.030 . 1 . . . . 89 HIS HA . 10106 1 1130 . 1 1 89 89 HIS HB2 H 1 3.431 0.030 . 2 . . . . 89 HIS HB2 . 10106 1 1131 . 1 1 89 89 HIS HB3 H 1 3.199 0.030 . 2 . . . . 89 HIS HB3 . 10106 1 1132 . 1 1 89 89 HIS HD2 H 1 7.428 0.030 . 1 . . . . 89 HIS HD2 . 10106 1 1133 . 1 1 89 89 HIS HE1 H 1 7.332 0.030 . 1 . . . . 89 HIS HE1 . 10106 1 1134 . 1 1 89 89 HIS C C 13 173.132 0.300 . 1 . . . . 89 HIS C . 10106 1 1135 . 1 1 89 89 HIS CA C 13 58.200 0.300 . 1 . . . . 89 HIS CA . 10106 1 1136 . 1 1 89 89 HIS CB C 13 31.991 0.300 . 1 . . . . 89 HIS CB . 10106 1 1137 . 1 1 89 89 HIS CD2 C 13 116.493 0.300 . 1 . . . . 89 HIS CD2 . 10106 1 1138 . 1 1 89 89 HIS CE1 C 13 138.671 0.300 . 1 . . . . 89 HIS CE1 . 10106 1 1139 . 1 1 89 89 HIS N N 15 115.341 0.300 . 1 . . . . 89 HIS N . 10106 1 1140 . 1 1 90 90 TYR H H 1 7.578 0.030 . 1 . . . . 90 TYR H . 10106 1 1141 . 1 1 90 90 TYR HA H 1 5.023 0.030 . 1 . . . . 90 TYR HA . 10106 1 1142 . 1 1 90 90 TYR HB2 H 1 3.167 0.030 . 2 . . . . 90 TYR HB2 . 10106 1 1143 . 1 1 90 90 TYR HB3 H 1 3.086 0.030 . 2 . . . . 90 TYR HB3 . 10106 1 1144 . 1 1 90 90 TYR HD1 H 1 7.594 0.030 . 1 . . . . 90 TYR HD1 . 10106 1 1145 . 1 1 90 90 TYR HD2 H 1 7.594 0.030 . 1 . . . . 90 TYR HD2 . 10106 1 1146 . 1 1 90 90 TYR HE1 H 1 6.827 0.030 . 1 . . . . 90 TYR HE1 . 10106 1 1147 . 1 1 90 90 TYR HE2 H 1 6.827 0.030 . 1 . . . . 90 TYR HE2 . 10106 1 1148 . 1 1 90 90 TYR C C 13 175.602 0.300 . 1 . . . . 90 TYR C . 10106 1 1149 . 1 1 90 90 TYR CA C 13 58.164 0.300 . 1 . . . . 90 TYR CA . 10106 1 1150 . 1 1 90 90 TYR CB C 13 40.946 0.300 . 1 . . . . 90 TYR CB . 10106 1 1151 . 1 1 90 90 TYR CD1 C 13 132.626 0.300 . 1 . . . . 90 TYR CD1 . 10106 1 1152 . 1 1 90 90 TYR CD2 C 13 132.626 0.300 . 1 . . . . 90 TYR CD2 . 10106 1 1153 . 1 1 90 90 TYR CE1 C 13 117.854 0.300 . 1 . . . . 90 TYR CE1 . 10106 1 1154 . 1 1 90 90 TYR CE2 C 13 117.854 0.300 . 1 . . . . 90 TYR CE2 . 10106 1 1155 . 1 1 90 90 TYR N N 15 118.641 0.300 . 1 . . . . 90 TYR N . 10106 1 1156 . 1 1 91 91 LYS H H 1 8.049 0.030 . 1 . . . . 91 LYS H . 10106 1 1157 . 1 1 91 91 LYS HA H 1 3.126 0.030 . 1 . . . . 91 LYS HA . 10106 1 1158 . 1 1 91 91 LYS HB2 H 1 1.633 0.030 . 2 . . . . 91 LYS HB2 . 10106 1 1159 . 1 1 91 91 LYS HB3 H 1 1.208 0.030 . 2 . . . . 91 LYS HB3 . 10106 1 1160 . 1 1 91 91 LYS HG2 H 1 0.839 0.030 . 2 . . . . 91 LYS HG2 . 10106 1 1161 . 1 1 91 91 LYS HG3 H 1 1.112 0.030 . 2 . . . . 91 LYS HG3 . 10106 1 1162 . 1 1 91 91 LYS HD2 H 1 1.360 0.030 . 2 . . . . 91 LYS HD2 . 10106 1 1163 . 1 1 91 91 LYS HD3 H 1 1.412 0.030 . 2 . . . . 91 LYS HD3 . 10106 1 1164 . 1 1 91 91 LYS HE2 H 1 2.821 0.030 . 1 . . . . 91 LYS HE2 . 10106 1 1165 . 1 1 91 91 LYS HE3 H 1 2.821 0.030 . 1 . . . . 91 LYS HE3 . 10106 1 1166 . 1 1 91 91 LYS C C 13 177.141 0.300 . 