data_10109 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 10109 _Entry.Title ; Solution Structure of the PDZ Domain from Mouse Glutamate Receptor Interacting Protein 1A-L (GRIP1) Homolog ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2007-02-13 _Entry.Accession_date 2007-02-16 _Entry.Last_release_date . _Entry.Original_release_date . _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version production.3.0.2.8 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.Entry_ID 1 M. Sato . . . 10109 2 N. Tochio . . . 10109 3 S. Koshiba . . . 10109 4 M. Inoue . . . 10109 5 T. Kigawa . . . 10109 6 S. Yokoyama . . . 10109 stop_ loop_ _SG_project.SG_project_ID _SG_project.Project_name _SG_project.Full_name_of_center _SG_project.Initial_of_center _SG_project.Entry_ID 1 'Protein 3000 Project' 'Protein Research Group, RIKEN Genomic Sciences Center' 'RIKEN GSC' 10109 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 10109 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 457 10109 '15N chemical shifts' 111 10109 '1H chemical shifts' 755 10109 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 2 . . 2010-05-25 2007-02-13 update BMRB 'update entity name' 10109 1 . . 2008-08-29 2007-02-13 original author 'original release' 10109 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 1V5Q 'BMRB Entry Tracking System' 10109 stop_ save_ ############### # Citations # ############### save_citation_1 _Citation.Sf_category citations _Citation.Sf_framecode citation_1 _Citation.Entry_ID 10109 _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 PDZ Domain from Mouse Glutamate Receptor Interacting Protein 1A-L (GRIP1) Homolog ; _Citation.Status 'in preparation' _Citation.Type journal _Citation.Journal_abbrev 'Not known' _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. Sato . . . 10109 1 2 N. Tochio . . . 10109 1 3 S. Koshiba . . . 10109 1 4 M. Inoue . . . 10109 1 5 T. Kigawa . . . 10109 1 6 S. Yokoyama . . . 10109 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 10109 _Assembly.ID 1 _Assembly.Name 'Glutamate Receptor Interacting Protein 1A-L Homolog' _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 'Glutamate Receptor Interacting Protein 1A-L Homolog' 1 $entity_1 A . yes native no no . . . 10109 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 yes PDB 1V5Q . . 'solution NMR' . . . 10109 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 10109 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name 'Glutamate Receptor Interacting Protein 1A-L Homolog' _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 ; GSSGSSGAGQVVHTETTEVV LTADPVTGFGIQLQGSVFAT ETLSSPPLISYIEADSPAER CGVLQIGDRVMAINGIPTED STFEEANQLLRDSSITSKVT LEIEFDVAESVIPSSGSGPS SG ; _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 122 _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 1P1E . "Structural Insights Into The Inter-Domain Chaperoning Of Tandem Pdz Domains In Glutamate Receptor Interacting Proteins" . . . . . 82.79 101 100.00 100.00 4.49e-64 . . . . 10109 1 2 no PDB 1V5Q . "Solution Structure Of The Pdz Domain From Mouse Glutamate Receptor Interacting Protein 1a-L (Grip1) Homolog" . . . . . 100.00 122 100.00 100.00 6.65e-78 . . . . 10109 1 3 no REF XP_007506268 . "PREDICTED: glutamate receptor-interacting protein 1-like, partial [Monodelphis domestica]" . . . . . 90.16 161 97.27 99.09 3.52e-68 . . . . 10109 1 stop_ loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID 'PDZ domain' . 10109 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 . 10109 1 2 . SER . 10109 1 3 . SER . 10109 1 4 . GLY . 10109 1 5 . SER . 10109 1 6 . SER . 10109 1 7 . GLY . 10109 1 8 . ALA . 10109 1 9 . GLY . 10109 1 10 . GLN . 10109 1 11 . VAL . 10109 1 12 . VAL . 10109 1 13 . HIS . 10109 1 14 . THR . 10109 1 15 . GLU . 10109 1 16 . THR . 10109 1 17 . THR . 10109 1 18 . GLU . 10109 1 19 . VAL . 10109 1 20 . VAL . 10109 1 21 . LEU . 10109 1 22 . THR . 10109 1 23 . ALA . 10109 1 24 . ASP . 10109 1 25 . PRO . 10109 1 26 . VAL . 10109 1 27 . THR . 10109 1 28 . GLY . 10109 1 29 . PHE . 10109 1 30 . GLY . 10109 1 31 . ILE . 10109 1 32 . GLN . 10109 1 33 . LEU . 10109 1 34 . GLN . 10109 1 35 . GLY . 10109 1 36 . SER . 10109 1 37 . VAL . 10109 1 38 . PHE . 10109 1 39 . ALA . 10109 1 40 . THR . 10109 1 41 . GLU . 10109 1 42 . THR . 10109 1 43 . LEU . 10109 1 44 . SER . 10109 1 45 . SER . 10109 1 46 . PRO . 10109 1 47 . PRO . 10109 1 48 . LEU . 10109 1 49 . ILE . 10109 1 50 . SER . 10109 1 51 . TYR . 10109 1 52 . ILE . 10109 1 53 . GLU . 10109 1 54 . ALA . 10109 1 55 . ASP . 10109 1 56 . SER . 10109 1 57 . PRO . 10109 1 58 . ALA . 10109 1 59 . GLU . 10109 1 60 . ARG . 10109 1 61 . CYS . 10109 1 62 . GLY . 10109 1 63 . VAL . 10109 1 64 . LEU . 10109 1 65 . GLN . 10109 1 66 . ILE . 10109 1 67 . GLY . 10109 1 68 . ASP . 10109 1 69 . ARG . 10109 1 70 . VAL . 10109 1 71 . MET . 10109 1 72 . ALA . 10109 1 73 . ILE . 10109 1 74 . ASN . 10109 1 75 . GLY . 10109 1 76 . ILE . 10109 1 77 . PRO . 10109 1 78 . THR . 10109 1 79 . GLU . 10109 1 80 . ASP . 10109 1 81 . SER . 10109 1 82 . THR . 10109 1 83 . PHE . 10109 1 84 . GLU . 10109 1 85 . GLU . 10109 1 86 . ALA . 10109 1 87 . ASN . 10109 1 88 . GLN . 10109 1 89 . LEU . 10109 1 90 . LEU . 10109 1 91 . ARG . 10109 1 92 . ASP . 10109 1 93 . SER . 10109 1 94 . SER . 10109 1 95 . ILE . 10109 1 96 . THR . 10109 1 97 . SER . 10109 1 98 . LYS . 10109 1 99 . VAL . 10109 1 100 . THR . 10109 1 101 . LEU . 10109 1 102 . GLU . 10109 1 103 . ILE . 10109 1 104 . GLU . 10109 1 105 . PHE . 10109 1 106 . ASP . 10109 1 107 . VAL . 10109 1 108 . ALA . 10109 1 109 . GLU . 10109 1 110 . SER . 10109 1 111 . VAL . 10109 1 112 . ILE . 10109 1 113 . PRO . 10109 1 114 . SER . 10109 1 115 . SER . 10109 1 116 . GLY . 10109 1 117 . SER . 10109 1 118 . GLY . 10109 1 119 . PRO . 10109 1 120 . SER . 10109 1 121 . SER . 10109 1 122 . GLY . 10109 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 10109 1 . SER 2 2 10109 1 . SER 3 3 10109 1 . GLY 4 4 10109 1 . SER 5 5 10109 1 . SER 6 6 10109 1 . GLY 7 7 10109 1 . ALA 8 8 10109 1 . GLY 9 9 10109 1 . GLN 10 10 10109 1 . VAL 11 11 10109 1 . VAL 12 12 10109 1 . HIS 13 13 10109 1 . THR 14 14 10109 1 . GLU 15 15 10109 1 . THR 16 16 10109 1 . THR 17 17 10109 1 . GLU 18 18 10109 1 . VAL 19 19 10109 1 . VAL 20 20 10109 1 . LEU 21 21 10109 1 . THR 22 22 10109 1 . ALA 23 23 10109 1 . ASP 24 24 10109 1 . PRO 25 25 10109 1 . VAL 26 26 10109 1 . THR 27 27 10109 1 . GLY 28 28 10109 1 . PHE 29 29 10109 1 . GLY 30 30 10109 1 . ILE 31 31 10109 1 . GLN 32 32 10109 1 . LEU 33 33 10109 1 . GLN 34 34 10109 1 . GLY 35 35 10109 1 . SER 36 36 10109 1 . VAL 37 37 10109 1 . PHE 38 38 10109 1 . ALA 39 39 10109 1 . THR 40 40 10109 1 . GLU 41 41 10109 1 . THR 42 42 10109 1 . LEU 43 43 10109 1 . SER 44 44 10109 1 . SER 45 45 10109 1 . PRO 46 46 10109 1 . PRO 47 47 10109 1 . LEU 48 48 10109 1 . ILE 49 49 10109 1 . SER 50 50 10109 1 . TYR 51 51 10109 1 . ILE 52 52 10109 1 . GLU 53 53 10109 1 . ALA 54 54 10109 1 . ASP 55 55 10109 1 . SER 56 56 10109 1 . PRO 57 57 10109 1 . ALA 58 58 10109 1 . GLU 59 59 10109 1 . ARG 60 60 10109 1 . CYS 61 61 10109 1 . GLY 62 62 10109 1 . VAL 63 63 10109 1 . LEU 64 64 10109 1 . GLN 65 65 10109 1 . ILE 66 66 10109 1 . GLY 67 67 10109 1 . ASP 68 68 10109 1 . ARG 69 69 10109 1 . VAL 70 70 10109 1 . MET 71 71 10109 1 . ALA 72 72 10109 1 . ILE 73 73 10109 1 . ASN 74 74 10109 1 . GLY 75 75 10109 1 . ILE 76 76 10109 1 . PRO 77 77 10109 1 . THR 78 78 10109 1 . GLU 79 79 10109 1 . ASP 80 80 10109 1 . SER 81 81 10109 1 . THR 82 82 10109 1 . PHE 83 83 10109 1 . GLU 84 84 10109 1 . GLU 85 85 10109 1 . ALA 86 86 10109 1 . ASN 87 87 10109 1 . GLN 88 88 10109 1 . LEU 89 89 10109 1 . LEU 90 90 10109 1 . ARG 91 91 10109 1 . ASP 92 92 10109 1 . SER 93 93 10109 1 . SER 94 94 10109 1 . ILE 95 95 10109 1 . THR 96 96 10109 1 . SER 97 97 10109 1 . LYS 98 98 10109 1 . VAL 99 99 10109 1 . THR 100 100 10109 1 . LEU 101 101 10109 1 . GLU 102 102 10109 1 . ILE 103 103 10109 1 . GLU 104 104 10109 1 . PHE 105 105 10109 1 . ASP 106 106 10109 1 . VAL 107 107 10109 1 . ALA 108 108 10109 1 . GLU 109 109 10109 1 . SER 110 110 10109 1 . VAL 111 111 10109 1 . ILE 112 112 10109 1 . PRO 113 113 10109 1 . SER 114 114 10109 1 . SER 115 115 10109 1 . GLY 116 116 10109 1 . SER 117 117 10109 1 . GLY 118 118 10109 1 . PRO 119 119 10109 1 . SER 120 120 10109 1 . SER 121 121 10109 1 . GLY 122 122 10109 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 10109 _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 . 10090 . . . mouse . . Eukaryota Metazoa Mus musculus . . . . . . . . . . . . . . . . . . . . . 10109 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 10109 _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 . . P030203-74 . . . . . . 10109 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 10109 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 'PDZ domain' '[U-13C; U-15N]' . . 1 $entity_1 . . 0.59 . . mM . . . . 10109 1 2 phosphate . . . . . . buffer 20 . . mM . . . . 10109 1 3 NaCl . . . . . . salt 100 . . mM . . . . 10109 1 4 d-DTT . . . . . . salt 1 . . mM . . . . 10109 1 5 NaN3 . . . . . . . 0.02 . . % . . . . 10109 1 6 H2O . . . . . . solvent 90 . . % . . . . 10109 1 7 D2O . . . . . . solvent 10 . . % . . . . 10109 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 10109 _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 10109 1 pH 6.0 0.05 pH 10109 1 pressure 1 0.001 atm 10109 1 temperature 298 0.1 K 10109 1 stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID 10109 _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 . . 10109 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection 10109 1 stop_ save_ save_software_2 _Software.Sf_category software _Software.Sf_framecode software_2 _Software.Entry_ID 10109 _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.' . . 10109 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 10109 2 stop_ save_ save_software_3 _Software.Sf_category software _Software.Sf_framecode software_3 _Software.Entry_ID 10109 _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 'Johnson, B.A.' . . 10109 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 10109 3 stop_ save_ save_software_4 _Software.Sf_category software _Software.Sf_framecode software_4 _Software.Entry_ID 10109 _Software.ID 4 _Software.Name Kujira _Software.Version 0.863 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Kobayashi, N.' . . 10109 4 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 10109 4 stop_ save_ save_software_5 _Software.Sf_category software _Software.Sf_framecode software_5 _Software.Entry_ID 10109 _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.' . . 10109 5 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID refinement 10109 5 'structure solution' 10109 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 10109 _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_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 10109 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 Bruker AVANCE . 800 . . . 10109 1 stop_ save_ ############################# # NMR applied experiments # ############################# save_experiment_list _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode experiment_list _Experiment_list.Entry_ID 10109 _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 13C-separated NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $condition_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 10109 1 2 '3D 15N-separated NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $condition_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 10109 1 stop_ 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 10109 _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 . . . . . . . . . 10109 1 H 1 DSS 'methyl protons' . . . . ppm 0.0 . indirect 1.0 . . . . . . . . . 10109 1 N 15 DSS 'methyl protons' . . . . ppm 0.0 . indirect 0.101329118 . . . . . . . . . 10109 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 10109 _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 13C-separated NOESY' 1 $sample_1 isotropic 10109 1 2 '3D 15N-separated NOESY' 1 $sample_1 isotropic 10109 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 5 5 SER HA H 1 4.524 0.030 . 1 . . . . 5 SER HA . 10109 1 2 . 1 1 5 5 SER HB2 H 1 3.894 0.030 . 1 . . . . 5 SER HB2 . 10109 1 3 . 1 1 5 5 SER HB3 H 1 3.894 0.030 . 1 . . . . 5 SER HB3 . 10109 1 4 . 1 1 5 5 SER C C 13 174.910 0.300 . 1 . . . . 5 SER C . 10109 1 5 . 1 1 5 5 SER CA C 13 58.395 0.300 . 1 . . . . 5 SER CA . 10109 1 6 . 1 1 5 5 SER CB C 13 63.955 0.300 . 1 . . . . 5 SER CB . 10109 1 7 . 1 1 6 6 SER H H 1 8.457 0.030 . 1 . . . . 6 SER H . 10109 1 8 . 1 1 6 6 SER HA H 1 4.526 0.030 . 1 . . . . 6 SER HA . 10109 1 9 . 1 1 6 6 SER HB2 H 1 3.951 0.030 . 2 . . . . 6 SER HB2 . 10109 1 10 . 1 1 6 6 SER HB3 H 1 3.898 0.030 . 2 . . . . 6 SER HB3 . 10109 1 11 . 1 1 6 6 SER C C 13 175.109 0.300 . 1 . . . . 6 SER C . 10109 1 12 . 1 1 6 6 SER CA C 13 58.708 0.300 . 1 . . . . 6 SER CA . 10109 1 13 . 1 1 6 6 SER CB C 13 63.815 0.300 . 1 . . . . 6 SER CB . 10109 1 14 . 1 1 6 6 SER N N 15 117.883 0.300 . 1 . . . . 6 SER N . 10109 1 15 . 1 1 7 7 GLY H H 1 8.427 0.030 . 1 . . . . 7 GLY H . 10109 1 16 . 1 1 7 7 GLY HA2 H 1 3.990 0.030 . 1 . . . . 7 GLY HA2 . 10109 1 17 . 1 1 7 7 GLY HA3 H 1 3.990 0.030 . 1 . . . . 7 GLY HA3 . 10109 1 18 . 1 1 7 7 GLY C C 13 173.971 0.300 . 1 . . . . 7 GLY C . 10109 1 19 . 1 1 7 7 GLY CA C 13 45.363 0.300 . 1 . . . . 7 GLY CA . 10109 1 20 . 1 1 7 7 GLY N N 15 110.861 0.300 . 1 . . . . 7 GLY N . 10109 1 21 . 1 1 8 8 ALA H H 1 8.211 0.030 . 1 . . . . 8 ALA H . 10109 1 22 . 1 1 8 8 ALA HA H 1 4.368 0.030 . 1 . . . . 8 ALA HA . 10109 1 23 . 1 1 8 8 ALA HB1 H 1 1.413 0.030 . 1 . . . . 8 ALA HB . 10109 1 24 . 1 1 8 8 ALA HB2 H 1 1.413 0.030 . 1 . . . . 8 ALA HB . 10109 1 25 . 1 1 8 8 ALA HB3 H 1 1.413 0.030 . 1 . . . . 8 ALA HB . 10109 1 26 . 1 1 8 8 ALA C C 13 178.293 0.300 . 1 . . . . 8 ALA C . 10109 1 27 . 1 1 8 8 ALA CA C 13 52.694 0.300 . 1 . . . . 8 ALA CA . 10109 1 28 . 1 1 8 8 ALA CB C 13 19.331 0.300 . 1 . . . . 8 ALA CB . 10109 1 29 . 1 1 8 8 ALA N N 15 123.770 0.300 . 1 . . . . 8 ALA N . 10109 1 30 . 1 1 9 9 GLY H H 1 8.439 0.030 . 1 . . . . 9 GLY H . 10109 1 31 . 1 1 9 9 GLY HA2 H 1 3.966 0.030 . 1 . . . . 9 GLY HA2 . 10109 1 32 . 1 1 9 9 GLY HA3 H 1 3.966 0.030 . 1 . . . . 9 GLY HA3 . 10109 1 33 . 1 1 9 9 GLY C C 13 173.947 0.300 . 1 . . . . 9 GLY C . 10109 1 34 . 1 1 9 9 GLY CA C 13 45.365 0.300 . 1 . . . . 9 GLY CA . 10109 1 35 . 1 1 9 9 GLY N N 15 108.222 0.300 . 1 . . . . 9 GLY N . 10109 1 36 . 1 1 10 10 GLN H H 1 8.118 0.030 . 1 . . . . 10 GLN H . 10109 1 37 . 1 1 10 10 GLN HA H 1 4.513 0.030 . 1 . . . . 10 GLN HA . 10109 1 38 . 1 1 10 10 GLN HB2 H 1 2.061 0.030 . 2 . . . . 10 GLN HB2 . 10109 1 39 . 1 1 10 10 GLN HB3 H 1 1.960 0.030 . 2 . . . . 10 GLN HB3 . 10109 1 40 . 1 1 10 10 GLN HG2 H 1 2.306 0.030 . 1 . . . . 10 GLN HG2 . 10109 1 41 . 1 1 10 10 GLN HG3 H 1 2.306 0.030 . 1 . . . . 10 GLN HG3 . 10109 1 42 . 1 1 10 10 GLN HE21 H 1 7.502 0.030 . 2 . . . . 10 GLN HE21 . 10109 1 43 . 1 1 10 10 GLN HE22 H 1 6.857 0.030 . 2 . . . . 10 GLN HE22 . 10109 1 44 . 1 1 10 10 GLN C C 13 175.695 0.300 . 1 . . . . 10 GLN C . 10109 1 45 . 1 1 10 10 GLN CA C 13 55.544 0.300 . 1 . . . . 10 GLN CA . 10109 1 46 . 1 1 10 10 GLN CB C 13 30.131 0.300 . 1 . . . . 10 GLN CB . 10109 1 47 . 1 1 10 10 GLN CG C 13 33.830 0.300 . 1 . . . . 10 GLN CG . 10109 1 48 . 1 1 10 10 GLN N N 15 119.523 0.300 . 1 . . . . 10 GLN N . 10109 1 49 . 1 1 10 10 GLN NE2 N 15 112.283 0.300 . 1 . . . . 10 GLN NE2 . 10109 1 50 . 1 1 11 11 VAL H H 1 8.432 0.030 . 1 . . . . 11 VAL H . 10109 1 51 . 1 1 11 11 VAL HA H 1 4.181 0.030 . 1 . . . . 11 VAL HA . 10109 1 52 . 1 1 11 11 VAL HB H 1 2.022 0.030 . 1 . . . . 11 VAL HB . 10109 1 53 . 1 1 11 11 VAL HG11 H 1 0.940 0.030 . 1 . . . . 11 VAL HG1 . 10109 1 54 . 1 1 11 11 VAL HG12 H 1 0.940 0.030 . 1 . . . . 11 VAL HG1 . 10109 1 55 . 1 1 11 11 VAL HG13 H 1 0.940 0.030 . 1 . . . . 11 VAL HG1 . 10109 1 56 . 1 1 11 11 VAL HG21 H 1 0.863 0.030 . 1 . . . . 11 VAL HG2 . 10109 1 57 . 1 1 11 11 VAL HG22 H 1 0.863 0.030 . 1 . . . . 11 VAL HG2 . 10109 1 58 . 1 1 11 11 VAL HG23 H 1 0.863 0.030 . 1 . . . . 11 VAL HG2 . 10109 1 59 . 1 1 11 11 VAL C C 13 175.683 0.300 . 1 . . . . 11 VAL C . 10109 1 60 . 1 1 11 11 VAL CA C 13 62.325 0.300 . 1 . . . . 11 VAL CA . 10109 1 61 . 1 1 11 11 VAL CB C 13 32.951 0.300 . 1 . . . . 11 VAL CB . 10109 1 62 . 1 1 11 11 VAL CG1 C 13 20.741 0.300 . 2 . . . . 11 VAL CG1 . 10109 1 63 . 1 1 11 11 VAL CG2 C 13 20.979 0.300 . 2 . . . . 11 VAL CG2 . 10109 1 64 . 1 1 11 11 VAL N N 15 122.559 0.300 . 1 . . . . 11 VAL N . 10109 1 65 . 1 1 12 12 VAL H H 1 8.330 0.030 . 1 . . . . 12 VAL H . 10109 1 66 . 1 1 12 12 VAL HA H 1 4.553 0.030 . 1 . . . . 12 VAL HA . 10109 1 67 . 1 1 12 12 VAL HB H 1 1.932 0.030 . 1 . . . . 12 VAL HB . 10109 1 68 . 1 1 12 12 VAL HG11 H 1 0.863 0.030 . 1 . . . . 12 VAL HG1 . 10109 1 69 . 1 1 12 12 VAL HG12 H 1 0.863 0.030 . 1 . . . . 12 VAL HG1 . 10109 1 70 . 1 1 12 12 VAL HG13 H 1 0.863 0.030 . 1 . . . . 12 VAL HG1 . 10109 1 71 . 1 1 12 12 VAL HG21 H 1 0.827 0.030 . 1 . . . . 12 VAL HG2 . 10109 1 72 . 1 1 12 12 VAL HG22 H 1 0.827 0.030 . 1 . . . . 12 VAL HG2 . 10109 1 73 . 1 1 12 12 VAL HG23 H 1 0.827 0.030 . 1 . . . . 12 VAL HG2 . 10109 1 74 . 1 1 12 12 VAL C C 13 175.683 0.300 . 1 . . . . 12 VAL C . 10109 1 75 . 1 1 12 12 VAL CA C 13 61.194 0.300 . 1 . . . . 12 VAL CA . 10109 1 76 . 1 1 12 12 VAL CB C 13 33.906 0.300 . 1 . . . . 12 VAL CB . 10109 1 77 . 1 1 12 12 VAL CG1 C 13 20.596 0.300 . 2 . . . . 12 VAL CG1 . 10109 1 78 . 1 1 12 12 VAL CG2 C 13 21.188 0.300 . 2 . . . . 12 VAL CG2 . 10109 1 79 . 1 1 12 12 VAL N N 15 124.676 0.300 . 1 . . . . 12 VAL N . 10109 1 80 . 1 1 13 13 HIS H H 1 8.742 0.030 . 1 . . . . 13 HIS H . 10109 1 81 . 1 1 13 13 HIS HA H 1 5.001 0.030 . 1 . . . . 13 HIS HA . 10109 1 82 . 1 1 13 13 HIS HB2 H 1 3.304 0.030 . 2 . . . . 13 HIS HB2 . 10109 1 83 . 1 1 13 13 HIS HB3 H 1 3.254 0.030 . 2 . . . . 13 HIS HB3 . 10109 1 84 . 1 1 13 13 HIS HD2 H 1 7.186 0.030 . 1 . . . . 13 HIS HD2 . 10109 1 85 . 1 1 13 13 HIS HE1 H 1 8.542 0.030 . 1 . . . . 13 HIS HE1 . 10109 1 86 . 1 1 13 13 HIS C C 13 173.037 0.300 . 1 . . . . 13 HIS C . 10109 1 87 . 1 1 13 13 HIS CA C 13 54.738 0.300 . 1 . . . . 13 HIS CA . 10109 1 88 . 1 1 13 13 HIS CB C 13 30.375 0.300 . 1 . . . . 13 HIS CB . 10109 1 89 . 1 1 13 13 HIS CD2 C 13 120.229 0.300 . 1 . . . . 13 HIS CD2 . 10109 1 90 . 1 1 13 13 HIS CE1 C 13 136.302 0.300 . 1 . . . . 13 HIS CE1 . 10109 1 91 . 1 1 13 13 HIS N N 15 122.531 0.300 . 1 . . . . 13 HIS N . 10109 1 92 . 1 1 14 14 THR H H 1 8.340 0.030 . 1 . . . . 14 THR H . 10109 1 93 . 1 1 14 14 THR HA H 1 5.035 0.030 . 1 . . . . 14 THR HA . 10109 1 94 . 1 1 14 14 THR HB H 1 3.928 0.030 . 1 . . . . 14 THR HB . 10109 1 95 . 1 1 14 14 THR HG21 H 1 1.062 0.030 . 1 . . . . 14 THR HG2 . 10109 1 96 . 1 1 14 14 THR HG22 H 1 1.062 0.030 . 1 . . . . 14 THR HG2 . 10109 1 97 . 1 1 14 14 THR HG23 H 1 1.062 0.030 . 1 . . . . 14 THR HG2 . 10109 1 98 . 1 1 14 14 THR C C 13 173.886 0.300 . 1 . . . . 14 THR C . 10109 1 99 . 1 1 14 14 THR CA C 13 60.719 0.300 . 1 . . . . 14 THR CA . 10109 1 100 . 1 1 14 14 THR CB C 13 71.242 0.300 . 1 . . . . 14 THR CB . 10109 1 101 . 1 1 14 14 THR CG2 C 13 21.967 0.300 . 1 . . . . 14 THR CG2 . 10109 1 102 . 1 1 14 14 THR N N 15 114.937 0.300 . 1 . . . . 14 THR N . 10109 1 103 . 1 1 15 15 GLU H H 1 8.451 0.030 . 1 . . . . 15 GLU H . 10109 1 104 . 1 1 15 15 GLU HA H 1 4.497 0.030 . 1 . . . . 15 GLU HA . 10109 1 105 . 1 1 15 15 GLU HB2 H 1 1.669 0.030 . 2 . . . . 15 GLU HB2 . 10109 1 106 . 1 1 15 15 GLU HB3 H 1 1.101 0.030 . 2 . . . . 15 GLU HB3 . 10109 1 107 . 1 1 15 15 GLU HG2 H 1 2.185 0.030 . 2 . . . . 15 GLU HG2 . 10109 1 108 . 1 1 15 15 GLU HG3 H 1 2.144 0.030 . 2 . . . . 15 GLU HG3 . 10109 1 109 . 1 1 15 15 GLU C C 13 173.765 0.300 . 1 . . . . 15 GLU C . 10109 1 110 . 1 1 15 15 GLU CA C 13 54.825 0.300 . 1 . . . . 15 GLU CA . 10109 1 111 . 1 1 15 15 GLU CB C 13 33.479 0.300 . 1 . . . . 15 GLU CB . 10109 1 112 . 1 1 15 15 GLU CG C 13 36.384 0.300 . 1 . . . . 15 GLU CG . 10109 1 113 . 1 1 15 15 GLU N N 15 123.141 0.300 . 1 . . . . 15 GLU N . 10109 1 114 . 1 1 16 16 THR H H 1 8.100 0.030 . 1 . . . . 16 THR H . 10109 1 115 . 1 1 16 16 THR HA H 1 5.716 0.030 . 1 . . . . 16 THR HA . 10109 1 116 . 1 1 16 16 THR HB H 1 4.103 0.030 . 1 . . . . 16 THR HB . 10109 1 117 . 1 1 16 16 THR HG21 H 1 1.157 0.030 . 1 . . . . 16 THR HG2 . 10109 1 118 . 1 1 16 16 THR HG22 H 1 1.157 0.030 . 1 . . . . 16 THR HG2 . 10109 1 119 . 1 1 16 16 THR HG23 H 1 1.157 0.030 . 1 . . . . 16 THR HG2 . 10109 1 120 . 1 1 16 16 THR C C 13 175.003 0.300 . 1 . . . . 16 THR C . 10109 1 121 . 1 1 16 16 THR CA C 13 59.680 0.300 . 1 . . . . 16 THR CA . 10109 1 122 . 1 1 16 16 THR CB C 13 71.841 0.300 . 1 . . . . 16 THR CB . 10109 1 123 . 1 1 16 16 THR CG2 C 13 21.431 0.300 . 1 . . . . 16 THR CG2 . 10109 1 124 . 1 1 16 16 THR N N 15 111.023 0.300 . 1 . . . . 16 THR N . 10109 1 125 . 1 1 17 17 THR H H 1 8.910 0.030 . 1 . . . . 17 THR H . 10109 1 126 . 1 1 17 17 THR HA H 1 4.720 0.030 . 1 . . . . 17 THR HA . 10109 1 127 . 1 1 17 17 THR HB H 1 4.215 0.030 . 1 . . . . 17 THR HB . 10109 1 128 . 1 1 17 17 THR HG21 H 1 1.031 0.030 . 1 . . . . 17 THR HG2 . 10109 1 129 . 1 1 17 17 THR HG22 H 1 1.031 0.030 . 1 . . . . 17 THR HG2 . 10109 1 130 . 1 1 17 17 THR HG23 H 1 1.031 0.030 . 1 . . . . 17 THR HG2 . 10109 1 131 . 1 1 17 17 THR C C 13 171.118 0.300 . 1 . . . . 17 THR C . 10109 1 132 . 1 1 17 17 THR CA C 13 60.947 0.300 . 1 . . . . 17 THR CA . 10109 1 133 . 1 1 17 17 THR CB C 13 70.235 0.300 . 1 . . . . 17 THR CB . 10109 1 134 . 1 1 17 17 THR CG2 C 13 19.359 0.300 . 1 . . . . 17 THR CG2 . 10109 1 135 . 1 1 17 17 THR N N 15 117.203 0.300 . 1 . . . . 17 THR N . 10109 1 136 . 1 1 18 18 GLU H H 1 8.060 0.030 . 1 . . . . 18 GLU H . 10109 1 137 . 1 1 18 18 GLU HA H 1 5.476 0.030 . 1 . . . . 18 GLU HA . 10109 1 138 . 1 1 18 18 GLU HB2 H 1 1.977 0.030 . 2 . . . . 18 GLU HB2 . 10109 1 139 . 1 1 18 18 GLU HB3 H 1 1.868 0.030 . 2 . . . . 18 GLU HB3 . 10109 1 140 . 1 1 18 18 GLU HG2 H 1 2.135 0.030 . 2 . . . . 18 GLU HG2 . 10109 1 141 . 1 1 18 18 GLU HG3 H 1 1.917 0.030 . 2 . . . . 18 GLU HG3 . 10109 1 142 . 1 1 18 18 GLU C C 13 175.671 0.300 . 1 . . . . 18 GLU C . 10109 1 143 . 1 1 18 18 GLU CA C 13 54.699 0.300 . 1 . . . . 18 GLU CA . 10109 1 144 . 1 1 18 18 GLU CB C 13 32.871 0.300 . 1 . . . . 18 GLU CB . 10109 1 145 . 1 1 18 18 GLU CG C 13 37.372 0.300 . 1 . . . . 18 GLU CG . 10109 1 146 . 1 1 18 18 GLU N N 15 123.587 0.300 . 1 . . . . 18 GLU N . 10109 1 147 . 1 1 19 19 VAL H H 1 9.152 0.030 . 1 . . . . 19 VAL H . 10109 1 148 . 1 1 19 19 VAL HA H 1 4.413 0.030 . 1 . . . . 19 VAL HA . 10109 1 149 . 1 1 19 19 VAL HB H 1 1.849 0.030 . 1 . . . . 19 VAL HB . 10109 1 150 . 1 1 19 19 VAL HG11 H 1 0.859 0.030 . 1 . . . . 19 VAL HG1 . 10109 1 151 . 1 1 19 19 VAL HG12 H 1 0.859 0.030 . 1 . . . . 19 VAL HG1 . 10109 1 152 . 1 1 19 19 VAL HG13 H 1 0.859 0.030 . 1 . . . . 19 VAL HG1 . 10109 1 153 . 1 1 19 19 VAL HG21 H 1 0.849 0.030 . 1 . . . . 19 VAL HG2 . 10109 1 154 . 1 1 19 19 VAL HG22 H 1 0.849 0.030 . 1 . . . . 19 VAL HG2 . 10109 1 155 . 1 1 19 19 VAL HG23 H 1 0.849 0.030 . 1 . . . . 19 VAL HG2 . 10109 1 156 . 1 1 19 19 VAL C C 13 173.267 0.300 . 1 . . . . 19 VAL C . 10109 1 157 . 1 1 19 19 VAL CA C 13 61.000 0.300 . 1 . . . . 19 VAL CA . 10109 1 158 . 1 1 19 19 VAL CB C 13 35.636 0.300 . 1 . . . . 19 VAL CB . 10109 1 159 . 1 1 19 19 VAL CG1 C 13 21.501 0.300 . 2 . . . . 19 VAL CG1 . 10109 1 160 . 1 1 19 19 VAL CG2 C 13 20.783 0.300 . 2 . . . . 19 VAL CG2 . 10109 1 161 . 1 1 19 19 VAL N N 15 125.019 0.300 . 1 . . . . 19 VAL N . 10109 1 162 . 1 1 20 20 VAL H H 1 8.553 0.030 . 1 . . . . 20 VAL H . 10109 1 163 . 1 1 20 20 VAL HA H 1 4.981 0.030 . 1 . . . . 20 VAL HA . 10109 1 164 . 1 1 20 20 VAL HB H 1 1.953 0.030 . 1 . . . . 20 VAL HB . 10109 1 165 . 1 1 20 20 VAL HG11 H 1 0.974 0.030 . 1 . . . . 20 VAL HG1 . 10109 1 166 . 1 1 20 20 VAL HG12 H 1 0.974 0.030 . 1 . . . . 20 VAL HG1 . 10109 1 167 . 1 1 20 20 VAL HG13 H 1 0.974 0.030 . 1 . . . . 20 VAL HG1 . 10109 1 168 . 1 1 20 20 VAL HG21 H 1 0.832 0.030 . 1 . . . . 20 VAL HG2 . 10109 1 169 . 1 1 20 20 VAL HG22 H 1 0.832 0.030 . 1 . . . . 20 VAL HG2 . 10109 1 170 . 1 1 20 20 VAL HG23 H 1 0.832 0.030 . 1 . . . . 20 VAL HG2 . 10109 1 171 . 1 1 20 20 VAL C C 13 176.210 0.300 . 1 . . . . 20 VAL C . 10109 1 172 . 1 1 20 20 VAL CA C 13 61.003 0.300 . 1 . . . . 20 VAL CA . 10109 1 173 . 1 1 20 20 VAL CB C 13 32.959 0.300 . 1 . . . . 20 VAL CB . 10109 1 174 . 1 1 20 20 VAL CG1 C 13 20.979 0.300 . 2 . . . . 20 VAL CG1 . 10109 1 175 . 1 1 20 20 VAL CG2 C 13 20.834 0.300 . 2 . . . . 20 VAL CG2 . 10109 1 176 . 1 1 20 20 VAL N N 15 127.832 0.300 . 1 . . . . 20 VAL N . 10109 1 177 . 1 1 21 21 LEU H H 1 8.915 0.030 . 1 . . . . 21 LEU H . 10109 1 178 . 1 1 21 21 LEU HA H 1 5.012 0.030 . 1 . . . . 21 LEU HA . 10109 1 179 . 1 1 21 21 LEU HB2 H 1 1.682 0.030 . 2 . . . . 21 LEU HB2 . 10109 1 180 . 1 1 21 21 LEU HB3 H 1 1.357 0.030 . 2 . . . . 21 LEU HB3 . 10109 1 181 . 1 1 21 21 LEU HG H 1 1.480 0.030 . 1 . . . . 21 LEU HG . 10109 1 182 . 1 1 21 21 LEU HD11 H 1 0.879 0.030 . 1 . . . . 21 LEU HD1 . 10109 1 183 . 1 1 21 21 LEU HD12 H 1 0.879 0.030 . 1 . . . . 21 LEU HD1 . 10109 1 184 . 1 1 21 21 LEU HD13 H 1 0.879 0.030 . 1 . . . . 21 LEU HD1 . 10109 1 185 . 1 1 21 21 LEU HD21 H 1 0.721 0.030 . 1 . . . . 21 LEU HD2 . 10109 1 186 . 1 1 21 21 LEU HD22 H 1 0.721 0.030 . 1 . . . . 21 LEU HD2 . 10109 1 187 . 1 1 21 21 LEU HD23 H 1 0.721 0.030 . 1 . . . . 21 LEU HD2 . 10109 1 188 . 1 1 21 21 LEU C C 13 175.598 0.300 . 1 . . . . 21 LEU C . 10109 1 189 . 1 1 21 21 LEU CA C 13 52.853 0.300 . 1 . . . . 21 LEU CA . 10109 1 190 . 1 1 21 21 LEU CB C 13 46.076 0.300 . 1 . . . . 21 LEU CB . 10109 1 191 . 1 1 21 21 LEU CG C 13 26.577 0.300 . 1 . . . . 21 LEU CG . 10109 1 192 . 1 1 21 21 LEU CD1 C 13 23.450 0.300 . 2 . . . . 21 LEU CD1 . 10109 1 193 . 1 1 21 21 LEU CD2 C 13 26.283 0.300 . 2 . . . . 21 LEU CD2 . 10109 1 194 . 1 1 21 21 LEU N N 15 125.782 0.300 . 1 . . . . 21 LEU N . 10109 1 195 . 1 1 22 22 THR H H 1 8.453 0.030 . 1 . . . . 22 THR H . 10109 1 196 . 1 1 22 22 THR HA H 1 5.122 0.030 . 1 . . . . 22 THR HA . 10109 1 197 . 1 1 22 22 THR HB H 1 4.083 0.030 . 1 . . . . 22 THR HB . 10109 1 198 . 1 1 22 22 THR HG21 H 1 1.312 0.030 . 1 . . . . 22 THR HG2 . 10109 1 199 . 1 1 22 22 THR HG22 H 1 1.312 0.030 . 1 . . . . 22 THR HG2 . 10109 1 200 . 1 1 22 22 THR HG23 H 1 1.312 0.030 . 1 . . . . 22 THR HG2 . 10109 1 201 . 1 1 22 22 THR C C 13 174.262 0.300 . 1 . . . . 22 THR C . 10109 1 202 . 1 1 22 22 THR CA C 13 61.211 0.300 . 1 . . . . 22 THR CA . 10109 1 203 . 1 1 22 22 THR CB C 13 70.133 0.300 . 1 . . . . 22 THR CB . 10109 1 204 . 1 1 22 22 THR CG2 C 13 21.462 0.300 . 1 . . . . 