1 . . . . 91 LYS C . 10106 1 1167 . 1 1 91 91 LYS CA C 13 57.795 0.300 . 1 . . . . 91 LYS CA . 10106 1 1168 . 1 1 91 91 LYS CB C 13 32.820 0.300 . 1 . . . . 91 LYS CB . 10106 1 1169 . 1 1 91 91 LYS CG C 13 24.669 0.300 . 1 . . . . 91 LYS CG . 10106 1 1170 . 1 1 91 91 LYS CD C 13 28.956 0.300 . 1 . . . . 91 LYS CD . 10106 1 1171 . 1 1 91 91 LYS CE C 13 42.207 0.300 . 1 . . . . 91 LYS CE . 10106 1 1172 . 1 1 91 91 LYS N N 15 124.911 0.300 . 1 . . . . 91 LYS N . 10106 1 1173 . 1 1 92 92 GLU H H 1 8.798 0.030 . 1 . . . . 92 GLU H . 10106 1 1174 . 1 1 92 92 GLU HA H 1 4.288 0.030 . 1 . . . . 92 GLU HA . 10106 1 1175 . 1 1 92 92 GLU HB2 H 1 2.038 0.030 . 1 . . . . 92 GLU HB2 . 10106 1 1176 . 1 1 92 92 GLU HB3 H 1 2.038 0.030 . 1 . . . . 92 GLU HB3 . 10106 1 1177 . 1 1 92 92 GLU HG2 H 1 2.290 0.030 . 1 . . . . 92 GLU HG2 . 10106 1 1178 . 1 1 92 92 GLU HG3 H 1 2.290 0.030 . 1 . . . . 92 GLU HG3 . 10106 1 1179 . 1 1 92 92 GLU C C 13 176.148 0.300 . 1 . . . . 92 GLU C . 10106 1 1180 . 1 1 92 92 GLU CA C 13 56.826 0.300 . 1 . . . . 92 GLU CA . 10106 1 1181 . 1 1 92 92 GLU CB C 13 30.090 0.300 . 1 . . . . 92 GLU CB . 10106 1 1182 . 1 1 92 92 GLU CG C 13 35.991 0.300 . 1 . . . . 92 GLU CG . 10106 1 1183 . 1 1 92 92 GLU N N 15 119.998 0.300 . 1 . . . . 92 GLU N . 10106 1 1184 . 1 1 93 93 ASN H H 1 8.267 0.030 . 1 . . . . 93 ASN H . 10106 1 1185 . 1 1 93 93 ASN HA H 1 4.780 0.030 . 1 . . . . 93 ASN HA . 10106 1 1186 . 1 1 93 93 ASN HB2 H 1 2.953 0.030 . 2 . . . . 93 ASN HB2 . 10106 1 1187 . 1 1 93 93 ASN HB3 H 1 2.871 0.030 . 2 . . . . 93 ASN HB3 . 10106 1 1188 . 1 1 93 93 ASN HD21 H 1 7.850 0.030 . 2 . . . . 93 ASN HD21 . 10106 1 1189 . 1 1 93 93 ASN HD22 H 1 6.990 0.030 . 2 . . . . 93 ASN HD22 . 10106 1 1190 . 1 1 93 93 ASN C C 13 175.348 0.300 . 1 . . . . 93 ASN C . 10106 1 1191 . 1 1 93 93 ASN CA C 13 53.320 0.300 . 1 . . . . 93 ASN CA . 10106 1 1192 . 1 1 93 93 ASN CB C 13 39.195 0.300 . 1 . . . . 93 ASN CB . 10106 1 1193 . 1 1 93 93 ASN N N 15 118.941 0.300 . 1 . . . . 93 ASN N . 10106 1 1194 . 1 1 93 93 ASN ND2 N 15 113.240 0.300 . 1 . . . . 93 ASN ND2 . 10106 1 1195 . 1 1 94 94 GLN H H 1 8.226 0.030 . 1 . . . . 94 GLN H . 10106 1 1196 . 1 1 94 94 GLN HA H 1 4.348 0.030 . 1 . . . . 94 GLN HA . 10106 1 1197 . 1 1 94 94 GLN HB2 H 1 2.156 0.030 . 2 . . . . 94 GLN HB2 . 10106 1 1198 . 1 1 94 94 GLN HB3 H 1 1.994 0.030 . 2 . . . . 94 GLN HB3 . 10106 1 1199 . 1 1 94 94 GLN HG2 H 1 2.342 0.030 . 2 . . . . 94 GLN HG2 . 10106 1 1200 . 1 1 94 94 GLN HG3 H 1 2.392 0.030 . 2 . . . . 94 GLN HG3 . 10106 1 1201 . 1 1 94 94 GLN HE21 H 1 7.547 0.030 . 2 . . . . 94 GLN HE21 . 10106 1 1202 . 1 1 94 94 GLN HE22 H 1 6.896 0.030 . 2 . . . . 94 GLN HE22 . 10106 1 1203 . 1 1 94 94 GLN C C 13 175.727 0.300 . 1 . . . . 