22 THR CG2 . 10109 1 205 . 1 1 22 22 THR N N 15 117.245 0.300 . 1 . . . . 22 THR N . 10109 1 206 . 1 1 23 23 ALA H H 1 8.424 0.030 . 1 . . . . 23 ALA H . 10109 1 207 . 1 1 23 23 ALA HA H 1 3.450 0.030 . 1 . . . . 23 ALA HA . 10109 1 208 . 1 1 23 23 ALA HB1 H 1 0.638 0.030 . 1 . . . . 23 ALA HB . 10109 1 209 . 1 1 23 23 ALA HB2 H 1 0.638 0.030 . 1 . . . . 23 ALA HB . 10109 1 210 . 1 1 23 23 ALA HB3 H 1 0.638 0.030 . 1 . . . . 23 ALA HB . 10109 1 211 . 1 1 23 23 ALA C C 13 176.933 0.300 . 1 . . . . 23 ALA C . 10109 1 212 . 1 1 23 23 ALA CA C 13 52.531 0.300 . 1 . . . . 23 ALA CA . 10109 1 213 . 1 1 23 23 ALA CB C 13 18.830 0.300 . 1 . . . . 23 ALA CB . 10109 1 214 . 1 1 23 23 ALA N N 15 126.299 0.300 . 1 . . . . 23 ALA N . 10109 1 215 . 1 1 24 24 ASP H H 1 8.010 0.030 . 1 . . . . 24 ASP H . 10109 1 216 . 1 1 24 24 ASP HA H 1 4.988 0.030 . 1 . . . . 24 ASP HA . 10109 1 217 . 1 1 24 24 ASP HB2 H 1 2.990 0.030 . 2 . . . . 24 ASP HB2 . 10109 1 218 . 1 1 24 24 ASP HB3 H 1 2.536 0.030 . 2 . . . . 24 ASP HB3 . 10109 1 219 . 1 1 24 24 ASP CA C 13 51.548 0.300 . 1 . . . . 24 ASP CA . 10109 1 220 . 1 1 24 24 ASP CB C 13 43.801 0.300 . 1 . . . . 24 ASP CB . 10109 1 221 . 1 1 24 24 ASP N N 15 124.073 0.300 . 1 . . . . 24 ASP N . 10109 1 222 . 1 1 25 25 PRO HA H 1 4.277 0.030 . 1 . . . . 25 PRO HA . 10109 1 223 . 1 1 25 25 PRO HB2 H 1 2.371 0.030 . 2 . . . . 25 PRO HB2 . 10109 1 224 . 1 1 25 25 PRO HB3 H 1 1.971 0.030 . 2 . . . . 25 PRO HB3 . 10109 1 225 . 1 1 25 25 PRO HG2 H 1 2.069 0.030 . 1 . . . . 25 PRO HG2 . 10109 1 226 . 1 1 25 25 PRO HG3 H 1 2.069 0.030 . 1 . . . . 25 PRO HG3 . 10109 1 227 . 1 1 25 25 PRO HD2 H 1 3.834 0.030 . 2 . . . . 25 PRO HD2 . 10109 1 228 . 1 1 25 25 PRO HD3 H 1 3.754 0.030 . 2 . . . . 25 PRO HD3 . 10109 1 229 . 1 1 25 25 PRO CA C 13 64.804 0.300 . 1 . . . . 25 PRO CA . 10109 1 230 . 1 1 25 25 PRO CB C 13 32.336 0.300 . 1 . . . . 25 PRO CB . 10109 1 231 . 1 1 25 25 PRO CG C 13 27.487 0.300 . 1 . . . . 25 PRO CG . 10109 1 232 . 1 1 25 25 PRO CD C 13 51.119 0.300 . 1 . . . . 25 PRO CD . 10109 1 233 . 1 1 26 26 VAL H H 1 8.718 0.030 . 1 . . . . 26 VAL H . 10109 1 234 . 1 1 26 26 VAL HA H 1 3.987 0.030 . 1 . . . . 26 VAL HA . 10109 1 235 . 1 1 26 26 VAL HB H 1 2.219 0.030 . 1 . . . . 26 VAL HB . 10109 1 236 . 1 1 26 26 VAL HG11 H 1 0.971 0.030 . 1 . . . . 26 VAL HG1 . 10109 1 237 . 1 1 26 26 VAL HG12 H 1 0.971 0.030 . 1 . . . . 26 VAL HG1 . 10109 1 238 . 1 1 26 26 VAL HG13 H 1 0.971 0.030 . 1 . . . . 26 VAL HG1 . 10109 1 239 . 1 1 26 26 VAL HG21 H 1 0.948 0.030 . 1 . . . . 26 VAL HG2 . 10109 1 240 . 1 1 26 26 VAL HG22 H 1 0.948 0.030 . 1 . . . . 26 VAL HG2 . 10109 1 241 . 1 1 26 26 VAL HG23 H 1 0.948 0.030 . 1 . . . . 26 VAL HG2 . 10109 1 242 . 1 1 26 26 VAL C C 13 178.171 0.300 . 1 . . . . 26 VAL C . 10109 1 243 . 1 1 26 26 VAL CA C 13 65.118 0.300 . 1 . . . . 26 VAL CA . 10109 1 244 . 1 1 26 26 VAL CB C 13 32.667 0.300 . 1 . . . . 26 VAL CB . 10109 1 245 . 1 1 26 26 VAL CG1 C 13 21.767 0.300 . 2 . . . . 26 VAL CG1 . 10109 1 246 . 1 1 26 26 VAL CG2 C 13 21.209 0.300 . 2 . . . . 26 VAL CG2 . 10109 1 247 . 1 1 26 26 VAL N N 15 117.978 0.300 . 1 . . . . 26 VAL N . 10109 1 248 . 1 1 27 27 THR H H 1 8.512 0.030 . 1 . . . . 27 THR H . 10109 1 249 . 1 1 27 27 THR HA H 1 4.299 0.030 . 1 . . . . 27 THR HA . 10109 1 250 . 1 1 27 27 THR HB H 1 4.307 0.030 . 1 . . . . 27 THR HB . 10109 1 251 . 1 1 27 27 THR HG21 H 1 1.200 0.030 . 1 . . . . 27 THR HG2 . 10109 1 252 . 1 1 27 27 THR HG22 H 1 1.200 0.030 . 1 . . . . 27 THR HG2 . 10109 1 253 . 1 1 27 27 THR HG23 H 1 1.200 0.030 . 1 . . . . 27 THR HG2 . 10109 1 254 . 1 1 27 27 THR C C 13 176.217 0.300 . 1 . . . . 27 THR C . 10109 1 255 . 1 1 27 27 THR CA C 13 62.333 0.300 . 1 . . . . 27 THR CA . 10109 1 256 . 1 1 27 27 THR CB C 13 70.191 0.300 . 1 . . . . 27 THR CB . 10109 1 257 . 1 1 27 27 THR CG2 C 13 22.144 0.300 . 1 . . . . 27 THR CG2 . 10109 1 258 . 1 1 27 27 THR N N 15 109.806 0.300 . 1 . . . . 27 THR N . 10109 1 259 . 1 1 28 28 GLY H H 1 8.170 0.030 . 1 . . . . 28 GLY H . 10109 1 260 . 1 1 28 28 GLY HA2 H 1 4.142 0.030 . 2 . . . . 28 GLY HA2 . 10109 1 261 . 1 1 28 28 GLY HA3 H 1 3.495 0.030 . 2 . . . . 28 GLY HA3 . 10109 1 262 . 1 1 28 28 GLY C C 13 175.513 0.300 . 1 . . . . 28 GLY C . 10109 1 263 . 1 1 28 28 GLY CA C 13 45.874 0.300 . 1 . . . . 28 GLY CA . 10109 1 264 . 1 1 28 28 GLY N N 15 111.536 0.300 . 1 . . . . 28 GLY N . 10109 1 265 . 1 1 29 29 PHE H H 1 8.901 0.030 . 1 . . . . 29 PHE H . 10109 1 266 . 1 1 29 29 PHE HA H 1 4.547 0.030 . 1 . . . . 29 PHE HA . 10109 1 267 . 1 1 29 29 PHE HB2 H 1 3.197 0.030 . 2 . . . . 29 PHE HB2 . 10109 1 268 . 1 1 29 29 PHE HB3 H 1 3.065 0.030 . 2 . . . . 29 PHE HB3 . 10109 1 269 . 1 1 29 29 PHE HD1 H 1 7.136 0.030 . 1 . . . . 29 PHE HD1 . 10109 1 270 . 1 1 29 29 PHE HD2 H 1 7.136 0.030 . 1 . . . . 29 PHE HD2 . 10109 1 271 . 1 1 29 29 PHE HE1 H 1 7.276 0.030 . 1 . . . . 29 PHE HE1 . 10109 1 272 . 1 1 29 29 PHE HE2 H 1 7.276 0.030 . 1 . . . . 29 PHE HE2 . 10109 1 273 . 1 1 29 29 PHE HZ H 1 6.878 0.030 . 1 . . . . 29 PHE HZ . 10109 1 274 . 1 1 29 29 PHE C C 13 176.739 0.300 . 1 . . . . 29 PHE C . 10109 1 275 . 1 1 29 29 PHE CA C 13 60.578 0.300 . 1 . . . . 29 PHE CA . 10109 1 276 . 1 1 29 29 PHE CB C 13 39.440 0.300 . 1 . . . . 29 PHE CB . 10109 1 277 . 1 1 29 29 PHE CD1 C 13 131.187 0.300 . 1 . . . . 29 PHE CD1 . 10109 1 278 . 1 1 29 29 PHE CD2 C 13 131.187 0.300 . 1 . . . . 29 PHE CD2 . 10109 1 279 . 1 1 29 29 PHE CE1 C 13 132.177 0.300 . 1 . . . . 29 PHE CE1 . 10109 1 280 . 1 1 29 29 PHE CE2 C 13 132.177 0.300 . 1 . . . . 29 PHE CE2 . 10109 1 281 . 1 1 29 29 PHE CZ C 13 129.724 0.300 . 1 . . . . 29 PHE CZ . 10109 1 282 . 1 1 29 29 PHE N N 15 121.465 0.300 . 1 . . . . 29 PHE N . 10109 1 283 . 1 1 30 30 GLY H H 1 8.385 0.030 . 1 . . . . 30 GLY H . 10109 1 284 . 1 1 30 30 GLY HA2 H 1 4.650 0.030 . 2 . . . . 30 GLY HA2 . 10109 1 285 . 1 1 30 30 GLY HA3 H 1 3.909 0.030 . 2 . . . . 30 GLY HA3 . 10109 1 286 . 1 1 30 30 GLY C C 13 173.474 0.300 . 1 . . . . 30 GLY C . 10109 1 287 . 1 1 30 30 GLY CA C 13 45.840 0.300 . 1 . . . . 30 GLY CA . 10109 1 288 . 1 1 30 30 GLY N N 15 103.798 0.300 . 1 . . . . 30 GLY N . 10109 1 289 . 1 1 31 31 ILE H H 1 7.537 0.030 . 1 . . . . 31 ILE H . 10109 1 290 . 1 1 31 31 ILE HA H 1 5.005 0.030 . 1 . . . . 31 ILE HA . 10109 1 291 . 1 1 31 31 ILE HB H 1 1.638 0.030 . 1 . . . . 31 ILE HB . 10109 1 292 . 1 1 31 31 ILE HG12 H 1 1.513 0.030 . 2 . . . . 31 ILE HG12 . 10109 1 293 . 1 1 31 31 ILE HG13 H 1 0.724 0.030 . 2 . . . . 31 ILE HG13 . 10109 1 294 . 1 1 31 31 ILE HG21 H 1 0.791 0.030 . 1 . . . . 31 ILE HG2 . 10109 1 295 . 1 1 31 31 ILE HG22 H 1 0.791 0.030 . 1 . . . . 31 ILE HG2 . 10109 1 296 . 1 1 31 31 ILE HG23 H 1 0.791 0.030 . 1 . . . . 31 ILE HG2 . 10109 1 297 . 1 1 31 31 ILE HD11 H 1 0.653 0.030 . 1 . . . . 31 ILE HD1 . 10109 1 298 . 1 1 31 31 ILE HD12 H 1 0.653 0.030 . 1 . . . . 31 ILE HD1 . 10109 1 299 . 1 1 31 31 ILE HD13 H 1 0.653 0.030 . 1 . . . . 31 ILE HD1 . 10109 1 300 . 1 1 31 31 ILE C C 13 175.404 0.300 . 1 . . . . 31 ILE C . 10109 1 301 . 1 1 31 31 ILE CA C 13 59.645 0.300 . 1 . . . . 31 ILE CA . 10109 1 302 . 1 1 31 31 ILE CB C 13 42.020 0.300 . 1 . . . . 31 ILE CB . 10109 1 303 . 1 1 31 31 ILE CG1 C 13 27.389 0.300 . 1 . . . . 31 ILE CG1 . 10109 1 304 . 1 1 31 31 ILE CG2 C 13 18.672 0.300 . 1 . . . . 31 ILE CG2 . 10109 1 305 . 1 1 31 31 ILE CD1 C 13 14.470 0.300 . 1 . . . . 31 ILE CD1 . 10109 1 306 . 1 1 31 31 ILE N N 15 113.752 0.300 . 1 . . . . 31 ILE N . 10109 1 307 . 1 1 32 32 GLN H H 1 8.256 0.030 . 1 . . . . 32 GLN H . 10109 1 308 . 1 1 32 32 GLN HA H 1 4.735 0.030 . 1 . . . . 32 GLN HA . 10109 1 309 . 1 1 32 32 GLN HB2 H 1 2.188 0.030 . 2 . . . . 32 GLN HB2 . 10109 1 310 . 1 1 32 32 GLN HB3 H 1 1.966 0.030 . 2 . . . . 32 GLN HB3 . 10109 1 311 . 1 1 32 32 GLN HG2 H 1 2.471 0.030 . 1 . . . . 32 GLN HG2 . 10109 1 312 . 1 1 32 32 GLN HG3 H 1 2.471 0.030 . 1 . . . . 32 GLN HG3 . 10109 1 313 . 1 1 32 32 GLN HE21 H 1 7.845 0.030 . 2 . . . . 32 GLN HE21 . 10109 1 314 . 1 1 32 32 GLN HE22 H 1 6.889 0.030 . 2 . . . . 32 GLN HE22 . 10109 1 315 . 1 1 32 32 GLN C C 13 174.505 0.300 . 1 . . . . 32 GLN C . 10109 1 316 . 1 1 32 32 GLN CA C 13 54.541 0.300 . 1 . . . . 32 GLN CA . 10109 1 317 . 1 1 32 32 GLN CB C 13 31.749 0.300 . 1 . . . . 32 GLN CB . 10109 1 318 . 1 1 32 32 GLN CG C 13 33.418 0.300 . 1 . . . . 32 GLN CG . 10109 1 319 . 1 1 32 32 GLN N N 15 122.948 0.300 . 1 . . . . 32 GLN N . 10109 1 320 . 1 1 32 32 GLN NE2 N 15 114.109 0.300 . 1 . . . . 32 GLN NE2 . 10109 1 321 . 1 1 33 33 LEU H H 1 8.958 0.030 . 1 . . . . 33 LEU H . 10109 1 322 . 1 1 33 33 LEU HA H 1 5.525 0.030 . 1 . . . . 33 LEU HA . 10109 1 323 . 1 1 33 33 LEU HB2 H 1 1.886 0.030 . 2 . . . . 33 LEU HB2 . 10109 1 324 . 1 1 33 33 LEU HB3 H 1 1.444 0.030 . 2 . . . . 33 LEU HB3 . 10109 1 325 . 1 1 33 33 LEU HG H 1 1.633 0.030 . 1 . . . . 33 LEU HG . 10109 1 326 . 1 1 33 33 LEU HD11 H 1 0.699 0.030 . 1 . . . . 33 LEU HD1 . 10109 1 327 . 1 1 33 33 LEU HD12 H 1 0.699 0.030 . 1 . . . . 33 LEU HD1 . 10109 1 328 . 1 1 33 33 LEU HD13 H 1 0.699 0.030 . 1 . . . . 33 LEU HD1 . 10109 1 329 . 1 1 33 33 LEU HD21 H 1 0.725 0.030 . 1 . . . . 33 LEU HD2 . 10109 1 330 . 1 1 33 33 LEU HD22 H 1 0.725 0.030 . 1 . . . . 33 LEU HD2 . 10109 1 331 . 1 1 33 33 LEU HD23 H 1 0.725 0.030 . 1 . . . . 33 LEU HD2 . 10109 1 332 . 1 1 33 33 LEU C C 13 176.897 0.300 . 1 . . . . 33 LEU C . 10109 1 333 . 1 1 33 33 LEU CA C 13 53.149 0.300 . 1 . . . . 33 LEU CA . 10109 1 334 . 1 1 33 33 LEU CB C 13 45.191 0.300 . 1 . . . . 33 LEU CB . 10109 1 335 . 1 1 33 33 LEU CG C 13 27.044 0.300 . 1 . . . . 33 LEU CG . 10109 1 336 . 1 1 33 33 LEU CD1 C 13 24.192 0.300 . 2 . . . . 33 LEU CD1 . 10109 1 337 . 1 1 33 33 LEU CD2 C 13 25.544 0.300 . 2 . . . . 33 LEU CD2 . 10109 1 338 . 1 1 33 33 LEU N N 15 122.163 0.300 . 1 . . . . 33 LEU N . 10109 1 339 . 1 1 34 34 GLN H H 1 9.127 0.030 . 1 . . . . 34 GLN H . 10109 1 340 . 1 1 34 34 GLN HA H 1 4.456 0.030 . 1 . . . . 34 GLN HA . 10109 1 341 . 1 1 34 34 GLN HB2 H 1 2.000 0.030 . 1 . . . . 34 GLN HB2 . 10109 1 342 . 1 1 34 34 GLN HB3 H 1 2.000 0.030 . 1 . . . . 34 GLN HB3 . 10109 1 343 . 1 1 34 34 GLN HG2 H 1 2.369 0.030 . 2 . . . . 34 GLN HG2 . 10109 1 344 . 1 1 34 34 GLN HG3 H 1 2.330 0.030 . 2 . . . . 34 GLN HG3 . 10109 1 345 . 1 1 34 34 GLN HE21 H 1 7.464 0.030 . 2 . . . . 34 GLN HE21 . 10109 1 346 . 1 1 34 34 GLN HE22 H 1 6.845 0.030 . 2 . . . . 34 GLN HE22 . 10109 1 347 . 1 1 34 34 GLN C C 13 174.663 0.300 . 1 . . . . 34 GLN C . 10109 1 348 . 1 1 34 34 GLN CA C 13 54.771 0.300 . 1 . . . . 34 GLN CA . 10109 1 349 . 1 1 34 34 GLN CB C 13 32.575 0.300 . 1 . . . . 34 GLN CB . 10109 1 350 . 1 1 34 34 GLN CG C 13 33.907 0.300 . 1 . . . . 34 GLN CG . 10109 1 351 . 1 1 34 34 GLN N N 15 118.965 0.300 . 1 . . . . 34 GLN N . 10109 1 352 . 1 1 34 34 GLN NE2 N 15 111.959 0.300 . 1 . . . . 34 GLN NE2 . 10109 1 353 . 1 1 35 35 GLY H H 1 7.968 0.030 . 1 . . . . 35 GLY H . 10109 1 354 . 1 1 35 35 GLY HA2 H 1 4.139 0.030 . 2 . . . . 35 GLY HA2 . 10109 1 355 . 1 1 35 35 GLY HA3 H 1 3.406 0.030 . 2 . . . . 35 GLY HA3 . 10109 1 356 . 1 1 35 35 GLY C C 13 173.388 0.300 . 1 . . . . 35 GLY C . 10109 1 357 . 1 1 35 35 GLY CA C 13 44.507 0.300 . 1 . . . . 35 GLY CA . 10109 1 358 . 1 1 35 35 GLY N N 15 110.712 0.300 . 1 . . . . 35 GLY N . 10109 1 359 . 1 1 36 36 SER H H 1 8.430 0.030 . 1 . . . . 36 SER H . 10109 1 360 . 1 1 36 36 SER HA H 1 4.407 0.030 . 1 . . . . 36 SER HA . 10109 1 361 . 1 1 36 36 SER HB2 H 1 3.859 0.030 . 2 . . . . 36 SER HB2 . 10109 1 362 . 1 1 36 36 SER HB3 H 1 3.729 0.030 . 2 . . . . 36 SER HB3 . 10109 1 363 . 1 1 36 36 SER C C 13 175.197 0.300 . 1 . . . . 36 SER C . 10109 1 364 . 1 1 36 36 SER CA C 13 58.008 0.300 . 1 . . . . 36 SER CA . 10109 1 365 . 1 1 36 36 SER CB C 13 64.277 0.300 . 1 . . . . 36 SER CB . 10109 1 366 . 1 1 36 36 SER N N 15 115.559 0.300 . 1 . . . . 36 SER N . 10109 1 367 . 1 1 37 37 VAL H H 1 8.191 0.030 . 1 . . . . 37 VAL H . 10109 1 368 . 1 1 37 37 VAL HA H 1 4.132 0.030 . 1 . . . . 37 VAL HA . 10109 1 369 . 1 1 37 37 VAL HB H 1 2.028 0.030 . 1 . . . . 37 VAL HB . 10109 1 370 . 1 1 37 37 VAL HG11 H 1 0.791 0.030 . 1 . . . . 37 VAL HG1 . 10109 1 371 . 1 1 37 37 VAL HG12 H 1 0.791 0.030 . 1 . . . . 37 VAL HG1 . 10109 1 372 . 1 1 37 37 VAL HG13 H 1 0.791 0.030 . 1 . . . . 37 VAL HG1 . 10109 1 373 . 1 1 37 37 VAL HG21 H 1 0.751 0.030 . 1 . . . . 37 VAL HG2 . 10109 1 374 . 1 1 37 37 VAL HG22 H 1 0.751 0.030 . 1 . . . . 37 VAL HG2 . 10109 1 375 . 1 1 37 37 VAL HG23 H 1 0.751 0.030 . 1 . . . . 37 VAL HG2 . 10109 1 376 . 1 1 37 37 VAL C C 13 175.926 0.300 . 1 . . . . 37 VAL C . 10109 1 377 . 1 1 37 37 VAL CA C 13 62.584 0.300 . 1 . . . . 37 VAL CA . 10109 1 378 . 1 1 37 37 VAL CB C 13 32.492 0.300 . 1 . . . . 37 VAL CB . 10109 1 379 . 1 1 37 37 VAL CG1 C 13 21.132 0.300 . 2 . . . . 37 VAL CG1 . 10109 1 380 . 1 1 37 37 VAL CG2 C 13 19.908 0.300 . 2 . . . . 37 VAL CG2 . 10109 1 381 . 1 1 37 37 VAL N N 15 121.145 0.300 . 1 . . . . 37 VAL N . 10109 1 382 . 1 1 38 38 PHE H H 1 8.201 0.030 . 1 . . . . 38 PHE H . 10109 1 383 . 1 1 38 38 PHE HA H 1 4.695 0.030 . 1 . . . . 38 PHE HA . 10109 1 384 . 1 1 38 38 PHE HB2 H 1 3.230 0.030 . 2 . . . . 38 PHE HB2 . 10109 1 385 . 1 1 38 38 PHE HB3 H 1 2.960 0.030 . 2 . . . . 38 PHE HB3 . 10109 1 386 . 1 1 38 38 PHE HD1 H 1 7.273 0.030 . 1 . . . . 38 PHE HD1 . 10109 1 387 . 1 1 38 38 PHE HD2 H 1 7.273 0.030 . 1 . . . . 38 PHE HD2 . 10109 1 388 . 1 1 38 38 PHE HE1 H 1 7.363 0.030 . 1 . . . . 38 PHE HE1 . 10109 1 389 . 1 1 38 38 PHE HE2 H 1 7.363 0.030 . 1 . . . . 38 PHE HE2 . 10109 1 390 . 1 1 38 38 PHE C C 13 175.525 0.300 . 1 . . . . 38 PHE C . 10109 1 391 . 1 1 38 38 PHE CA C 13 57.445 0.300 . 1 . . . . 38 PHE CA . 10109 1 392 . 1 1 38 38 PHE CB C 13 39.673 0.300 . 1 . . . . 38 PHE CB . 10109 1 393 . 1 1 38 38 PHE CD1 C 13 131.756 0.300 . 1 . . . . 38 PHE CD1 . 10109 1 394 . 1 1 38 38 PHE CD2 C 13 131.756 0.300 . 1 . . . . 38 PHE CD2 . 10109 1 395 . 1 1 38 38 PHE CE1 C 13 131.664 0.300 . 1 . . . . 38 PHE CE1 . 10109 1 396 . 1 1 38 38 PHE CE2 C 13 131.664 0.300 . 1 . . . . 38 PHE CE2 . 10109 1 397 . 1 1 38 38 PHE N N 15 122.026 0.300 . 1 . . . . 38 PHE N . 10109 1 398 . 1 1 39 39 ALA H H 1 8.150 0.030 . 1 . . . . 39 ALA H . 10109 1 399 . 1 1 39 39 ALA HA H 1 4.408 0.030 . 1 . . . . 39 ALA HA . 10109 1 400 . 1 1 39 39 ALA HB1 H 1 1.459 0.030 . 1 . . . . 39 ALA HB . 10109 1 401 . 1 1 39 39 ALA HB2 H 1 1.459 0.030 . 1 . . . . 39 ALA HB . 10109 1 402 . 1 1 39 39 ALA HB3 H 1 1.459 0.030 . 1 . . . . 39 ALA HB . 10109 1 403 . 1 1 39 39 ALA C C 13 177.601 0.300 . 1 . . . . 39 ALA C . 10109 1 404 . 1 1 39 39 ALA CA C 13 52.993 0.300 . 1 . . . . 39 ALA CA . 10109 1 405 . 1 1 39 39 ALA CB C 13 19.510 0.300 . 1 . . . . 39 ALA CB . 10109 1 406 . 1 1 39 39 ALA N N 15 125.118 0.300 . 1 . . . . 39 ALA N . 10109 1 407 . 1 1 40 40 THR H H 1 8.095 0.030 . 1 . . . . 40 THR H . 10109 1 408 . 1 1 40 40 THR HA H 1 4.431 0.030 . 1 . . . . 40 THR HA . 10109 1 409 . 1 1 40 40 THR HB H 1 4.420 0.030 . 1 . . . . 40 THR HB . 10109 1 410 . 1 1 40 40 THR HG21 H 1 1.253 0.030 . 1 . . . . 40 THR HG2 . 10109 1 411 . 1 1 40 40 THR HG22 H 1 1.253 0.030 . 1 . . . . 40 THR HG2 . 10109 1 412 . 1 1 40 40 THR HG23 H 1 1.253 0.030 . 1 . . . . 40 THR HG2 . 10109 1 413 . 1 1 40 40 THR C C 13 174.748 0.300 . 1 . . . . 40 THR C . 10109 1 414 . 1 1 40 40 THR CA C 13 61.634 0.300 . 1 . . . . 40 THR CA . 10109 1 415 . 1 1 40 40 THR CB C 13 70.042 0.300 . 1 . . . . 40 THR CB . 10109 1 416 . 1 1 40 40 THR CG2 C 13 21.774 0.300 . 1 . . . . 40 THR CG2 . 10109 1 417 . 1 1 40 40 THR N N 15 111.382 0.300 . 1 . . . . 40 THR N . 10109 1 418 . 1 1 41 41 GLU H H 1 8.507 0.030 . 1 . . . . 41 GLU H . 10109 1 419 . 1 1 41 41 GLU HA H 1 4.355 0.030 . 1 . . . . 41 GLU HA . 10109 1 420 . 1 1 41 41 GLU HB2 H 1 2.175 0.030 . 2 . . . . 41 GLU HB2 . 10109 1 421 . 1 1 41 41 GLU HB3 H 1 2.076 0.030 . 2 . . . . 41 GLU HB3 . 10109 1 422 . 1 1 41 41 GLU HG2 H 1 2.339 0.030 . 1 . . . . 41 GLU HG2 . 10109 1 423 . 1 1 41 41 GLU HG3 H 1 2.339 0.030 . 1 . . . . 41 GLU HG3 . 10109 1 424 . 1 1 41 41 GLU C C 13 176.739 0.300 . 1 . . . . 41 GLU C . 10109 1 425 . 1 1 41 41 GLU CA C 13 57.392 0.300 . 1 . . . . 41 GLU CA . 10109 1 426 . 1 1 41 41 GLU CB C 13 30.075 0.300 . 1 . . . . 41 GLU CB . 10109 1 427 . 1 1 41 41 GLU CG C 13 36.548 0.300 . 1 . . . . 41 GLU CG . 10109 1 428 . 1 1 41 41 GLU N N 15 120.678 0.300 . 1 . . . . 41 GLU N . 10109 1 429 . 1 1 42 42 THR H H 1 7.985 0.030 . 1 . . . . 42 THR H . 10109 1 430 . 1 1 42 42 THR HA H 1 4.326 0.030 . 1 . . . . 42 THR HA . 10109 1 431 . 1 1 42 42 THR HB H 1 4.251 0.030 . 1 . . . . 42 THR HB . 10109 1 432 . 1 1 42 42 THR HG21 H 1 1.197 0.030 . 1 . . . . 42 THR HG2 . 10109 1 433 . 1 1 42 42 THR HG22 H 1 1.197 0.030 . 1 . . . . 42 THR HG2 . 10109 1 434 . 1 1 42 42 THR HG23 H 1 1.197 0.030 . 1 . . . . 42 THR HG2 . 10109 1 435 . 1 1 42 42 THR C C 13 174.275 0.300 . 1 . . . . 42 THR C . 10109 1 436 . 1 1 42 42 THR CA C 13 61.986 0.300 . 1 . . . . 42 THR CA . 10109 1 437 . 1 1 42 42 THR CB C 13 69.797 0.300 . 1 . . . . 42 THR CB . 10109 1 438 . 1 1 42 42 THR CG2 C 13 21.934 0.300 . 1 . . . . 42 THR CG2 . 10109 1 439 . 1 1 42 42 THR N N 15 112.296 0.300 . 1 . . . . 42 THR N . 10109 1 440 . 1 1 43 43 LEU H H 1 8.158 0.030 . 1 . . . . 43 LEU H . 10109 1 441 . 1 1 43 43 LEU HA H 1 4.402 0.030 . 1 . . . . 43 LEU HA . 10109 1 442 . 1 1 43 43 LEU HB2 H 1 1.751 0.030 . 2 . . . . 43 LEU HB2 . 10109 1 443 . 1 1 43 43 LEU HB3 H 1 1.645 0.030 . 2 . . . . 43 LEU HB3 . 10109 1 444 . 1 1 43 43 LEU HG H 1 1.648 0.030 . 1 . . . . 43 LEU HG . 10109 1 445 . 1 1 43 43 LEU HD11 H 1 0.924 0.030 . 1 . . . . 43 LEU HD1 . 10109 1 446 . 1 1 43 43 LEU HD12 H 1 0.924 0.030 . 1 . . . . 43 LEU HD1 . 10109 1 447 . 1 1 43 43 LEU HD13 H 1 0.924 0.030 . 1 . . . . 43 LEU HD1 . 10109 1 448 . 1 1 43 43 LEU HD21 H 1 0.918 0.030 . 1 . . . . 43 LEU HD2 . 10109 1 449 . 1 1 43 43 LEU HD22 H 1 0.918 0.030 . 1 . . . . 43 LEU HD2 . 10109 1 450 . 1 1 43 43 LEU HD23 H 1 0.918 0.030 . 1 . . . . 43 LEU HD2 . 10109 1 451 . 1 1 43 43 LEU C C 13 176.763 0.300 . 1 . . . . 43 LEU C . 10109 1 452 . 1 1 43 43 LEU CA C 13 55.528 0.300 . 1 . . . . 43 LEU CA . 10109 1 453 . 1 1 43 43 LEU CB C 13 42.335 0.300 . 1 . . . . 43 LEU CB . 10109 1 454 . 1 1 43 43 LEU CG C 13 27.059 0.300 . 1 . . . . 43 LEU CG . 10109 1 455 . 1 1 43 43 LEU CD1 C 13 25.072 0.300 . 2 . . . . 43 LEU CD1 . 10109 1 456 . 1 1 43 43 LEU CD2 C 13 23.987 0.300 . 2 . . . . 43 LEU CD2 . 10109 1 457 . 1 1 43 43 LEU N N 15 124.126 0.300 . 1 . . . . 43 LEU N . 10109 1 458 . 1 1 44 44 SER H H 1 8.326 0.030 . 1 . . . . 44 SER H . 10109 1 459 . 1 1 44 44 SER HA H 1 4.546 0.030 . 1 . . . . 44 SER HA . 10109 1 460 . 1 1 44 44 SER HB2 H 1 3.887 0.030 . 1 . . . . 44 SER HB2 . 10109 1 461 . 1 1 44 44 SER HB3 H 1 3.887 0.030 . 1 . . . . 44 SER HB3 . 10109 1 462 . 1 1 44 44 SER C C 13 173.862 0.300 . 1 . . . . 44 SER C . 10109 1 463 . 1 1 44 44 SER CA C 13 58.252 0.300 . 1 . . . . 44 SER CA . 10109 1 464 . 1 1 44 44 SER CB C 13 64.073 0.300 . 1 . . . . 44 SER CB . 10109 1 465 . 1 1 44 44 SER N N 15 117.035 0.300 . 1 . . . . 44 SER N . 10109 1 466 . 1 1 45 45 SER H H 1 8.221 0.030 . 1 . . . . 45 SER H . 10109 1 467 . 1 1 45 45 SER HA H 1 4.907 0.030 . 1 . . . . 45 SER HA . 10109 1 468 . 1 1 45 45 SER HB2 H 1 3.845 0.030 . 1 . . . . 45 SER HB2 . 10109 1 469 . 1 1 45 45 SER HB3 H 1 3.845 0.030 . 1 . . . . 45 SER HB3 . 10109 1 470 . 1 1 45 45 SER C C 13 171.592 0.300 . 1 . . . . 45 SER C . 10109 1 471 . 1 1 45 45 SER CA C 13 56.248 0.300 . 1 . . . . 45 SER CA . 10109 1 472 . 1 1 45 45 SER CB C 13 64.038 0.300 . 1 . . . . 45 SER CB . 10109 1 473 . 1 1 45 45 SER N N 15 117.713 0.300 . 1 . . . . 45 SER N . 10109 1 474 . 1 1 46 46 PRO HA H 1 4.774 0.030 . 1 . . . . 46 PRO HA . 10109 1 475 . 1 1 46 46 PRO HB2 H 1 2.404 0.030 . 2 . . . . 46 PRO HB2 . 10109 1 476 . 1 1 46 46 PRO HB3 H 1 1.740 0.030 . 2 . . . . 46 PRO HB3 . 10109 1 477 . 1 1 46 46 PRO HG2 H 1 2.018 0.030 . 2 . . . . 46 PRO HG2 . 10109 1 478 . 1 1 46 46 PRO HG3 H 1 1.975 0.030 . 2 . . . . 46 PRO HG3 . 10109 1 479 . 1 1 46 46 PRO HD2 H 1 3.838 0.030 . 2 . . . . 46 PRO HD2 . 10109 1 480 . 1 1 46 46 PRO HD3 H 1 3.667 0.030 . 2 . . . . 46 PRO HD3 . 10109 1 481 . 1 1 46 46 PRO CB C 13 31.495 0.300 . 1 . . . . 46 PRO CB . 10109 1 482 . 1 1 46 46 PRO CG C 13 27.925 0.300 . 1 . . . . 46 PRO CG . 10109 1 483 . 1 1 46 46 PRO CD C 13 50.894 0.300 . 1 . . . . 46 PRO CD . 10109 1 484 . 1 1 47 47 PRO HA H 1 5.049 0.030 . 1 . . . . 47 PRO HA . 10109 1 485 . 1 1 47 47 PRO HB2 H 1 2.292 0.030 . 2 . . . . 47 PRO HB2 . 10109 1 486 . 1 1 47 47 PRO HB3 H 1 1.897 0.030 . 2 . . . . 47 PRO HB3 . 10109 1 487 . 1 1 47 47 PRO HG2 H 1 2.061 0.030 . 2 . . . . 47 PRO HG2 . 10109 1 488 . 1 1 47 47 PRO HG3 H 1 1.978 0.030 . 2 . . . . 47 PRO HG3 . 10109 1 489 . 1 1 47 47 PRO HD2 H 1 4.137 0.030 . 2 . . . . 47 PRO HD2 . 10109 1 490 . 1 1 47 47 PRO HD3 H 1 3.926 0.030 . 2 . . . . 47 PRO HD3 . 10109 1 491 . 1 1 47 47 PRO CB C 13 32.989 0.300 . 1 . . . . 47 PRO CB . 10109 1 492 . 1 1 47 47 PRO CG C 13 27.414 0.300 . 1 . . . . 47 PRO CG . 10109 1 493 . 1 1 47 47 PRO CD C 13 49.903 0.300 . 1 . . . . 47 PRO CD . 10109 1 494 . 1 1 48 48 LEU H H 1 8.410 0.030 . 1 . . . . 48 LEU H . 10109 1 495 . 1 1 48 48 LEU HA H 1 5.381 0.030 . 1 . . . . 48 LEU HA . 10109 1 496 . 1 1 48 48 LEU HB2 H 1 1.547 0.030 . 2 . . . . 48 LEU HB2 . 10109 1 497 . 1 1 48 48 LEU HB3 H 1 1.261 0.030 . 2 . . . . 48 LEU HB3 . 10109 1 498 . 1 1 48 48 LEU HG H 1 1.733 0.030 . 1 . . . . 48 LEU HG . 10109 1 499 . 1 1 48 48 LEU HD11 H 1 0.839 0.030 . 1 . . . . 48 LEU HD1 . 10109 1 500 . 1 1 48 48 LEU HD12 H 1 0.839 0.030 . 1 . . . . 48 LEU HD1 . 10109 1 501 . 1 1 48 48 LEU HD13 H 1 0.839 0.030 . 1 . . . . 48 LEU HD1 . 10109 1 502 . 1 1 48 48 LEU HD21 H 1 0.887 0.030 . 1 . . . . 48 LEU HD2 . 10109 1 503 . 1 1 48 48 LEU HD22 H 1 0.887 0.030 . 1 . . . . 48 LEU HD2 . 10109 1 504 . 1 1 48 48 LEU HD23 H 1 0.887 0.030 . 1 . . . . 48 LEU HD2 . 10109 1 505 . 1 1 48 48 LEU C C 13 178.341 0.300 . 1 . . . . 48 LEU C . 10109 1 506 . 1 1 48 48 LEU CA C 13 52.552 0.300 . 1 . . . . 48 LEU CA . 10109 1 507 . 1 1 48 48 LEU CB C 13 45.351 0.300 . 1 . . . . 48 LEU CB . 10109 1 508 . 1 1 48 48 LEU CG C 13 27.311 0.300 . 1 . . . . 48 LEU CG . 10109 1 509 . 1 1 48 48 LEU CD1 C 13 24.766 0.300 . 2 . . . . 48 LEU CD1 . 10109 1 510 . 1 1 48 48 LEU CD2 C 13 25.522 0.300 . 2 . . . . 48 LEU CD2 . 10109 1 511 . 1 1 48 48 LEU N N 15 117.755 0.300 . 1 . . . . 48 LEU N . 10109 1 512 . 1 1 49 49 ILE H H 1 8.588 0.030 . 1 . . . . 49 ILE H . 10109 1 513 . 1 1 49 49 ILE HA H 1 4.238 0.030 . 1 . . . . 49 ILE HA . 10109 1 514 . 1 1 49 49 ILE HB H 1 2.093 0.030 . 1 . . . . 49 ILE HB . 10109 1 515 . 1 1 49 49 ILE HG12 H 1 1.720 0.030 . 2 . . . . 49 ILE HG12 . 10109 1 516 . 1 1 49 49 ILE HG13 H 1 0.841 0.030 . 2 . . . . 49 ILE HG13 . 10109 1 517 . 1 1 49 49 ILE HG21 H 1 0.796 0.030 . 1 . . . . 49 ILE HG2 . 10109 1 518 . 1 1 49 49 ILE HG22 H 1 0.796 0.030 . 1 . . . . 49 ILE HG2 . 10109 1 519 . 1 1 49 49 ILE HG23 H 1 0.796 0.030 . 1 . . . . 49 ILE HG2 . 10109 1 520 . 1 1 49 49 ILE HD11 H 1 0.838 0.030 . 1 . . . . 49 ILE HD1 . 10109 1 521 . 1 1 49 49 ILE HD12 H 1 0.838 0.030 . 1 . . . . 49 ILE HD1 . 10109 1 522 . 1 1 49 49 ILE HD13 H 1 0.838 0.030 . 1 . . . . 49 ILE HD1 . 10109 1 523 . 1 1 49 49 ILE C C 13 176.402 0.300 . 1 . . . . 49 ILE C . 10109 1 524 . 1 1 49 49 ILE CA C 13 63.169 0.300 . 1 . . . . 49 ILE CA . 10109 1 525 . 1 1 49 49 ILE CB C 13 37.101 0.300 . 1 . . . . 49 ILE CB . 10109 1 526 . 1 1 49 49 ILE CG1 C 13 27.923 0.300 . 1 . . . . 49 ILE CG1 . 10109 1 527 . 1 1 49 49 ILE CG2 C 13 17.522 0.300 . 1 . . . . 49 ILE CG2 . 10109 1 528 . 1 1 49 49 ILE CD1 C 13 13.783 0.300 . 1 . . . . 49 ILE CD1 . 10109 1 529 . 1 1 49 49 ILE N N 15 119.332 0.300 . 1 . . . . 49 ILE N . 10109 1 530 . 1 1 50 50 SER H H 1 9.453 0.030 . 1 . . . . 50 SER H . 10109 1 531 . 1 1 50 50 SER HA H 1 4.633 0.030 . 1 . . . . 50 SER HA . 10109 1 532 . 1 1 50 50 SER HB2 H 1 3.960 0.030 . 2 . . . . 50 SER HB2 . 10109 1 533 . 1 1 50 50 SER HB3 H 1 3.485 0.030 . 2 . . . . 50 SER HB3 . 10109 1 534 . 1 1 50 50 SER C C 13 174.481 0.300 . 1 . . . . 50 SER C . 10109 1 535 . 1 1 50 50 SER CA C 13 58.595 0.300 . 1 . . . . 50 SER CA . 10109 1 536 . 1 1 50 50 SER CB C 13 64.962 0.300 . 1 . . . . 50 SER CB . 10109 1 537 . 1 1 50 50 SER N N 15 126.036 0.300 . 1 . . . . 50 SER N . 10109 1 538 . 1 1 51 51 TYR H H 1 7.544 0.030 . 1 . . . . 51 TYR H . 10109 1 539 . 1 1 51 51 TYR HA H 1 4.291 0.030 . 1 . . . . 51 TYR HA . 10109 1 540 . 1 1 51 51 TYR HB2 H 1 3.179 0.030 . 2 . . . . 51 TYR HB2 . 10109 1 541 . 1 1 51 51 TYR HB3 H 1 2.403 0.030 . 2 . . . . 51 TYR HB3 . 10109 1 542 . 1 1 51 51 TYR HD1 H 1 6.997 0.030 . 1 . . . . 51 TYR HD1 . 10109 1 543 . 1 1 51 51 TYR HD2 H 1 6.997 0.030 . 1 . . . . 51 TYR HD2 . 10109 1 544 . 1 1 51 51 TYR HE1 H 1 6.833 0.030 . 1 . . . . 51 TYR HE1 . 10109 1 545 . 1 1 51 51 TYR HE2 H 1 6.833 0.030 . 1 . . . . 51 TYR HE2 . 10109 1 546 . 1 1 51 51 TYR C C 13 172.150 0.300 . 1 . . . . 51 TYR C . 10109 1 547 . 1 1 51 51 TYR CA C 13 59.541 0.300 . 1 . . . . 51 TYR CA . 10109 1 548 . 1 1 51 51 TYR CB C 13 41.979 0.300 . 1 . . . . 51 TYR CB . 10109 1 549 . 1 1 51 51 TYR CD1 C 13 132.962 0.300 . 1 . . . . 51 TYR CD1 . 10109 1 550 . 1 1 51 51 TYR CD2 C 13 132.962 0.300 . 1 . . . . 51 TYR CD2 . 10109 1 551 . 1 1 51 51 TYR CE1 C 13 118.346 0.300 . 1 . . . . 51 TYR CE1 . 10109 1 552 . 1 1 51 51 TYR CE2 C 13 118.346 0.300 . 1 . . . . 51 TYR CE2 . 10109 1 553 . 1 1 51 51 TYR N N 15 122.544 0.300 . 1 . . . . 51 TYR N . 10109 1 554 . 1 1 52 52 ILE H H 1 7.110 0.030 . 1 . . . . 52 ILE H . 10109 1 555 . 1 1 52 52 ILE HA H 1 4.583 0.030 . 1 . . . . 52 ILE HA . 10109 1 556 . 1 1 52 52 ILE HB H 1 1.371 0.030 . 1 . . . . 52 ILE HB . 10109 1 557 . 1 1 52 52 ILE HG12 H 1 1.267 0.030 . 2 . . . . 52 ILE HG12 . 10109 1 558 . 1 1 52 52 ILE HG13 H 1 0.599 0.030 . 2 . . . . 52 ILE HG13 . 10109 1 559 . 1 1 52 52 ILE HG21 H 1 0.551 0.030 . 1 . . . . 52 ILE HG2 . 10109 1 560 . 1 1 52 52 ILE HG22 H 1 0.551 0.030 . 1 . . . . 52 ILE HG2 . 10109 1 561 . 1 1 52 52 ILE HG23 H 1 0.551 0.030 . 1 . . . . 52 ILE HG2 . 10109 1 562 . 1 1 52 52 ILE HD11 H 1 0.535 0.030 . 1 . . . . 52 ILE HD1 . 10109 1 563 . 1 1 52 52 ILE HD12 H 1 0.535 0.030 . 1 . . . . 52 ILE HD1 . 10109 1 564 . 1 1 52 52 ILE HD13 H 1 0.535 0.030 . 1 . . . . 52 ILE HD1 . 10109 1 565 . 1 1 52 52 ILE C C 13 174.897 0.300 . 1 . . . . 52 ILE C . 10109 1 566 . 1 1 52 52 ILE CA C 13 59.357 0.300 . 1 . . . . 52 ILE CA . 10109 1 567 . 1 1 52 52 ILE CB C 13 40.307 0.300 . 1 . . . . 52 ILE CB . 10109 1 568 . 1 1 52 52 ILE CG1 C 13 28.063 0.300 . 1 . . . . 52 ILE CG1 . 10109 1 569 . 1 1 52 52 ILE CG2 C 13 16.971 0.300 . 1 . . . . 52 ILE CG2 . 10109 1 570 . 1 1 52 52 ILE CD1 C 13 13.575 0.300 . 1 . . . . 52 ILE CD1 . 10109 1 571 . 1 1 52 52 ILE N N 15 125.700 0.300 . 1 . . . . 52 ILE N . 10109 1 572 . 