94 GLN C . 10106 1 1204 . 1 1 94 94 GLN CA C 13 56.181 0.300 . 1 . . . . 94 GLN CA . 10106 1 1205 . 1 1 94 94 GLN CB C 13 29.530 0.300 . 1 . . . . 94 GLN CB . 10106 1 1206 . 1 1 94 94 GLN CG C 13 33.769 0.300 . 1 . . . . 94 GLN CG . 10106 1 1207 . 1 1 94 94 GLN N N 15 120.522 0.300 . 1 . . . . 94 GLN N . 10106 1 1208 . 1 1 94 94 GLN NE2 N 15 113.236 0.300 . 1 . . . . 94 GLN NE2 . 10106 1 1209 . 1 1 95 95 ASP H H 1 8.431 0.030 . 1 . . . . 95 ASP H . 10106 1 1210 . 1 1 95 95 ASP HA H 1 4.679 0.030 . 1 . . . . 95 ASP HA . 10106 1 1211 . 1 1 95 95 ASP HB2 H 1 2.754 0.030 . 2 . . . . 95 ASP HB2 . 10106 1 1212 . 1 1 95 95 ASP HB3 H 1 2.646 0.030 . 2 . . . . 95 ASP HB3 . 10106 1 1213 . 1 1 95 95 ASP C C 13 176.236 0.300 . 1 . . . . 95 ASP C . 10106 1 1214 . 1 1 95 95 ASP CA C 13 54.501 0.300 . 1 . . . . 95 ASP CA . 10106 1 1215 . 1 1 95 95 ASP CB C 13 41.336 0.300 . 1 . . . . 95 ASP CB . 10106 1 1216 . 1 1 95 95 ASP N N 15 121.573 0.300 . 1 . . . . 95 ASP N . 10106 1 1217 . 1 1 96 96 SER H H 1 8.271 0.030 . 1 . . . . 96 SER H . 10106 1 1218 . 1 1 96 96 SER HA H 1 4.501 0.030 . 1 . . . . 96 SER HA . 10106 1 1219 . 1 1 96 96 SER HB2 H 1 3.939 0.030 . 2 . . . . 96 SER HB2 . 10106 1 1220 . 1 1 96 96 SER HB3 H 1 3.892 0.030 . 2 . . . . 96 SER HB3 . 10106 1 1221 . 1 1 96 96 SER CA C 13 58.500 0.300 . 1 . . . . 96 SER CA . 10106 1 1222 . 1 1 96 96 SER CB C 13 64.100 0.300 . 1 . . . . 96 SER CB . 10106 1 1223 . 1 1 96 96 SER N N 15 116.391 0.300 . 1 . . . . 96 SER N . 10106 1 1224 . 1 1 97 97 GLY H H 1 8.311 0.030 . 1 . . . . 97 GLY H . 10106 1 1225 . 1 1 97 97 GLY HA2 H 1 4.140 0.030 . 1 . . . . 97 GLY HA2 . 10106 1 1226 . 1 1 97 97 GLY HA3 H 1 4.140 0.030 . 1 . . . . 97 GLY HA3 . 10106 1 1227 . 1 1 97 97 GLY C C 13 171.884 0.300 . 1 . . . . 97 GLY C . 10106 1 1228 . 1 1 97 97 GLY CA C 13 44.764 0.300 . 1 . . . . 97 GLY CA . 10106 1 1229 . 1 1 97 97 GLY N N 15 110.777 0.300 . 1 . . . . 97 GLY N . 10106 1 1230 . 1 1 98 98 PRO HA H 1 4.495 0.030 . 1 . . . . 98 PRO HA . 10106 1 1231 . 1 1 98 98 PRO HB2 H 1 2.182 0.030 . 2 . . . . 98 PRO HB2 . 10106 1 1232 . 1 1 98 98 PRO HB3 H 1 2.416 0.030 . 2 . . . . 98 PRO HB3 . 10106 1 1233 . 1 1 98 98 PRO HG2 H 1 1.865 0.030 . 2 . . . . 98 PRO HG2 . 10106 1 1234 . 1 1 98 98 PRO HG3 H 1 1.950 0.030 . 2 . . . . 98 PRO HG3 . 10106 1 1235 . 1 1 98 98 PRO HD2 H 1 3.641 0.030 . 1 . . . . 98 PRO HD2 . 10106 1 1236 . 1 1 98 98 PRO HD3 H 1 3.641 0.030 . 1 . . . . 98 PRO HD3 . 10106 1 1237 . 1 1 98 98 PRO CA C 13 63.294 0.300 . 1 . . . . 98 PRO CA . 10106 1 1238 . 1 1 98 98 PRO CB C 13 34.798 0.300 . 1 . . . . 98 PRO CB . 10106 1 1239 . 1 1 98 98 PRO CG C 13 24.816 0.300 . 1 . . . . 98 PRO CG . 10106 1 1240 . 1 1 98 98 PRO CD C 13 49.855 0.300 . 1 . . . . 98 PRO CD . 10106 1 stop_ save_