1 1 53 53 GLU H H 1 9.053 0.030 . 1 . . . . 53 GLU H . 10109 1 573 . 1 1 53 53 GLU HA H 1 4.009 0.030 . 1 . . . . 53 GLU HA . 10109 1 574 . 1 1 53 53 GLU HB2 H 1 1.988 0.030 . 1 . . . . 53 GLU HB2 . 10109 1 575 . 1 1 53 53 GLU HB3 H 1 1.988 0.030 . 1 . . . . 53 GLU HB3 . 10109 1 576 . 1 1 53 53 GLU HG2 H 1 2.522 0.030 . 2 . . . . 53 GLU HG2 . 10109 1 577 . 1 1 53 53 GLU HG3 H 1 2.465 0.030 . 2 . . . . 53 GLU HG3 . 10109 1 578 . 1 1 53 53 GLU C C 13 176.915 0.300 . 1 . . . . 53 GLU C . 10109 1 579 . 1 1 53 53 GLU CA C 13 55.910 0.300 . 1 . . . . 53 GLU CA . 10109 1 580 . 1 1 53 53 GLU CB C 13 30.365 0.300 . 1 . . . . 53 GLU CB . 10109 1 581 . 1 1 53 53 GLU CG C 13 35.488 0.300 . 1 . . . . 53 GLU CG . 10109 1 582 . 1 1 53 53 GLU N N 15 128.025 0.300 . 1 . . . . 53 GLU N . 10109 1 583 . 1 1 54 54 ALA H H 1 8.769 0.030 . 1 . . . . 54 ALA H . 10109 1 584 . 1 1 54 54 ALA HA H 1 4.214 0.030 . 1 . . . . 54 ALA HA . 10109 1 585 . 1 1 54 54 ALA HB1 H 1 1.413 0.030 . 1 . . . . 54 ALA HB . 10109 1 586 . 1 1 54 54 ALA HB2 H 1 1.413 0.030 . 1 . . . . 54 ALA HB . 10109 1 587 . 1 1 54 54 ALA HB3 H 1 1.413 0.030 . 1 . . . . 54 ALA HB . 10109 1 588 . 1 1 54 54 ALA C C 13 178.038 0.300 . 1 . . . . 54 ALA C . 10109 1 589 . 1 1 54 54 ALA CA C 13 53.336 0.300 . 1 . . . . 54 ALA CA . 10109 1 590 . 1 1 54 54 ALA CB C 13 18.549 0.300 . 1 . . . . 54 ALA CB . 10109 1 591 . 1 1 54 54 ALA N N 15 130.707 0.300 . 1 . . . . 54 ALA N . 10109 1 592 . 1 1 55 55 ASP H H 1 9.262 0.030 . 1 . . . . 55 ASP H . 10109 1 593 . 1 1 55 55 ASP HA H 1 4.292 0.030 . 1 . . . . 55 ASP HA . 10109 1 594 . 1 1 55 55 ASP HB2 H 1 2.994 0.030 . 2 . . . . 55 ASP HB2 . 10109 1 595 . 1 1 55 55 ASP HB3 H 1 2.703 0.030 . 2 . . . . 55 ASP HB3 . 10109 1 596 . 1 1 55 55 ASP C C 13 174.069 0.300 . 1 . . . . 55 ASP C . 10109 1 597 . 1 1 55 55 ASP CA C 13 55.669 0.300 . 1 . . . . 55 ASP CA . 10109 1 598 . 1 1 55 55 ASP CB C 13 39.761 0.300 . 1 . . . . 55 ASP CB . 10109 1 599 . 1 1 55 55 ASP N N 15 117.636 0.300 . 1 . . . . 55 ASP N . 10109 1 600 . 1 1 56 56 SER H H 1 7.387 0.030 . 1 . . . . 56 SER H . 10109 1 601 . 1 1 56 56 SER HA H 1 4.900 0.030 . 1 . . . . 56 SER HA . 10109 1 602 . 1 1 56 56 SER HB2 H 1 4.103 0.030 . 2 . . . . 56 SER HB2 . 10109 1 603 . 1 1 56 56 SER HB3 H 1 3.583 0.030 . 2 . . . . 56 SER HB3 . 10109 1 604 . 1 1 56 56 SER C C 13 173.534 0.300 . 1 . . . . 56 SER C . 10109 1 605 . 1 1 56 56 SER CA C 13 56.768 0.300 . 1 . . . . 56 SER CA . 10109 1 606 . 1 1 56 56 SER CB C 13 64.734 0.300 . 1 . . . . 56 SER CB . 10109 1 607 . 1 1 56 56 SER N N 15 112.292 0.300 . 1 . . . . 56 SER N . 10109 1 608 . 1 1 57 57 PRO HA H 1 4.321 0.030 . 1 . . . . 57 PRO HA . 10109 1 609 . 1 1 57 57 PRO HB2 H 1 2.812 0.030 . 2 . . . . 57 PRO HB2 . 10109 1 610 . 1 1 57 57 PRO HB3 H 1 2.155 0.030 . 2 . . . . 57 PRO HB3 . 10109 1 611 . 1 1 57 57 PRO HG2 H 1 2.755 0.030 . 2 . . . . 57 PRO HG2 . 10109 1 612 . 1 1 57 57 PRO HG3 H 1 2.204 0.030 . 2 . . . . 57 PRO HG3 . 10109 1 613 . 1 1 57 57 PRO HD2 H 1 3.934 0.030 . 2 . . . . 57 PRO HD2 . 10109 1 614 . 1 1 57 57 PRO HD3 H 1 3.716 0.030 . 2 . . . . 57 PRO HD3 . 10109 1 615 . 1 1 57 57 PRO C C 13 179.142 0.300 . 1 . . . . 57 PRO C . 10109 1 616 . 1 1 57 57 PRO CA C 13 65.972 0.300 . 1 . . . . 57 PRO CA . 10109 1 617 . 1 1 57 57 PRO CB C 13 32.759 0.300 . 1 . . . . 57 PRO CB . 10109 1 618 . 1 1 57 57 PRO CG C 13 29.633 0.300 . 1 . . . . 57 PRO CG . 10109 1 619 . 1 1 57 57 PRO CD C 13 50.899 0.300 . 1 . . . . 57 PRO CD . 10109 1 620 . 1 1 58 58 ALA H H 1 7.736 0.030 . 1 . . . . 58 ALA H . 10109 1 621 . 1 1 58 58 ALA HA H 1 4.073 0.030 . 1 . . . . 58 ALA HA . 10109 1 622 . 1 1 58 58 ALA HB1 H 1 1.365 0.030 . 1 . . . . 58 ALA HB . 10109 1 623 . 1 1 58 58 ALA HB2 H 1 1.365 0.030 . 1 . . . . 58 ALA HB . 10109 1 624 . 1 1 58 58 ALA HB3 H 1 1.365 0.030 . 1 . . . . 58 ALA HB . 10109 1 625 . 1 1 58 58 ALA C C 13 178.074 0.300 . 1 . . . . 58 ALA C . 10109 1 626 . 1 1 58 58 ALA CA C 13 54.753 0.300 . 1 . . . . 58 ALA CA . 10109 1 627 . 1 1 58 58 ALA CB C 13 20.086 0.300 . 1 . . . . 58 ALA CB . 10109 1 628 . 1 1 58 58 ALA N N 15 116.878 0.300 . 1 . . . . 58 ALA N . 10109 1 629 . 1 1 59 59 GLU H H 1 7.692 0.030 . 1 . . . . 59 GLU H . 10109 1 630 . 1 1 59 59 GLU HA H 1 3.905 0.030 . 1 . . . . 59 GLU HA . 10109 1 631 . 1 1 59 59 GLU HB2 H 1 2.271 0.030 . 2 . . . . 59 GLU HB2 . 10109 1 632 . 1 1 59 59 GLU HB3 H 1 2.133 0.030 . 2 . . . . 59 GLU HB3 . 10109 1 633 . 1 1 59 59 GLU HG2 H 1 2.207 0.030 . 1 . . . . 59 GLU HG2 . 10109 1 634 . 1 1 59 59 GLU HG3 H 1 2.207 0.030 . 1 . . . . 59 GLU HG3 . 10109 1 635 . 1 1 59 59 GLU C C 13 178.791 0.300 . 1 . . . . 59 GLU C . 10109 1 636 . 1 1 59 59 GLU CA C 13 59.496 0.300 . 1 . . . . 59 GLU CA . 10109 1 637 . 1 1 59 59 GLU CB C 13 30.425 0.300 . 1 . . . . 59 GLU CB . 10109 1 638 . 1 1 59 59 GLU CG C 13 37.454 0.300 . 1 . . . . 59 GLU CG . 10109 1 639 . 1 1 59 59 GLU N N 15 120.517 0.300 . 1 . . . . 59 GLU N . 10109 1 640 . 1 1 60 60 ARG H H 1 8.493 0.030 . 1 . . . . 60 ARG H . 10109 1 641 . 1 1 60 60 ARG HA H 1 4.051 0.030 . 1 . . . . 60 ARG HA . 10109 1 642 . 1 1 60 60 ARG HB2 H 1 1.905 0.030 . 2 . . . . 60 ARG HB2 . 10109 1 643 . 1 1 60 60 ARG HB3 H 1 1.810 0.030 . 2 . . . . 60 ARG HB3 . 10109 1 644 . 1 1 60 60 ARG HG2 H 1 1.801 0.030 . 2 . . . . 60 ARG HG2 . 10109 1 645 . 1 1 60 60 ARG HG3 H 1 1.695 0.030 . 2 . . . . 60 ARG HG3 . 10109 1 646 . 1 1 60 60 ARG HD2 H 1 3.251 0.030 . 2 . . . . 60 ARG HD2 . 10109 1 647 . 1 1 60 60 ARG HD3 H 1 3.057 0.030 . 2 . . . . 60 ARG HD3 . 10109 1 648 . 1 1 60 60 ARG HE H 1 7.160 0.030 . 1 . . . . 60 ARG HE . 10109 1 649 . 1 1 60 60 ARG C C 13 178.621 0.300 . 1 . . . . 60 ARG C . 10109 1 650 . 1 1 60 60 ARG CA C 13 58.839 0.300 . 1 . . . . 60 ARG CA . 10109 1 651 . 1 1 60 60 ARG CB C 13 31.026 0.300 . 1 . . . . 60 ARG CB . 10109 1 652 . 1 1 60 60 ARG CG C 13 28.509 0.300 . 1 . . . . 60 ARG CG . 10109 1 653 . 1 1 60 60 ARG CD C 13 43.654 0.300 . 1 . . . . 60 ARG CD . 10109 1 654 . 1 1 60 60 ARG N N 15 116.878 0.300 . 1 . . . . 60 ARG N . 10109 1 655 . 1 1 60 60 ARG NE N 15 84.526 0.300 . 1 . . . . 60 ARG NE . 10109 1 656 . 1 1 61 61 CYS H H 1 7.648 0.030 . 1 . . . . 61 CYS H . 10109 1 657 . 1 1 61 61 CYS HA H 1 4.608 0.030 . 1 . . . . 61 CYS HA . 10109 1 658 . 1 1 61 61 CYS HB2 H 1 3.141 0.030 . 2 . . . . 61 CYS HB2 . 10109 1 659 . 1 1 61 61 CYS HB3 H 1 3.047 0.030 . 2 . . . . 61 CYS HB3 . 10109 1 660 . 1 1 61 61 CYS C C 13 175.914 0.300 . 1 . . . . 61 CYS C . 10109 1 661 . 1 1 61 61 CYS CA C 13 59.742 0.300 . 1 . . . . 61 CYS CA . 10109 1 662 . 1 1 61 61 CYS CB C 13 26.988 0.300 . 1 . . . . 61 CYS CB . 10109 1 663 . 1 1 61 61 CYS N N 15 113.152 0.300 . 1 . . . . 61 CYS N . 10109 1 664 . 1 1 62 62 GLY H H 1 7.332 0.030 . 1 . . . . 62 GLY H . 10109 1 665 . 1 1 62 62 GLY HA2 H 1 4.138 0.030 . 2 . . . . 62 GLY HA2 . 10109 1 666 . 1 1 62 62 GLY HA3 H 1 3.974 0.030 . 2 . . . . 62 GLY HA3 . 10109 1 667 . 1 1 62 62 GLY C C 13 174.615 0.300 . 1 . . . . 62 GLY C . 10109 1 668 . 1 1 62 62 GLY CA C 13 47.079 0.300 . 1 . . . . 62 GLY CA . 10109 1 669 . 1 1 62 62 GLY N N 15 110.254 0.300 . 1 . . . . 62 GLY N . 10109 1 670 . 1 1 63 63 VAL H H 1 7.291 0.030 . 1 . . . . 63 VAL H . 10109 1 671 . 1 1 63 63 VAL HA H 1 4.357 0.030 . 1 . . . . 63 VAL HA . 10109 1 672 . 1 1 63 63 VAL HB H 1 2.175 0.030 . 1 . . . . 63 VAL HB . 10109 1 673 . 1 1 63 63 VAL HG11 H 1 0.847 0.030 . 1 . . . . 63 VAL HG1 . 10109 1 674 . 1 1 63 63 VAL HG12 H 1 0.847 0.030 . 1 . . . . 63 VAL HG1 . 10109 1 675 . 1 1 63 63 VAL HG13 H 1 0.847 0.030 . 1 . . . . 63 VAL HG1 . 10109 1 676 . 1 1 63 63 VAL HG21 H 1 0.773 0.030 . 1 . . . . 63 VAL HG2 . 10109 1 677 . 1 1 63 63 VAL HG22 H 1 0.773 0.030 . 1 . . . . 63 VAL HG2 . 10109 1 678 . 1 1 63 63 VAL HG23 H 1 0.773 0.030 . 1 . . . . 63 VAL HG2 . 10109 1 679 . 1 1 63 63 VAL C C 13 174.809 0.300 . 1 . . . . 63 VAL C . 10109 1 680 . 1 1 63 63 VAL CA C 13 61.581 0.300 . 1 . . . . 63 VAL CA . 10109 1 681 . 1 1 63 63 VAL CB C 13 32.890 0.300 . 1 . . . . 63 VAL CB . 10109 1 682 . 1 1 63 63 VAL CG1 C 13 21.181 0.300 . 2 . . . . 63 VAL CG1 . 10109 1 683 . 1 1 63 63 VAL CG2 C 13 20.061 0.300 . 2 . . . . 63 VAL CG2 . 10109 1 684 . 1 1 63 63 VAL N N 15 113.347 0.300 . 1 . . . . 63 VAL N . 10109 1 685 . 1 1 64 64 LEU H H 1 7.783 0.030 . 1 . . . . 64 LEU H . 10109 1 686 . 1 1 64 64 LEU HA H 1 4.639 0.030 . 1 . . . . 64 LEU HA . 10109 1 687 . 1 1 64 64 LEU HB2 H 1 1.630 0.030 . 2 . . . . 64 LEU HB2 . 10109 1 688 . 1 1 64 64 LEU HB3 H 1 1.030 0.030 . 2 . . . . 64 LEU HB3 . 10109 1 689 . 1 1 64 64 LEU HG H 1 1.582 0.030 . 1 . . . . 64 LEU HG . 10109 1 690 . 1 1 64 64 LEU HD11 H 1 0.804 0.030 . 1 . . . . 64 LEU HD1 . 10109 1 691 . 1 1 64 64 LEU HD12 H 1 0.804 0.030 . 1 . . . . 64 LEU HD1 . 10109 1 692 . 1 1 64 64 LEU HD13 H 1 0.804 0.030 . 1 . . . . 64 LEU HD1 . 10109 1 693 . 1 1 64 64 LEU HD21 H 1 0.804 0.030 . 1 . . . . 64 LEU HD2 . 10109 1 694 . 1 1 64 64 LEU HD22 H 1 0.804 0.030 . 1 . . . . 64 LEU HD2 . 10109 1 695 . 1 1 64 64 LEU HD23 H 1 0.804 0.030 . 1 . . . . 64 LEU HD2 . 10109 1 696 . 1 1 64 64 LEU C C 13 175.671 0.300 . 1 . . . . 64 LEU C . 10109 1 697 . 1 1 64 64 LEU CA C 13 53.591 0.300 . 1 . . . . 64 LEU CA . 10109 1 698 . 1 1 64 64 LEU CB C 13 44.584 0.300 . 1 . . . . 64 LEU CB . 10109 1 699 . 1 1 64 64 LEU CG C 13 26.791 0.300 . 1 . . . . 64 LEU CG . 10109 1 700 . 1 1 64 64 LEU CD1 C 13 26.619 0.300 . 2 . . . . 64 LEU CD1 . 10109 1 701 . 1 1 64 64 LEU CD2 C 13 24.113 0.300 . 2 . . . . 64 LEU CD2 . 10109 1 702 . 1 1 64 64 LEU N N 15 119.561 0.300 . 1 . . . . 64 LEU N . 10109 1 703 . 1 1 65 65 GLN H H 1 8.488 0.030 . 1 . . . . 65 GLN H . 10109 1 704 . 1 1 65 65 GLN HA H 1 4.444 0.030 . 1 . . . . 65 GLN HA . 10109 1 705 . 1 1 65 65 GLN HB2 H 1 1.972 0.030 . 2 . . . . 65 GLN HB2 . 10109 1 706 . 1 1 65 65 GLN HB3 H 1 1.893 0.030 . 2 . . . . 65 GLN HB3 . 10109 1 707 . 1 1 65 65 GLN HG2 H 1 2.264 0.030 . 1 . . . . 65 GLN HG2 . 10109 1 708 . 1 1 65 65 GLN HG3 H 1 2.264 0.030 . 1 . . . . 65 GLN HG3 . 10109 1 709 . 1 1 65 65 GLN HE21 H 1 7.733 0.030 . 2 . . . . 65 GLN HE21 . 10109 1 710 . 1 1 65 65 GLN HE22 H 1 6.712 0.030 . 2 . . . . 65 GLN HE22 . 10109 1 711 . 1 1 65 65 GLN C C 13 174.967 0.300 . 1 . . . . 65 GLN C . 10109 1 712 . 1 1 65 65 GLN CA C 13 53.838 0.300 . 1 . . . . 65 GLN CA . 10109 1 713 . 1 1 65 65 GLN CB C 13 32.595 0.300 . 1 . . . . 65 GLN CB . 10109 1 714 . 1 1 65 65 GLN CG C 13 33.539 0.300 . 1 . . . . 65 GLN CG . 10109 1 715 . 1 1 65 65 GLN N N 15 119.969 0.300 . 1 . . . . 65 GLN N . 10109 1 716 . 1 1 65 65 GLN NE2 N 15 112.773 0.300 . 1 . . . . 65 GLN NE2 . 10109 1 717 . 1 1 66 66 ILE H H 1 8.448 0.030 . 1 . . . . 66 ILE H . 10109 1 718 . 1 1 66 66 ILE HA H 1 3.501 0.030 . 1 . . . . 66 ILE HA . 10109 1 719 . 1 1 66 66 ILE HB H 1 1.730 0.030 . 1 . . . . 66 ILE HB . 10109 1 720 . 1 1 66 66 ILE HG12 H 1 1.534 0.030 . 2 . . . . 66 ILE HG12 . 10109 1 721 . 1 1 66 66 ILE HG13 H 1 0.948 0.030 . 2 . . . . 66 ILE HG13 . 10109 1 722 . 1 1 66 66 ILE HG21 H 1 0.929 0.030 . 1 . . . . 66 ILE HG2 . 10109 1 723 . 1 1 66 66 ILE HG22 H 1 0.929 0.030 . 1 . . . . 66 ILE HG2 . 10109 1 724 . 1 1 66 66 ILE HG23 H 1 0.929 0.030 . 1 . . . . 66 ILE HG2 . 10109 1 725 . 1 1 66 66 ILE HD11 H 1 0.868 0.030 . 1 . . . . 66 ILE HD1 . 10109 1 726 . 1 1 66 66 ILE HD12 H 1 0.868 0.030 . 1 . . . . 66 ILE HD1 . 10109 1 727 . 1 1 66 66 ILE HD13 H 1 0.868 0.030 . 1 . . . . 66 ILE HD1 . 10109 1 728 . 1 1 66 66 ILE C C 13 177.686 0.300 . 1 . . . . 66 ILE C . 10109 1 729 . 1 1 66 66 ILE CA C 13 63.147 0.300 . 1 . . . . 66 ILE CA . 10109 1 730 . 1 1 66 66 ILE CB C 13 37.106 0.300 . 1 . . . . 66 ILE CB . 10109 1 731 . 1 1 66 66 ILE CG1 C 13 28.264 0.300 . 1 . . . . 66 ILE CG1 . 10109 1 732 . 1 1 66 66 ILE CG2 C 13 17.203 0.300 . 1 . . . . 66 ILE CG2 . 10109 1 733 . 1 1 66 66 ILE CD1 C 13 12.659 0.300 . 1 . . . . 66 ILE CD1 . 10109 1 734 . 1 1 66 66 ILE N N 15 121.408 0.300 . 1 . . . . 66 ILE N . 10109 1 735 . 1 1 67 67 GLY H H 1 9.291 0.030 . 1 . . . . 67 GLY H . 10109 1 736 . 1 1 67 67 GLY HA2 H 1 4.608 0.030 . 2 . . . . 67 GLY HA2 . 10109 1 737 . 1 1 67 67 GLY HA3 H 1 3.550 0.030 . 2 . . . . 67 GLY HA3 . 10109 1 738 . 1 1 67 67 GLY C C 13 174.542 0.300 . 1 . . . . 67 GLY C . 10109 1 739 . 1 1 67 67 GLY CA C 13 44.691 0.300 . 1 . . . . 67 GLY CA . 10109 1 740 . 1 1 67 67 GLY N N 15 115.849 0.300 . 1 . . . . 67 GLY N . 10109 1 741 . 1 1 68 68 ASP H H 1 7.883 0.030 . 1 . . . . 68 ASP H . 10109 1 742 . 1 1 68 68 ASP HA H 1 4.768 0.030 . 1 . . . . 68 ASP HA . 10109 1 743 . 1 1 68 68 ASP HB2 H 1 2.756 0.030 . 2 . . . . 68 ASP HB2 . 10109 1 744 . 1 1 68 68 ASP HB3 H 1 2.639 0.030 . 2 . . . . 68 ASP HB3 . 10109 1 745 . 1 1 68 68 ASP C C 13 175.149 0.300 . 1 . . . . 68 ASP C . 10109 1 746 . 1 1 68 68 ASP CA C 13 55.562 0.300 . 1 . . . . 68 ASP CA . 10109 1 747 . 1 1 68 68 ASP CB C 13 40.085 0.300 . 1 . . . . 68 ASP CB . 10109 1 748 . 1 1 68 68 ASP N N 15 121.711 0.300 . 1 . . . . 68 ASP N . 10109 1 749 . 1 1 69 69 ARG H H 1 8.828 0.030 . 1 . . . . 69 ARG H . 10109 1 750 . 1 1 69 69 ARG HA H 1 4.903 0.030 . 1 . . . . 69 ARG HA . 10109 1 751 . 1 1 69 69 ARG HB2 H 1 2.129 0.030 . 2 . . . . 69 ARG HB2 . 10109 1 752 . 1 1 69 69 ARG HB3 H 1 1.630 0.030 . 2 . . . . 69 ARG HB3 . 10109 1 753 . 1 1 69 69 ARG HG2 H 1 1.791 0.030 . 2 . . . . 69 ARG HG2 . 10109 1 754 . 1 1 69 69 ARG HG3 H 1 1.749 0.030 . 2 . . . . 69 ARG HG3 . 10109 1 755 . 1 1 69 69 ARG HD2 H 1 3.566 0.030 . 2 . . . . 69 ARG HD2 . 10109 1 756 . 1 1 69 69 ARG HD3 H 1 3.159 0.030 . 2 . . . . 69 ARG HD3 . 10109 1 757 . 1 1 69 69 ARG HE H 1 7.094 0.030 . 1 . . . . 69 ARG HE . 10109 1 758 . 1 1 69 69 ARG C C 13 176.241 0.300 . 1 . . . . 69 ARG C . 10109 1 759 . 1 1 69 69 ARG CA C 13 56.460 0.300 . 1 . . . . 69 ARG CA . 10109 1 760 . 1 1 69 69 ARG CB C 13 31.034 0.300 . 1 . . . . 69 ARG CB . 10109 1 761 . 1 1 69 69 ARG CG C 13 29.043 0.300 . 1 . . . . 69 ARG CG . 10109 1 762 . 1 1 69 69 ARG CD C 13 42.529 0.300 . 1 . . . . 69 ARG CD . 10109 1 763 . 1 1 69 69 ARG N N 15 120.650 0.300 . 1 . . . . 69 ARG N . 10109 1 764 . 1 1 69 69 ARG NE N 15 82.902 0.300 . 1 . . . . 69 ARG NE . 10109 1 765 . 1 1 70 70 VAL H H 1 8.552 0.030 . 1 . . . . 70 VAL H . 10109 1 766 . 1 1 70 70 VAL HA H 1 4.288 0.030 . 1 . . . . 70 VAL HA . 10109 1 767 . 1 1 70 70 VAL HB H 1 1.923 0.030 . 1 . . . . 70 VAL HB . 10109 1 768 . 1 1 70 70 VAL HG11 H 1 0.793 0.030 . 1 . . . . 70 VAL HG1 . 10109 1 769 . 1 1 70 70 VAL HG12 H 1 0.793 0.030 . 1 . . . . 70 VAL HG1 . 10109 1 770 . 1 1 70 70 VAL HG13 H 1 0.793 0.030 . 1 . . . . 70 VAL HG1 . 10109 1 771 . 1 1 70 70 VAL HG21 H 1 0.793 0.030 . 1 . . . . 70 VAL HG2 . 10109 1 772 . 1 1 70 70 VAL HG22 H 1 0.793 0.030 . 1 . . . . 70 VAL HG2 . 10109 1 773 . 1 1 70 70 VAL HG23 H 1 0.793 0.030 . 1 . . . . 70 VAL HG2 . 10109 1 774 . 1 1 70 70 VAL C C 13 174.796 0.300 . 1 . . . . 70 VAL C . 10109 1 775 . 1 1 70 70 VAL CA C 13 62.338 0.300 . 1 . . . . 70 VAL CA . 10109 1 776 . 1 1 70 70 VAL CB C 13 31.494 0.300 . 1 . . . . 70 VAL CB . 10109 1 777 . 1 1 70 70 VAL CG1 C 13 22.477 0.300 . 2 . . . . 70 VAL CG1 . 10109 1 778 . 1 1 70 70 VAL CG2 C 13 21.400 0.300 . 2 . . . . 70 VAL CG2 . 10109 1 779 . 1 1 70 70 VAL N N 15 121.771 0.300 . 1 . . . . 70 VAL N . 10109 1 780 . 1 1 71 71 MET H H 1 9.094 0.030 . 1 . . . . 71 MET H . 10109 1 781 . 1 1 71 71 MET HA H 1 4.511 0.030 . 1 . . . . 71 MET HA . 10109 1 782 . 1 1 71 71 MET HB2 H 1 2.173 0.030 . 2 . . . . 71 MET HB2 . 10109 1 783 . 1 1 71 71 MET HB3 H 1 1.713 0.030 . 2 . . . . 71 MET HB3 . 10109 1 784 . 1 1 71 71 MET HG2 H 1 2.607 0.030 . 2 . . . . 71 MET HG2 . 10109 1 785 . 1 1 71 71 MET HG3 H 1 2.359 0.030 . 2 . . . . 71 MET HG3 . 10109 1 786 . 1 1 71 71 MET HE1 H 1 1.998 0.030 . 1 . . . . 71 MET HE . 10109 1 787 . 1 1 71 71 MET HE2 H 1 1.998 0.030 . 1 . . . . 71 MET HE . 10109 1 788 . 1 1 71 71 MET HE3 H 1 1.998 0.030 . 1 . . . . 71 MET HE . 10109 1 789 . 1 1 71 71 MET C C 13 178.220 0.300 . 1 . . . . 71 MET C . 10109 1 790 . 1 1 71 71 MET CA C 13 55.182 0.300 . 1 . . . . 71 MET CA . 10109 1 791 . 1 1 71 71 MET CB C 13 31.726 0.300 . 1 . . . . 71 MET CB . 10109 1 792 . 1 1 71 71 MET CG C 13 31.917 0.300 . 1 . . . . 71 MET CG . 10109 1 793 . 1 1 71 71 MET CE C 13 16.249 0.300 . 1 . . . . 71 MET CE . 10109 1 794 . 1 1 71 71 MET N N 15 125.508 0.300 . 1 . . . . 71 MET N . 10109 1 795 . 1 1 72 72 ALA H H 1 7.808 0.030 . 1 . . . . 72 ALA H . 10109 1 796 . 1 1 72 72 ALA HA H 1 5.015 0.030 . 1 . . . . 72 ALA HA . 10109 1 797 . 1 1 72 72 ALA HB1 H 1 1.151 0.030 . 1 . . . . 72 ALA HB . 10109 1 798 . 1 1 72 72 ALA HB2 H 1 1.151 0.030 . 1 . . . . 72 ALA HB . 10109 1 799 . 1 1 72 72 ALA HB3 H 1 1.151 0.030 . 1 . . . . 72 ALA HB . 10109 1 800 . 1 1 72 72 ALA C C 13 175.489 0.300 . 1 . . . . 72 ALA C . 10109 1 801 . 1 1 72 72 ALA CA C 13 52.897 0.300 . 1 . . . . 72 ALA CA . 10109 1 802 . 1 1 72 72 ALA CB C 13 21.343 0.300 . 1 . . . . 72 ALA CB . 10109 1 803 . 1 1 72 72 ALA N N 15 120.326 0.300 . 1 . . . . 72 ALA N . 10109 1 804 . 1 1 73 73 ILE H H 1 8.180 0.030 . 1 . . . . 73 ILE H . 10109 1 805 . 1 1 73 73 ILE HA H 1 4.438 0.030 . 1 . . . . 73 ILE HA . 10109 1 806 . 1 1 73 73 ILE HB H 1 1.609 0.030 . 1 . . . . 73 ILE HB . 10109 1 807 . 1 1 73 73 ILE HG12 H 1 1.319 0.030 . 2 . . . . 73 ILE HG12 . 10109 1 808 . 1 1 73 73 ILE HG13 H 1 0.641 0.030 . 2 . . . . 73 ILE HG13 . 10109 1 809 . 1 1 73 73 ILE HG21 H 1 0.609 0.030 . 1 . . . . 73 ILE HG2 . 10109 1 810 . 1 1 73 73 ILE HG22 H 1 0.609 0.030 . 1 . . . . 73 ILE HG2 . 10109 1 811 . 1 1 73 73 ILE HG23 H 1 0.609 0.030 . 1 . . . . 73 ILE HG2 . 10109 1 812 . 1 1 73 73 ILE HD11 H 1 0.728 0.030 . 1 . . . . 73 ILE HD1 . 10109 1 813 . 1 1 73 73 ILE HD12 H 1 0.728 0.030 . 1 . . . . 73 ILE HD1 . 10109 1 814 . 1 1 73 73 ILE HD13 H 1 0.728 0.030 . 1 . . . . 73 ILE HD1 . 10109 1 815 . 1 1 73 73 ILE C C 13 175.422 0.300 . 1 . . . . 73 ILE C . 10109 1 816 . 1 1 73 73 ILE CA C 13 60.737 0.300 . 1 . . . . 73 ILE CA . 10109 1 817 . 1 1 73 73 ILE CB C 13 40.010 0.300 . 1 . . . . 73 ILE CB . 10109 1 818 . 1 1 73 73 ILE CG1 C 13 27.388 0.300 . 1 . . . . 73 ILE CG1 . 10109 1 819 . 1 1 73 73 ILE CG2 C 13 17.354 0.300 . 1 . . . . 73 ILE CG2 . 10109 1 820 . 1 1 73 73 ILE CD1 C 13 14.067 0.300 . 1 . . . . 73 ILE CD1 . 10109 1 821 . 1 1 73 73 ILE N N 15 119.185 0.300 . 1 . . . . 73 ILE N . 10109 1 822 . 1 1 74 74 ASN H H 1 9.769 0.030 . 1 . . . . 74 ASN H . 10109 1 823 . 1 1 74 74 ASN HA H 1 4.435 0.030 . 1 . . . . 74 ASN HA . 10109 1 824 . 1 1 74 74 ASN HB2 H 1 3.151 0.030 . 2 . . . . 74 ASN HB2 . 10109 1 825 . 1 1 74 74 ASN HB3 H 1 3.014 0.030 . 2 . . . . 74 ASN HB3 . 10109 1 826 . 1 1 74 74 ASN HD21 H 1 7.699 0.030 . 2 . . . . 74 ASN HD21 . 10109 1 827 . 1 1 74 74 ASN HD22 H 1 7.209 0.030 . 2 . . . . 74 ASN HD22 . 10109 1 828 . 1 1 74 74 ASN C C 13 175.399 0.300 . 1 . . . . 74 ASN C . 10109 1 829 . 1 1 74 74 ASN CA C 13 54.059 0.300 . 1 . . . . 74 ASN CA . 10109 1 830 . 1 1 74 74 ASN CB C 13 36.648 0.300 . 1 . . . . 74 ASN CB . 10109 1 831 . 1 1 74 74 ASN N N 15 126.144 0.300 . 1 . . . . 74 ASN N . 10109 1 832 . 1 1 74 74 ASN ND2 N 15 112.736 0.300 . 1 . . . . 74 ASN ND2 . 10109 1 833 . 1 1 75 75 GLY H H 1 9.250 0.030 . 1 . . . . 75 GLY H . 10109 1 834 . 1 1 75 75 GLY HA2 H 1 4.093 0.030 . 2 . . . . 75 GLY HA2 . 10109 1 835 . 1 1 75 75 GLY HA3 H 1 3.508 0.030 . 2 . . . . 75 GLY HA3 . 10109 1 836 . 1 1 75 75 GLY C C 13 173.874 0.300 . 1 . . . . 75 GLY C . 10109 1 837 . 1 1 75 75 GLY CA C 13 45.038 0.300 . 1 . . . . 75 GLY CA . 10109 1 838 . 1 1 75 75 GLY N N 15 103.568 0.300 . 1 . . . . 75 GLY N . 10109 1 839 . 1 1 76 76 ILE H H 1 8.097 0.030 . 1 . . . . 76 ILE H . 10109 1 840 . 1 1 76 76 ILE HA H 1 4.494 0.030 . 1 . . . . 76 ILE HA . 10109 1 841 . 1 1 76 76 ILE HB H 1 2.257 0.030 . 1 . . . . 76 ILE HB . 10109 1 842 . 1 1 76 76 ILE HG12 H 1 1.548 0.030 . 2 . . . . 76 ILE HG12 . 10109 1 843 . 1 1 76 76 ILE HG13 H 1 1.223 0.030 . 2 . . . . 76 ILE HG13 . 10109 1 844 . 1 1 76 76 ILE HG21 H 1 0.926 0.030 . 1 . . . . 76 ILE HG2 . 10109 1 845 . 1 1 76 76 ILE HG22 H 1 0.926 0.030 . 1 . . . . 76 ILE HG2 . 10109 1 846 . 1 1 76 76 ILE HG23 H 1 0.926 0.030 . 1 . . . . 76 ILE HG2 . 10109 1 847 . 1 1 76 76 ILE HD11 H 1 0.890 0.030 . 1 . . . . 76 ILE HD1 . 10109 1 848 . 1 1 76 76 ILE HD12 H 1 0.890 0.030 . 1 . . . . 76 ILE HD1 . 10109 1 849 . 1 1 76 76 ILE HD13 H 1 0.890 0.030 . 1 . . . . 76 ILE HD1 . 10109 1 850 . 1 1 76 76 ILE C C 13 174.408 0.300 . 1 . . . . 76 ILE C . 10109 1 851 . 1 1 76 76 ILE CA C 13 57.719 0.300 . 1 . . . . 76 ILE CA . 10109 1 852 . 1 1 76 76 ILE CB C 13 37.714 0.300 . 1 . . . . 76 ILE CB . 10109 1 853 . 1 1 76 76 ILE CG1 C 13 27.092 0.300 . 1 . . . . 76 ILE CG1 . 10109 1 854 . 1 1 76 76 ILE CG2 C 13 16.660 0.300 . 1 . . . . 76 ILE CG2 . 10109 1 855 . 1 1 76 76 ILE CD1 C 13 12.086 0.300 . 1 . . . . 76 ILE CD1 . 10109 1 856 . 1 1 76 76 ILE N N 15 125.578 0.300 . 1 . . . . 76 ILE N . 10109 1 857 . 1 1 77 77 PRO HA H 1 4.813 0.030 . 1 . . . . 77 PRO HA . 10109 1 858 . 1 1 77 77 PRO HB2 H 1 2.601 0.030 . 2 . . . . 77 PRO HB2 . 10109 1 859 . 1 1 77 77 PRO HB3 H 1 2.020 0.030 . 2 . . . . 77 PRO HB3 . 10109 1 860 . 1 1 77 77 PRO HG2 H 1 2.213 0.030 . 2 . . . . 77 PRO HG2 . 10109 1 861 . 1 1 77 77 PRO HG3 H 1 2.004 0.030 . 2 . . . . 77 PRO HG3 . 10109 1 862 . 1 1 77 77 PRO HD2 H 1 4.205 0.030 . 2 . . . . 77 PRO HD2 . 10109 1 863 . 1 1 77 77 PRO HD3 H 1 3.790 0.030 . 2 . . . . 77 PRO HD3 . 10109 1 864 . 1 1 77 77 PRO CA C 13 62.741 0.300 . 1 . . . . 77 PRO CA . 10109 1 865 . 1 1 77 77 PRO CB C 13 32.841 0.300 . 1 . . . . 77 PRO CB . 10109 1 866 . 1 1 77 77 PRO CG C 13 27.917 0.300 . 1 . . . . 77 PRO CG . 10109 1 867 . 1 1 77 77 PRO CD C 13 51.619 0.300 . 1 . . . . 77 PRO CD . 10109 1 868 . 1 1 78 78 THR H H 1 8.131 0.030 . 1 . . . . 78 THR H . 10109 1 869 . 1 1 78 78 THR HA H 1 4.288 0.030 . 1 . . . . 78 THR HA . 10109 1 870 . 1 1 78 78 THR HB H 1 4.344 0.030 . 1 . . . . 78 THR HB . 10109 1 871 . 1 1 78 78 THR HG21 H 1 1.031 0.030 . 1 . . . . 78 THR HG2 . 10109 1 872 . 1 1 78 78 THR HG22 H 1 1.031 0.030 . 1 . . . . 78 THR HG2 . 10109 1 873 . 1 1 78 78 THR HG23 H 1 1.031 0.030 . 1 . . . . 78 THR HG2 . 10109 1 874 . 1 1 78 78 THR CA C 13 62.367 0.300 . 1 . . . . 78 THR CA . 10109 1 875 . 1 1 78 78 THR CB C 13 68.517 0.300 . 1 . . . . 78 THR CB . 10109 1 876 . 1 1 78 78 THR CG2 C 13 22.280 0.300 . 1 . . . . 78 THR CG2 . 10109 1 877 . 1 1 78 78 THR N N 15 117.204 0.300 . 1 . . . . 78 THR N . 10109 1 878 . 1 1 79 79 GLU H H 1 7.907 0.030 . 1 . . . . 79 GLU H . 10109 1 879 . 1 1 79 79 GLU HA H 1 4.175 0.030 . 1 . . . . 79 GLU HA . 10109 1 880 . 1 1 79 79 GLU HB2 H 1 2.089 0.030 . 1 . . . . 79 GLU HB2 . 10109 1 881 . 1 1 79 79 GLU HB3 H 1 2.089 0.030 . 1 . . . . 79 GLU HB3 . 10109 1 882 . 1 1 79 79 GLU HG2 H 1 2.261 0.030 . 1 . . . . 79 GLU HG2 . 10109 1 883 . 1 1 79 79 GLU HG3 H 1 2.261 0.030 . 1 . . . . 79 GLU HG3 . 10109 1 884 . 1 1 79 79 GLU CA C 13 58.281 0.300 . 1 . . . . 79 GLU CA . 10109 1 885 . 1 1 79 79 GLU CB C 13 29.689 0.300 . 1 . . . . 79 GLU CB . 10109 1 886 . 1 1 79 79 GLU CG C 13 35.925 0.300 . 1 . . . . 79 GLU CG . 10109 1 887 . 1 1 80 80 ASP H H 1 8.341 0.030 . 1 . . . . 80 ASP H . 10109 1 888 . 1 1 80 80 ASP HA H 1 4.205 0.030 . 1 . . . . 80 ASP HA . 10109 1 889 . 1 1 80 80 ASP HB2 H 1 2.872 0.030 . 2 . . . . 80 ASP HB2 . 10109 1 890 . 1 1 80 80 ASP HB3 H 1 2.674 0.030 . 2 . . . . 80 ASP HB3 . 10109 1 891 . 1 1 80 80 ASP CA C 13 57.340 0.300 . 1 . . . . 80 ASP CA . 10109 1 892 . 1 1 80 80 ASP CB C 13 41.175 0.300 . 1 . . . . 80 ASP CB . 10109 1 893 . 1 1 80 80 ASP N N 15 121.933 0.300 . 1 . . . . 80 ASP N . 10109 1 894 . 1 1 81 81 SER HA H 1 4.284 0.030 . 1 . . . . 81 SER HA . 10109 1 895 . 1 1 81 81 SER HB2 H 1 3.979 0.030 . 2 . . . . 81 SER HB2 . 10109 1 896 . 1 1 81 81 SER HB3 H 1 3.841 0.030 . 2 . . . . 81 SER HB3 . 10109 1 897 . 1 1 81 81 SER CB C 13 64.963 0.300 . 1 . . . . 81 SER CB . 10109 1 898 . 1 1 82 82 THR H H 1 8.100 0.030 . 1 . . . . 82 THR H . 10109 1 899 . 1 1 82 82 THR HA H 1 4.757 0.030 . 1 . . . . 82 THR HA . 10109 1 900 . 1 1 82 82 THR HB H 1 4.325 0.030 . 1 . . . . 82 THR HB . 10109 1 901 . 1 1 82 82 THR HG21 H 1 1.303 0.030 . 1 . . . . 82 THR HG2 . 10109 1 902 . 1 1 82 82 THR HG22 H 1 1.303 0.030 . 1 . . . . 82 THR HG2 . 10109 1 903 . 1 1 82 82 THR HG23 H 1 1.303 0.030 . 1 . . . . 82 THR HG2 . 10109 1 904 . 1 1 82 82 THR C C 13 174.772 0.300 . 1 . . . . 82 THR C . 10109 1 905 . 1 1 82 82 THR CA C 13 59.170 0.300 . 1 . . . . 82 THR CA . 10109 1 906 . 1 1 82 82 THR CB C 13 62.175 0.300 . 1 . . . . 82 THR CB . 10109 1 907 . 1 1 82 82 THR CG2 C 13 22.028 0.300 . 1 . . . . 82 THR CG2 . 10109 1 908 . 1 1 83 83 PHE H H 1 9.021 0.030 . 1 . . . . 83 PHE H . 10109 1 909 . 1 1 83 83 PHE HA H 1 4.183 0.030 . 1 . . . . 83 PHE HA . 10109 1 910 . 1 1 83 83 PHE HB2 H 1 3.280 0.030 . 2 . . . . 83 PHE HB2 . 10109 1 911 . 1 1 83 83 PHE HB3 H 1 3.032 0.030 . 2 . . . . 83 PHE HB3 . 10109 1 912 . 1 1 83 83 PHE HD1 H 1 7.219 0.030 . 1 . . . . 83 PHE HD1 . 10109 1 913 . 1 1 83 83 PHE HD2 H 1 7.219 0.030 . 1 . . . . 83 PHE HD2 . 10109 1 914 . 1 1 83 83 PHE HE1 H 1 7.270 0.030 . 1 . . . . 83 PHE HE1 . 10109 1 915 . 1 1 83 83 PHE HE2 H 1 7.270 0.030 . 1 . . . . 83 PHE HE2 . 10109 1 916 . 1 1 83 83 PHE C C 13 176.751 0.300 . 1 . . . . 83 PHE C . 10109 1 917 . 1 1 83 83 PHE CA C 13 61.725 0.300 . 1 . . . . 83 PHE CA . 10109 1 918 . 1 1 83 83 PHE CB C 13 38.643 0.300 . 1 . . . . 83 PHE CB . 10109 1 919 . 1 1 83 83 PHE CD1 C 13 131.756 0.300 . 1 . . . . 83 PHE CD1 . 10109 1 920 . 1 1 83 83 PHE CD2 C 13 131.756 0.300 . 1 . . . . 83 PHE CD2 . 10109 1 921 . 1 1 84 84 GLU H H 1 8.508 0.030 . 1 . . . . 84 GLU H . 10109 1 922 . 1 1 84 84 GLU HA H 1 3.905 0.030 . 1 . . . . 84 GLU HA . 10109 1 923 . 1 1 84 84 GLU HB2 H 1 1.977 0.030 . 2 . . . . 84 GLU HB2 . 10109 1 924 . 1 1 84 84 GLU HB3 H 1 1.935 0.030 . 2 . . . . 84 GLU HB3 . 10109 1 925 . 1 1 84 84 GLU HG2 H 1 2.310 0.030 . 2 . . . . 84 GLU HG2 . 10109 1 926 . 1 1 84 84 GLU HG3 H 1 2.227 0.030 . 2 . . . . 84 GLU HG3 . 10109 1 927 . 1 1 84 84 GLU C C 13 179.470 0.300 . 1 . . . . 84 GLU C . 10109 1 928 . 1 1 84 84 GLU CA C 13 59.628 0.300 . 1 . . . . 84 GLU CA . 10109 1 929 . 1 1 84 84 GLU CB C 13 29.045 0.300 . 1 . . . . 84 GLU CB . 10109 1 930 . 1 1 84 84 GLU CG C 13 36.466 0.300 . 1 . . . . 84 GLU CG . 10109 1 931 . 1 1 84 84 GLU N N 15 118.826 0.300 . 1 . . . . 84 GLU N . 10109 1 932 . 1 1 85 85 GLU H H 1 7.791 0.030 . 1 . . . . 85 GLU H . 10109 1 933 . 1 1 85 85 GLU HA H 1 3.994 0.030 . 1 . . . . 85 GLU HA . 10109 1 934 . 1 1 85 85 GLU HB2 H 1 2.257 0.030 . 2 . . . . 85 GLU HB2 . 10109 1 935 . 1 1 85 85 GLU HB3 H 1 2.013 0.030 . 2 . . . . 85 GLU HB3 . 10109 1 936 . 1 1 85 85 GLU HG2 H 1 2.317 0.030 . 1 . . . . 85 GLU HG2 . 10109 1 937 . 1 1 85 85 GLU HG3 H 1 2.317 0.030 . 1 . . . . 85 GLU HG3 . 10109 1 938 . 1 1 85 85 GLU C C 13 179.094 0.300 . 1 . . . . 85 GLU C . 10109 1 939 . 1 1 85 85 GLU CA C 13 59.135 0.300 . 1 . . . . 85 GLU CA . 10109 1 940 . 1 1 85 85 GLU CB C 13 29.701 0.300 . 1 . . . . 85 GLU CB . 10109 1 941 . 1 1 85 85 GLU CG C 13 36.987 0.300 . 1 . . . . 85 GLU CG . 10109 1 942 . 1 1 85 85 GLU N N 15 120.145 0.300 . 1 . . . . 85 GLU N . 10109 1 943 . 1 1 86 86 ALA H H 1 8.026 0.030 . 1 . . . . 86 ALA H . 10109 1 944 . 1 1 86 86 ALA HA H 1 3.987 0.030 . 1 . . . . 86 ALA HA . 10109 1 945 . 1 1 86 86 ALA HB1 H 1 1.294 0.030 . 1 . . . . 86 ALA HB . 10109 1 946 . 1 1 86 86 ALA HB2 H 1 1.294 0.030 . 1 . . . . 86 ALA HB . 10109 1 947 . 1 1 86 86 ALA HB3 H 1 1.294 0.030 . 1 . . . . 86 ALA HB . 10109 1 948 . 1 1 86 86 ALA C C 13 178.548 0.300 . 1 . . . . 86 ALA C . 10109 1 949 . 1 1 86 86 ALA CA C 13 55.210 0.300 . 1 . . . . 86 ALA CA . 10109 1 950 . 1 1 86 86 ALA CB C 13 17.801 0.300 . 1 . . . . 86 ALA CB . 10109 1 951 . 1 1 86 86 ALA N N 15 122.428 0.300 . 1 . . . . 86 ALA N . 10109 1 952 . 1 1 87 87 ASN H H 1 8.350 0.030 . 1 . . . . 87 ASN H . 10109 1 953 . 1 1 87 87 ASN HA H 1 4.307 0.030 . 1 . . . . 87 ASN HA . 10109 1 954 . 1 1 87 87 ASN HB2 H 1 2.504 0.030 . 2 . . . . 87 ASN HB2 . 10109 1 955 . 1 1 87 87 ASN HB3 H 1 2.293 0.030 . 2 . . . . 87 ASN HB3 . 10109 1 956 . 1 1 87 87 ASN HD21 H 1 7.341 0.030 . 2 . . . . 87 ASN HD21 . 10109 1 957 . 1 1 87 87 ASN HD22 H 1 6.531 0.030 . 2 . . . . 87 ASN HD22 . 10109 1 958 . 1 1 87 87 ASN C C 13 178.402 0.300 . 1 . . . . 87 ASN C . 10109 1 959 . 1 1 87 87 ASN CA C 13 55.943 0.300 . 1 . . . . 87 ASN CA . 10109 1 960 . 1 1 87 87 ASN CB C 13 38.684 0.300 . 1 . . . . 87 ASN CB . 10109 1 961 . 1 1 87 87 ASN N N 15 114.572 0.300 . 1 . . . . 87 ASN N . 10109 1 962 . 1 1 87 87 ASN ND2 N 15 111.589 0.300 . 1 . . . . 87 ASN ND2 . 10109 1 963 . 1 1 88 88 GLN H H 1 8.027 0.030 . 1 . . . . 88 GLN H . 10109 1 964 . 1 1 88 88 GLN HA H 1 3.919 0.030 . 1 . . . . 88 GLN HA . 10109 1 965 . 1 1 88 88 GLN HB2 H 1 2.248 0.030 . 2 . . . . 88 GLN HB2 . 10109 1 966 . 1 1 88 88 GLN HB3 H 1 2.166 0.030 . 2 . . . . 88 GLN HB3 . 10109 1 967 . 1 1 88 88 GLN HG2 H 1 2.471 0.030 . 1 . . . . 88 GLN HG2 . 10109 1 968 . 1 1 88 88 GLN HG3 H 1 2.471 0.030 . 1 . . . . 88 GLN HG3 . 10109 1 969 . 1 1 88 88 GLN HE21 H 1 7.759 0.030 . 2 . . . . 88 GLN HE21 . 10109 1 970 . 1 1 88 88 GLN HE22 H 1 6.680 0.030 . 2 . . . . 88 GLN HE22 . 10109 1 971 . 1 1 88 88 GLN C C 13 177.746 0.300 . 1 . . . . 88 GLN C . 10109 1 972 . 1 1 88 88 GLN CA C 13 58.783 0.300 . 1 . . . . 88 GLN CA . 10109 1 973 . 1 1 88 88 GLN CB C 13 27.893 0.300 . 1 . . . . 88 GLN CB . 10109 1 974 . 1 1 88 88 GLN CG C 13 33.500 0.300 . 1 . . . . 88 GLN CG . 10109 1 975 . 1 1 88 88 GLN N N 15 119.556 0.300 . 1 . . . . 88 GLN N . 10109 1 976 . 1 1 88 88 GLN NE2 N 15 112.041 0.300 . 1 . . . . 88 GLN NE2 . 10109 1 977 . 1 1 89 89 LEU H H 1 7.713 0.030 . 1 . . . . 89 LEU H . 10109 1 978 . 1 1 89 89 LEU HA H 1 4.176 0.030 . 1 . . . . 89 LEU HA . 10109 1 979 . 1 1 89 89 LEU HB2 H 1 2.037 0.030 . 2 . . . . 89 LEU HB2 . 10109 1 980 . 1 1 89 89 LEU HB3 H 1 1.404 0.030 . 2 . . . . 89 LEU HB3 . 10109 1 981 . 1 1 89 89 LEU HG H 1 1.855 0.030 . 1 . . . . 89 LEU HG . 10109 1 982 . 1 1 89 89 LEU HD11 H 1 0.931 0.030 . 1 . . . . 89 LEU HD1 . 10109 1 983 . 1 1 89 89 LEU HD12 H 1 0.931 0.030 . 1 . . . . 89 LEU HD1 . 10109 1 984 . 1 1 89 89 LEU HD13 H 1 0.931 0.030 . 1 . . . . 89 LEU HD1 . 10109 1 985 . 1 1 89 89 LEU HD21 H 1 0.913 0.030 . 1 . . . . 89 LEU HD2 . 10109 1 986 . 1 1 89 89 LEU HD22 H 1 0.913 0.030 . 1 . . . . 89 LEU HD2 . 10109 1 987 . 1 1 89 89 LEU HD23 H 1 0.913 0.030 . 1 . . . . 89 LEU HD2 . 10109 1 988 . 1 1 89 89 LEU C C 13 180.004 0.300 . 1 . . . . 89 LEU C . 10109 1 989 . 1 1 89 89 LEU CA C 13 57.885 0.300 . 1 . . . . 89 LEU CA . 10109 1 990 . 1 1 89 89 LEU CB C 13 42.226 0.300 . 1 . . . . 89 LEU CB . 10109 1 991 . 1 1 89 89 LEU CG C 13 27.044 0.300 . 1 . . . . 89 LEU CG . 10109 1 992 . 1 1 89 89 LEU CD1 C 13 23.616 0.300 . 2 . . . . 89 LEU CD1 . 10109 1 993 . 1 1 89 89 LEU CD2 C 13 25.776 0.300 . 2 . . . . 89 LEU CD2 . 10109 1 994 . 1 1 89 89 LEU N N 15 119.318 0.300 . 1 . . . . 89 LEU N . 10109 1 995 . 1 1 90 90 LEU H H 1 7.543 0.030 . 1 . . . . 90 LEU H . 10109 1 996 . 1 1 90 90 LEU HA H 1 4.180 0.030 . 1 . . . . 90 LEU HA . 10109 1 997 . 1 1 90 90 LEU HB2 H 1 1.886 0.030 . 1 . . . . 90 LEU HB2 . 10109 1 998 . 1 1 90 90 LEU HB3 H 1 1.886 0.030 . 1 . . . . 90 LEU HB3 . 10109 1 999 . 1 1 90 90 LEU HG H 1 1.806 0.030 . 1 . . . . 90 LEU HG . 10109 1 1000 . 1 1 90 90 LEU HD11 H 1 0.836 0.030 . 1 . . . . 90 LEU HD1 . 10109 1 1001 . 1 1 90 90 LEU HD12 H 1 0.836 0.030 . 1 . . . . 90 LEU HD1 . 10109 1 1002 . 1 1 90 90 LEU HD13 H 1 0.836 0.030 . 1 . . . . 90 LEU HD1 . 10109 1 1003 . 1 1 90 90 LEU HD21 H 1 0.731 0.030 . 1 . . . . 90 LEU HD2 . 10109 1 1004 . 1 1 90 90 LEU HD22 H 1 0.731 0.030 . 1 . . . . 90 LEU HD2 . 10109 1 1005 . 1 1 90 90 LEU HD23 H 1 0.731 0.030 . 1 . . . . 90 LEU HD2 . 10109 1 1006 . 1 1 90 90 LEU C C 13 178.681 0.300 . 1 . . . . 90 LEU C . 10109 1 1007 . 1 1 90 90 LEU CA C 13 57.252 0.300 . 1 . . . . 90 LEU CA . 10109 1 1008 . 1 1 90 90 LEU CB C 13 41.979 0.300 . 1 . . . . 90 LEU CB . 10109 1 1009 . 1 1 90 90 LEU CG C 13 27.039 0.300 . 1 . . . . 90 LEU CG . 10109 1 1010 . 1 1 90 90 LEU CD1 C 13 25.259 0.300 . 2 . . . . 90 LEU CD1 . 10109 1 1011 . 1 1 90 90 LEU CD2 C 13 24.129 0.300 . 2 . . . . 90 LEU CD2 . 10109 1 1012 . 1 1 90 90 LEU N N 15 117.291 0.300 . 1 . . . . 90 LEU N . 10109 1 1013 . 1 1 91 91 ARG H H 1 8.063 0.030 . 1 . . . . 91 ARG H . 10109 1 1014 . 1 1 91 91 ARG HA H 1 4.285 0.030 . 1 . . . . 91 ARG HA . 10109 1 1015 . 1 1 91 91 ARG HB2 H 1 1.993 0.030 . 1 . . . . 91 ARG HB2 . 10109 1 1016 . 1 1 91 91 ARG HB3 H 1 1.993 0.030 . 1 . . . . 91 ARG HB3 . 10109 1 1017 . 1 1 91 91 ARG HG2 H 1 1.858 0.030 . 2 . . . . 91 ARG HG2 . 10109 1 1018 . 1 1 91 91 ARG HG3 H 1 1.712 0.030 . 2 . . . . 91 ARG HG3 . 10109 1 1019 . 1 1 91 91 ARG HD2 H 1 3.246 0.030 . 1 . . . . 91 ARG HD2 . 10109 1 1020 . 1 1 91 91 ARG HD3 H 1 3.246 0.030 . 1 . . . . 91 ARG HD3 . 10109 1 1021 . 1 1 91 91 ARG HE H 1 7.261 0.030 . 1 . . . . 91 ARG HE . 10109 1 1022 . 1 1 91 91 ARG C C 13 178.973 0.300 . 1 . . . . 91 ARG C . 10109 1 1023 . 1 1 91 91 ARG CA C 13 58.729 0.300 . 1 . . . . 91 ARG CA . 10109 1 1024 . 1 1 91 91 ARG CB C 13 30.547 0.300 . 1 . . . . 91 ARG CB . 10109 1 1025 . 1 1 91 91 ARG CG C 13 27.434 0.300 . 1 . . . . 91 ARG CG . 10109 1 1026 . 1 1 91 91 ARG CD C 13 43.654 0.300 . 1 . . . . 91 ARG CD . 10109 1 1027 . 1 1 91 91 ARG N N 15 119.744 0.300 . 1 . . . . 91 ARG N . 10109 1 1028 . 1 1 91 91 ARG NE N 15 84.543 0.300 . 1 . . . . 91 ARG NE . 10109 1 1029 . 1 1 92 92 ASP H H 1 8.586 0.030 . 1 . . . . 92 ASP H . 10109 1 1030 . 1 1 92 92 ASP HA H 1 4.700 0.030 . 1 . . . . 92 ASP HA . 10109 1 1031 . 1 1 92 92 ASP HB2 H 1 2.887 0.030 . 2 . . . . 92 ASP HB2 . 10109 1 1032 . 1 1 92 92 ASP HB3 H 1 2.784 0.030 . 2 . . . . 92 ASP HB3 . 10109 1 1033 . 1 1 92 92 ASP CA C 13 55.579 0.300 . 1 . . . . 92 ASP CA . 10109 1 1034 . 1 1 92 92 ASP CB C 13 40.087 0.300 . 1 . . . . 92 ASP CB . 10109 1 1035 . 1 1 92 92 ASP N N 15 120.877 0.300 . 1 . . . . 92 ASP N . 10109 1 1036 . 1 1 93 93 SER H H 1 8.064 0.030 . 1 . . . . 93 SER H . 10109 1 1037 . 1 1 93 93 SER HA H 1 4.498 0.030 . 1 . . . . 93 SER HA . 10109 1 1038 . 1 1 93 93 SER HB2 H 1 3.924 0.030 . 1 . . . . 93 SER HB2 . 10109 1 1039 . 1 1 93 93 SER HB3 H 1 3.924 0.030 . 1 . . . . 93 SER HB3 . 10109 1 1040 . 1 1 93 93 SER C C 13 176.059 0.300 . 1 . . . . 93 SER C . 10109 1 1041 . 1 1 93 93 SER CA C 13 60.543 0.300 . 1 . . . . 93 SER CA . 10109 1 1042 . 1 1 93 93 SER CB C 13 63.292 0.300 . 1 . . . . 93 SER CB . 10109 1 1043 . 1 1 93 93 SER N N 15 116.215 0.300 . 1 . . . . 93 SER N . 10109 1 1044 . 1 1 94 94 SER H H 1 8.285 0.030 . 1 . . . . 94 SER H . 10109 1 1045 . 1 1 94 94 SER HA H 1 4.117 0.030 . 1 . . . . 94 SER HA . 10109 1 1046 . 1 1 94 94 SER HB2 H 1 3.920 0.030 . 1 . . . . 94 SER HB2 . 10109 1 1047 . 1 1 94 94 SER HB3 H 1 3.920 0.030 . 1 . . . . 94 SER HB3 . 10109 1 1048 . 1 1 94 94 SER C C 13 175.889 0.300 . 1 . . . . 94 SER C . 10109 1 1049 . 1 1 94 94 SER CA C 13 61.106 0.300 . 1 . . . . 94 SER CA . 10109 1 1050 . 1 1 94 94 SER CB C 13 62.920 0.300 . 1 . . . . 94 SER CB . 10109 1 1051 . 1 1 94 94 SER N N 15 116.844 0.300 . 1 . . . . 94 SER N . 10109 1 1052 . 1 1 95 95 ILE H H 1 7.615 0.030 . 1 . . . . 95 ILE H . 10109 1 1053 . 1 1 95 95 ILE HA H 1 4.073 0.030 . 1 . . . . 95 ILE HA . 10109 1 1054 . 1 1 95 95 ILE HB H 1 2.069 0.030 . 1 . . . . 95 ILE HB . 10109 1 1055 . 1 1 95 95 ILE HG12 H 1 1.609 0.030 . 2 . . . . 95 ILE HG12 . 10109 1 1056 . 1 1 95 95 ILE HG13 H 1 1.315 0.030 . 2 . . . . 95 ILE HG13 . 10109 1 1057 . 1 1 95 95 ILE HG21 H 1 1.014 0.030 . 1 . . . . 95 ILE HG2 . 10109 1 1058 . 1 1 95 95 ILE HG22 H 1 1.014 0.030 . 1 . . . . 95 ILE HG2 . 10109 1 1059 . 1 1 95 95 ILE HG23 H 1 1.014 0.030 . 1 . . . . 95 ILE HG2 . 10109 1 1060 . 1 1 95 95 ILE HD11 H 1 0.938 0.030 . 1 . . . . 95 ILE HD1 . 10109 1 1061 . 1 1 95 95 ILE HD12 H 1 0.938 0.030 . 1 . . . . 95 ILE HD1 . 10109 1 1062 . 1 1 95 95 ILE HD13 H 1 0.938 0.030 . 1 . . . . 95 ILE HD1 . 10109 1 1063 . 1 1 95 95 ILE C C 13 177.103 0.300 . 1 . . . . 95 ILE C . 10109 1 1064 . 1 1 95 95 ILE CA C 13 63.288 0.300 . 1 . . . . 95 ILE CA . 10109 1 1065 . 1 1 95 95 ILE CB C 13 38.149 0.300 . 1 . . . . 95 ILE CB . 10109 1 1066 . 1 1 95 95 ILE CG1 C 13 28.104 0.300 . 1 . . . . 95 ILE CG1 . 10109 1 1067 . 1 1 95 95 ILE CG2 C 13 17.557 0.300 . 1 . . . . 95 ILE CG2 . 10109 1 1068 . 1 1 95 95 ILE CD1 C 13 12.913 0.300 . 1 . . . . 95 ILE CD1 . 10109 1 1069 . 1 1 95 95 ILE N N 15 121.122 0.300 . 1 . . . . 95 ILE N . 10109 1 1070 . 1 1 96 96 THR H H 1 7.788 0.030 . 1 . . . . 96 THR H . 10109 1 1071 . 1 1 96 96 THR HA H 1 4.469 0.030 . 1 . . . . 96 THR HA . 10109 1 1072 . 1 1 96 96 THR HB H 1 4.447 0.030 . 1 . . . . 96 THR HB . 10109 1 1073 . 1 1 96 96 THR HG21 H 1 1.330 0.030 . 1 . . . . 96 THR HG2 . 10109 1 1074 . 1 1 96 96 THR HG22 H 1 1.330 0.030 . 1 . . . . 96 THR HG2 . 10109 1 1075 . 1 1 96 96 THR HG23 H 1 1.330 0.030 . 1 . . . . 96 THR HG2 . 10109 1 1076 . 1 1 96 96 THR C C 13 174.943 0.300 . 1 . . . . 96 THR C . 10109 1 1077 . 1 1 96 96 THR CA C 13 62.250 0.300 . 1 . . . . 96 THR CA . 10109 1 1078 . 1 1 96 96 THR CB C 13 69.606 0.300 . 1 . . . . 96 THR CB . 10109 1 1079 . 1 1 96 96 THR CG2 C 13 22.117 0.300 . 1 . . . . 96 THR CG2 . 10109 1 1080 . 1 1 96 96 THR N N 15 112.580 0.300 . 1 . . . . 96 THR N . 10109 1 1081 . 1 1 97 97 SER H H 1 8.035 0.030 . 1 . . . . 97 SER H . 10109 1 1082 . 1 1 97 97 SER HA H 1 4.186 0.030 . 1 . . . . 97 SER HA . 10109 1 1083 . 1 1 97 97 SER HB2 H 1 4.236 0.030 . 2 . . . . 97 SER HB2 . 10109 1 1084 . 1 1 97 97 SER HB3 H 1 4.124 0.030 . 2 . . . . 97 SER HB3 . 10109 1 1085 . 1 1 97 97 SER C C 13 172.757 0.300 . 1 . . . . 97 SER C . 10109 1 1086 . 1 1 97 97 SER CA C 13 61.141 0.300 . 1 . . . . 97 SER CA . 10109 1 1087 . 1 1 97 97 SER CB C 13 63.357 0.300 . 1 . . . . 97 SER CB . 10109 1 1088 . 1 1 97 97 SER N N 15 114.311 0.300 . 1 . . . . 97 SER N . 10109 1 1089 . 1 1 98 98 LYS H H 1 8.109 0.030 . 1 . . . . 98 LYS H . 10109 1 1090 . 1 1 98 98 LYS HA H 1 5.652 0.030 . 1 . . . . 98 LYS HA . 10109 1 1091 . 1 1 98 98 LYS HB2 H 1 1.723 0.030 . 1 . . . . 98 LYS HB2 . 10109 1 1092 . 1 1 98 98 LYS HB3 H 1 1.723 0.030 . 1 . . . . 98 LYS HB3 . 10109 1 1093 . 1 1 98 98 LYS HG2 H 1 1.385 0.030 . 1 . . . . 98 LYS HG2 . 10109 1 1094 . 1 1 98 98 LYS HG3 H 1 1.385 0.030 . 1 . . . . 98 LYS HG3 . 10109 1 1095 . 1 1 98 98 LYS HD2 H 1 1.586 0.030 . 1 . . . . 98 LYS HD2 . 10109 1 1096 . 1 1 98 98 LYS HD3 H 1 1.586 0.030 . 1 . . . . 98 LYS HD3 . 10109 1 1097 . 1 1 98 98 LYS HE2 H 1 2.881 0.030 . 1 . . . . 98 LYS HE2 . 10109 1 1098 . 1 1 98 98 LYS HE3 H 1 2.881 0.030 . 1 . . . . 98 LYS HE3 . 10109 1 1099 . 1 1 98 98 LYS C C 13 174.955 0.300 . 1 . . . . 98 LYS C . 10109 1 1100 . 1 1 98 98 LYS CA C 13 55.439 0.300 . 1 . . . . 98 LYS CA . 10109 1 1101 . 1 1 98 98 LYS CB C 13 36.358 0.300 . 1 . . . . 98 LYS CB . 10109 1 1102 . 1 1 98 98 LYS CG C 13 24.462 0.300 . 1 . . . . 98 LYS CG . 10109 1 1103 . 1 1 98 98 LYS CD C 13 29.447 0.300 . 1 . . . . 98 LYS CD . 10109 1 1104 . 1 1 98 98 LYS CE C 13 42.068 0.300 . 1 . . . . 98 LYS CE . 10109 1 1105 . 1 1 98 98 LYS N N 15 121.566 0.300 . 1 . . . . 98 LYS N . 10109 1 1106 . 1 1 99 99 VAL H H 1 8.704 0.030 . 1 . . . . 99 VAL H . 10109 1 1107 . 1 1 99 99 VAL HA H 1 4.889 0.030 . 1 . . . . 99 VAL HA . 10109 1 1108 . 1 1 99 99 VAL HB H 1 1.391 0.030 . 1 . . . . 99 VAL HB . 10109 1 1109 . 1 1 99 99 VAL HG11 H 1 0.007 0.030 . 1 . . . . 99 VAL HG1 . 10109 1 1110 . 1 1 99 99 VAL HG12 H 1 0.007 0.030 . 1 . . . . 99 VAL HG1 . 10109 1 1111 . 1 1 99 99 VAL HG13 H 1 0.007 0.030 . 1 . . . . 99 VAL HG1 . 10109 1 1112 . 1 1 99 99 VAL HG21 H 1 0.530 0.030 . 1 . . . . 99 VAL HG2 . 10109 1 1113 . 1 1 99 99 VAL HG22 H 1 0.530 0.030 . 1 . . . . 99 VAL HG2 . 10109 1 1114 . 1 1 99 99 VAL HG23 H 1 0.530 0.030 . 1 . . . . 99 VAL HG2 . 10109 1 1115 . 1 1 99 99 VAL C C 13 172.211 0.300 . 1 . . . . 99 VAL C . 10109 1 1116 . 1 1 99 99 VAL CA C 13 59.540 0.300 . 1 . . . . 99 VAL CA . 10109 1 1117 . 1 1 99 99 VAL CB C 13 35.306 0.300 . 1 . . . . 99 VAL CB . 10109 1 1118 . 1 1 99 99 VAL CG1 C 13 19.424 0.300 . 2 . . . . 99 VAL CG1 . 10109 1 1119 . 1 1 99 99 VAL CG2 C 13 21.293 0.300 . 2 . . . . 99 VAL CG2 . 10109 1 1120 . 1 1 99 99 VAL N N 15 120.376 0.300 . 1 . . . . 99 VAL N . 10109 1 1121 . 1 1 100 100 THR H H 1 8.207 0.030 . 1 . . . . 100 THR H . 10109 1 1122 . 1 1 100 100 THR HA H 1 4.950 0.030 . 1 . . . . 100 THR HA . 10109 1 1123 . 1 1 100 100 THR HB H 1 3.976 0.030 . 1 . . . . 100 THR HB . 10109 1 1124 . 1 1 100 100 THR HG21 H 1 1.038 0.030 . 1 . . . . 100 THR HG2 . 10109 1 1125 . 1 1 100 100 THR HG22 H 1 1.038 0.030 . 1 . . . . 100 THR HG2 . 10109 1 1126 . 1 1 100 100 THR HG23 H 1 1.038 0.030 . 1 . . . . 100 THR HG2 . 10109 1 1127 . 1 1 100 100 THR C C 13 174.409 0.300 . 1 . . . . 100 THR C . 10109 1 1128 . 1 1 100 100 THR CA C 13 61.383 0.300 . 1 . . . . 100 THR CA . 10109 1 1129 . 1 1 100 100 THR CB C 13 69.638 0.300 . 1 . . . . 100 THR CB . 10109 1 1130 . 1 1 100 100 THR CG2 C 13 21.473 0.300 . 1 . . . . 100 THR CG2 . 10109 1 1131 . 1 1 100 100 THR N N 15 120.779 0.300 . 1 . . . . 100 THR N . 10109 1 1132 . 1 1 101 101 LEU H H 1 9.619 0.030 . 1 . . . . 101 LEU H . 10109 1 1133 . 1 1 101 101 LEU HA H 1 5.067 0.030 . 1 . . . . 101 LEU HA . 10109 1 1134 . 1 1 101 101 LEU HB2 H 1 1.804 0.030 . 2 . . . . 101 LEU HB2 . 10109 1 1135 . 1 1 101 101 LEU HB3 H 1 1.252 0.030 . 2 . . . . 101 LEU HB3 . 10109 1 1136 . 1 1 101 101 LEU HG H 1 1.498 0.030 . 1 . . . . 101 LEU HG . 10109 1 1137 . 1 1 101 101 LEU HD11 H 1 0.730 0.030 . 1 . . . . 101 LEU HD1 . 10109 1 1138 . 1 1 101 101 LEU HD12 H 1 0.730 0.030 . 1 . . . . 101 LEU HD1 . 10109 1 1139 . 1 1 101 101 LEU HD13 H 1 0.730 0.030 . 1 . . . . 101 LEU HD1 . 10109 1 1140 . 1 1 101 101 LEU HD21 H 1 0.645 0.030 . 1 . . . . 101 LEU HD2 . 10109 1 1141 . 1 1 101 101 LEU HD22 H 1 0.645 0.030 . 1 . . . . 101 LEU HD2 . 10109 1 1142 . 1 1 101 101 LEU HD23 H 1 0.645 0.030 . 1 . . . . 101 LEU HD2 . 10109 1 1143 . 1 1 101 101 LEU C C 13 175.125 0.300 . 1 . . . . 101 LEU C . 10109 1 1144 . 1 1 101 101 LEU CA C 13 53.072 0.300 . 1 . . . . 101 LEU CA . 10109 1 1145 . 1 1 101 101 LEU CB C 13 44.866 0.300 . 1 . . . . 101 LEU CB . 10109 1 1146 . 1 1 101 101 LEU CG C 13 26.748 0.300 . 1 . . . . 101 LEU CG . 10109 1 1147 . 1 1 101 101 LEU CD1 C 13 25.030 0.300 . 2 . . . . 101 LEU CD1 . 10109 1 1148 . 1 1 101 101 LEU CD2 C 13 26.214 0.300 . 2 . . . . 101 LEU CD2 . 10109 1 1149 . 1 1 101 101 LEU N N 15 128.350 0.300 . 1 . . . . 101 LEU N . 10109 1 1150 . 1 1 102 102 GLU H H 1 8.305 0.030 . 1 . . . . 102 GLU H . 10109 1 1151 . 1 1 102 102 GLU HA H 1 5.088 0.030 . 1 . . . . 102 GLU HA . 10109 1 1152 . 1 1 102 102 GLU HB2 H 1 2.053 0.030 . 2 . . . . 102 GLU HB2 . 10109 1 1153 . 1 1 102 102 GLU HB3 H 1 1.885 0.030 . 2 . . . . 102 GLU HB3 . 10109 1 1154 . 1 1 102 102 GLU HG2 H 1 2.218 0.030 . 2 . . . . 102 GLU HG2 . 10109 1 1155 . 1 1 102 102 GLU HG3 H 1 2.050 0.030 . 2 . . . . 102 GLU HG3 . 10109 1 1156 . 1 1 102 102 GLU C C 13 175.440 0.300 . 1 . . . . 102 GLU C . 10109 1 1157 . 1 1 102 102 GLU CA C 13 55.422 0.300 . 1 . . . . 102 GLU CA . 10109 1 1158 . 1 1 102 102 GLU CB C 13 30.762 0.300 . 1 . . . . 102 GLU CB . 10109 1 1159 . 1 1 102 102 GLU CG C 13 35.518 0.300 . 1 . . . . 102 GLU CG . 10109 1 1160 . 1 1 102 102 GLU N N 15 123.636 0.300 . 1 . . . . 102 GLU N . 10109 1 1161 . 1 1 103 103 ILE H H 1 9.038 0.030 . 1 . . . . 103 ILE H . 10109 1 1162 . 1 1 103 103 ILE HA H 1 5.430 0.030 . 1 . . . . 103 ILE HA . 10109 1 1163 . 1 1 103 103 ILE HB H 1 1.921 0.030 . 1 . . . . 103 ILE HB . 10109 1 1164 . 1 1 103 103 ILE HG12 H 1 1.357 0.030 . 2 . . . . 103 ILE HG12 . 10109 1 1165 . 1 1 103 103 ILE HG13 H 1 1.208 0.030 . 2 . . . . 103 ILE HG13 . 10109 1 1166 . 1 1 103 103 ILE HG21 H 1 0.857 0.030 . 1 . . . . 103 ILE HG2 . 10109 1 1167 . 1 1 103 103 ILE HG22 H 1 0.857 0.030 . 1 . . . . 103 ILE HG2 . 10109 1 1168 . 1 1 103 103 ILE HG23 H 1 0.857 0.030 . 1 . . . . 103 ILE HG2 . 10109 1 1169 . 1 1 103 103 ILE HD11 H 1 0.734 0.030 . 1 . . . . 103 ILE HD1 . 10109 1 1170 . 1 1 103 103 ILE HD12 H 1 0.734 0.030 . 1 . . . . 103 ILE HD1 . 10109 1 1171 . 1 1 103 103 ILE HD13 H 1 0.734 0.030 . 1 . . . . 103 ILE HD1 . 10109 1 1172 . 1 1 103 103 ILE C C 13 174.651 0.300 . 1 . . . . 103 ILE C . 10109 1 1173 . 1 1 103 103 ILE CA C 13 57.604 0.300 . 1 . . . . 103 ILE CA . 10109 1 1174 . 1 1 103 103 ILE CB C 13 40.949 0.300 . 1 . . . . 103 ILE CB . 10109 1 1175 . 1 1 103 103 ILE CG1 C 13 26.115 0.300 . 1 . . . . 103 ILE CG1 . 10109 1 1176 . 1 1 103 103 ILE CG2 C 13 18.164 0.300 . 1 . . . . 103 ILE CG2 . 10109 1 1177 . 1 1 103 103 ILE CD1 C 13 13.356 0.300 . 1 . . . . 103 ILE CD1 . 10109 1 1178 . 1 1 103 103 ILE N N 15 124.715 0.300 . 1 . . . . 103 ILE N . 10109 1 1179 . 1 1 104 104 GLU H H 1 8.975 0.030 . 1 . . . . 104 GLU H . 10109 1 1180 . 1 1 104 104 GLU HA H 1 5.314 0.030 . 1 . . . . 104 GLU HA . 10109 1 1181 . 1 1 104 104 GLU HB2 H 1 2.065 0.030 . 2 . . . . 104 GLU HB2 . 10109 1 1182 . 1 1 104 104 GLU HB3 H 1 1.942 0.030 . 2 . . . . 104 GLU HB3 . 10109 1 1183 . 1 1 104 104 GLU HG2 H 1 2.183 0.030 . 2 . . . . 104 GLU HG2 . 10109 1 1184 . 1 1 104 104 GLU HG3 H 1 2.114 0.030 . 2 . . . . 104 GLU HG3 . 10109 1 1185 . 1 1 104 104 GLU C C 13 174.178 0.300 . 1 . . . . 104 GLU C . 10109 1 1186 . 1 1 104 104 GLU CA C 13 54.770 0.300 . 1 . . . . 104 GLU CA . 10109 1 1187 . 1 1 104 104 GLU CB C 13 34.029 0.300 . 1 . . . . 104 GLU CB . 10109 1 1188 . 1 1 104 104 GLU CG C 13 37.702 0.300 . 1 . . . . 104 GLU CG . 10109 1 1189 . 1 1 104 104 GLU N N 15 124.413 0.300 . 1 . . . . 104 GLU N . 10109 1 1190 . 1 1 105 105 PHE H H 1 8.683 0.030 . 1 . . . . 105 PHE H . 10109 1 1191 . 1 1 105 105 PHE HA H 1 5.094 0.030 . 1 . . . . 105 PHE HA . 10109 1 1192 . 1 1 105 105 PHE HB2 H 1 3.067 0.030 . 2 . . . . 105 PHE HB2 . 10109 1 1193 . 1 1 105 105 PHE HB3 H 1 2.885 0.030 . 2 . . . . 105 PHE HB3 . 10109 1 1194 . 1 1 105 105 PHE HD1 H 1 6.947 0.030 . 1 . . . . 105 PHE HD1 . 10109 1 1195 . 1 1 105 105 PHE HD2 H 1 6.947 0.030 . 1 . . . . 105 PHE HD2 . 10109 1 1196 . 1 1 105 105 PHE HE1 H 1 7.049 0.030 . 1 . . . . 105 PHE HE1 . 10109 1 1197 . 1 1 105 105 PHE HE2 H 1 7.049 0.030 . 1 . . . . 105 PHE HE2 . 10109 1 1198 . 1 1 105 105 PHE HZ H 1 7.181 0.030 . 1 . . . . 105 PHE HZ . 10109 1 1199 . 1 1 105 105 PHE C C 13 173.085 0.300 . 1 . . . . 105 PHE C . 10109 1 1200 . 1 1 105 105 PHE CA C 13 54.963 0.300 . 1 . . . . 105 PHE CA . 10109 1 1201 . 1 1 105 105 PHE CB C 13 42.350 0.300 . 1 . . . . 105 PHE CB . 10109 1 1202 . 1 1 105 105 PHE CD1 C 13 132.798 0.300 . 1 . . . . 105 PHE CD1 . 10109 1 1203 . 1 1 105 105 PHE CD2 C 13 132.798 0.300 . 1 . . . . 105 PHE CD2 . 10109 1 1204 . 1 1 105 105 PHE CE1 C 13 130.650 0.300 . 1 . . . . 105 PHE CE1 . 10109 1 1205 . 1 1 105 105 PHE CE2 C 13 130.650 0.300 . 1 . . . . 105 PHE CE2 . 10109 1 1206 . 1 1 105 105 PHE N N 15 122.486 0.300 . 1 . . . . 105 PHE N . 10109 1 1207 . 1 1 106 106 ASP H H 1 8.615 0.030 . 1 . . . . 106 ASP H . 10109 1 1208 . 1 1 106 106 ASP HA H 1 4.900 0.030 . 1 . . . . 106 ASP HA . 10109 1 1209 . 1 1 106 106 ASP HB2 H 1 2.579 0.030 . 2 . . . . 106 ASP HB2 . 10109 1 1210 . 1 1 106 106 ASP HB3 H 1 2.467 0.030 . 2 . . . . 106 ASP HB3 . 10109 1 1211 . 1 1 106 106 ASP C C 13 176.217 0.300 . 1 . . . . 106 ASP C . 10109 1 1212 . 1 1 106 106 ASP CA C 13 53.838 0.300 . 1 . . . . 106 ASP CA . 10109 1 1213 . 1 1 106 106 ASP CB C 13 41.837 0.300 . 1 . . . . 106 ASP CB . 10109 1 1214 . 1 1 106 106 ASP N N 15 120.392 0.300 . 1 . . . . 106 ASP N . 10109 1 1215 . 1 1 107 107 VAL H H 1 8.611 0.030 . 1 . . . . 107 VAL H . 10109 1 1216 . 1 1 107 107 VAL HA H 1 4.140 0.030 . 1 . . . . 107 VAL HA . 10109 1 1217 . 1 1 107 107 VAL HB H 1 1.488 0.030 . 1 . . . . 107 VAL HB . 10109 1 1218 . 1 1 107 107 VAL HG11 H 1 0.885 0.030 . 1 . . . . 107 VAL HG1 . 10109 1 1219 . 1 1 107 107 VAL HG12 H 1 0.885 0.030 . 1 . . . . 107 VAL HG1 . 10109 1 1220 . 1 1 107 107 VAL HG13 H 1 0.885 0.030 . 1 . . . . 107 VAL HG1 . 10109 1 1221 . 1 1 107 107 VAL HG21 H 1 0.771 0.030 . 1 . . . . 107 VAL HG2 . 10109 1 1222 . 1 1 107 107 VAL HG22 H 1 0.771 0.030 . 1 . . . . 107 VAL HG2 . 10109 1 1223 . 1 1 107 107 VAL HG23 H 1 0.771 0.030 . 1 . . . . 107 VAL HG2 . 10109 1 1224 . 1 1 107 107 VAL C C 13 174.741 0.300 . 1 . . . . 107 VAL C . 10109 1 1225 . 1 1 107 107 VAL CA C 13 61.809 0.300 . 1 . . . . 107 VAL CA . 10109 1 1226 . 1 1 107 107 VAL CB C 13 33.550 0.300 . 1 . . . . 107 VAL CB . 10109 1 1227 . 1 1 107 107 VAL CG1 C 13 21.325 0.300 . 2 . . . . 107 VAL CG1 . 10109 1 1228 . 1 1 107 107 VAL CG2 C 13 21.226 0.300 . 2 . . . . 107 VAL CG2 . 10109 1 1229 . 1 1 107 107 VAL N N 15 122.466 0.300 . 1 . . . . 107 VAL N . 10109 1 1230 . 1 1 108 108 ALA H H 1 8.519 0.030 . 1 . . . . 108 ALA H . 10109 1 1231 . 1 1 108 108 ALA HA H 1 4.623 0.030 . 1 . . . . 108 ALA HA . 10109 1 1232 . 1 1 108 108 ALA HB1 H 1 1.376 0.030 . 1 . . . . 108 ALA HB . 10109 1 1233 . 1 1 108 108 ALA HB2 H 1 1.376 0.030 . 1 . . . . 108 ALA HB . 10109 1 1234 . 1 1 108 108 ALA HB3 H 1 1.376 0.030 . 1 . . . . 108 ALA HB . 10109 1 1235 . 1 1 108 108 ALA C C 13 177.552 0.300 . 1 . . . . 108 ALA C . 10109 1 1236 . 1 1 108 108 ALA CA C 13 51.836 0.300 . 1 . . . . 108 ALA CA . 10109 1 1237 . 1 1 108 108 ALA CB C 13 19.803 0.300 . 1 . . . . 108 ALA CB . 10109 1 1238 . 1 1 108 108 ALA N N 15 129.026 0.300 . 1 . . . . 108 ALA N . 10109 1 1239 . 1 1 109 109 GLU H H 1 8.474 0.030 . 1 . . . . 109 GLU H . 10109 1 1240 . 1 1 109 109 GLU HA H 1 4.397 0.030 . 1 . . . . 109 GLU HA . 10109 1 1241 . 1 1 109 109 GLU HB2 H 1 2.082 0.030 . 2 . . . . 109 GLU HB2 . 10109 1 1242 . 1 1 109 109 GLU HB3 H 1 1.944 0.030 . 2 . . . . 109 GLU HB3 . 10109 1 1243 . 1 1 109 109 GLU HG2 H 1 2.305 0.030 . 1 . . . . 109 GLU HG2 . 10109 1 1244 . 1 1 109 109 GLU HG3 H 1 2.305 0.030 . 1 . . . . 109 GLU HG3 . 10109 1 1245 . 1 1 109 109 GLU C C 13 176.217 0.300 . 1 . . . . 109 GLU C . 10109 1 1246 . 1 1 109 109 GLU CA C 13 56.143 0.300 . 1 . . . . 109 GLU CA . 10109 1 1247 . 1 1 109 109 GLU CB C 13 31.068 0.300 . 1 . . . . 109 GLU CB . 10109 1 1248 . 1 1 109 109 GLU CG C 13 36.054 0.300 . 1 . . . . 109 GLU CG . 10109 1 1249 . 1 1 109 109 GLU N N 15 121.214 0.300 . 1 . . . . 109 GLU N . 10109 1 1250 . 1 1 110 110 SER H H 1 8.472 0.030 . 1 . . . . 110 SER H . 10109 1 1251 . 1 1 110 110 SER HA H 1 4.517 0.030 . 1 . . . . 110 SER HA . 10109 1 1252 . 1 1 110 110 SER HB2 H 1 3.868 0.030 . 1 . . . . 110 SER HB2 . 10109 1 1253 . 1 1 110 110 SER HB3 H 1 3.868 0.030 . 1 . . . . 110 SER HB3 . 10109 1 1254 . 1 1 110 110 SER C C 13 174.323 0.300 . 1 . . . . 110 SER C . 10109 1 1255 . 1 1 110 110 SER CA C 13 58.491 0.300 . 1 . . . . 110 SER CA . 10109 1 1256 . 1 1 110 110 SER CB C 13 63.791 0.300 . 1 . . . . 110 SER CB . 10109 1 1257 . 1 1 110 110 SER N N 15 117.514 0.300 . 1 . . . . 110 SER N . 10109 1 1258 . 1 1 111 111 VAL H H 1 8.228 0.030 . 1 . . . . 111 VAL H . 10109 1 1259 . 1 1 111 111 VAL HA H 1 4.156 0.030 . 1 . . . . 111 VAL HA . 10109 1 1260 . 1 1 111 111 VAL HB H 1 2.058 0.030 . 1 . . . . 111 VAL HB . 10109 1 1261 . 1 1 111 111 VAL HG11 H 1 0.940 0.030 . 1 . . . . 111 VAL HG1 . 10109 1 1262 . 1 1 111 111 VAL HG12 H 1 0.940 0.030 . 1 . . . . 111 VAL HG1 . 10109 1 1263 . 1 1 111 111 VAL HG13 H 1 0.940 0.030 . 1 . . . . 111 VAL HG1 . 10109 1 1264 . 1 1 111 111 VAL HG21 H 1 0.933 0.030 . 1 . . . . 111 VAL HG2 . 10109 1 1265 . 1 1 111 111 VAL HG22 H 1 0.933 0.030 . 1 . . . . 111 VAL HG2 . 10109 1 1266 . 1 1 111 111 VAL HG23 H 1 0.933 0.030 . 1 . . . . 111 VAL HG2 . 10109 1 1267 . 1 1 111 111 VAL C C 13 175.914 0.300 . 1 . . . . 111 VAL C . 10109 1 1268 . 1 1 111 111 VAL CA C 13 62.250 0.300 . 1 . . . . 111 VAL CA . 10109 1 1269 . 1 1 111 111 VAL CB C 13 32.759 0.300 . 1 . . . . 111 VAL CB . 10109 1 1270 . 1 1 111 111 VAL CG1 C 13 20.637 0.300 . 2 . . . . 111 VAL CG1 . 10109 1 1271 . 1 1 111 111 VAL CG2 C 13 20.897 0.300 . 2 . . . . 111 VAL CG2 . 10109 1 1272 . 1 1 111 111 VAL N N 15 122.497 0.300 . 1 . . . . 111 VAL N . 10109 1 1273 . 1 1 112 112 ILE H H 1 8.335 0.030 . 1 . . . . 112 ILE H . 10109 1 1274 . 1 1 112 112 ILE HA H 1 4.488 0.030 . 1 . . . . 112 ILE HA . 10109 1 1275 . 1 1 112 112 ILE HB H 1 1.883 0.030 . 1 . . . . 112 ILE HB . 10109 1 1276 . 1 1 112 112 ILE HG12 H 1 1.534 0.030 . 2 . . . . 112 ILE HG12 . 10109 1 1277 . 1 1 112 112 ILE HG13 H 1 1.205 0.030 . 2 . . . . 112 ILE HG13 . 10109 1 1278 . 1 1 112 112 ILE HG21 H 1 0.964 0.030 . 1 . . . . 112 ILE HG2 . 10109 1 1279 . 1 1 112 112 ILE HG22 H 1 0.964 0.030 . 1 . . . . 112 ILE HG2 . 10109 1 1280 . 1 1 112 112 ILE HG23 H 1 0.964 0.030 . 1 . . . . 112 ILE HG2 . 10109 1 1281 . 1 1 112 112 ILE HD11 H 1 0.871 0.030 . 1 . . . . 112 ILE HD1 . 10109 1 1282 . 1 1 112 112 ILE HD12 H 1 0.871 0.030 . 1 . . . . 112 ILE HD1 . 10109 1 1283 . 1 1 112 112 ILE HD13 H 1 0.871 0.030 . 1 . . . . 112 ILE HD1 . 10109 1 1284 . 1 1 112 112 ILE CA C 13 58.495 0.300 . 1 . . . . 112 ILE CA . 10109 1 1285 . 1 1 112 112 ILE CB C 13 38.504 0.300 . 1 . . . . 112 ILE CB . 10109 1 1286 . 1 1 112 112 ILE CG1 C 13 27.090 0.300 . 1 . . . . 112 ILE CG1 . 10109 1 1287 . 1 1 112 112 ILE CG2 C 13 17.027 0.300 . 1 . . . . 112 ILE CG2 . 10109 1 1288 . 1 1 112 112 ILE CD1 C 13 12.627 0.300 . 1 . . . . 112 ILE CD1 . 10109 1 1289 . 1 1 112 112 ILE N N 15 126.971 0.300 . 1 . . . . 112 ILE N . 10109 1 1290 . 1 1 113 113 PRO HA H 1 4.462 0.030 . 1 . . . . 113 PRO HA . 10109 1 1291 . 1 1 113 113 PRO HB2 H 1 2.336 0.030 . 2 . . . . 113 PRO HB2 . 10109 1 1292 . 1 1 113 113 PRO HB3 H 1 1.971 0.030 . 2 . . . . 113 PRO HB3 . 10109 1 1293 . 1 1 113 113 PRO HG2 H 1 2.067 0.030 . 2 . . . . 113 PRO HG2 . 10109 1 1294 . 1 1 113 113 PRO HG3 H 1 2.003 0.030 . 2 . . . . 113 PRO HG3 . 10109 1 1295 . 1 1 113 113 PRO HD2 H 1 3.948 0.030 . 2 . . . . 113 PRO HD2 . 10109 1 1296 . 1 1 113 113 PRO HD3 H 1 3.731 0.030 . 2 . . . . 113 PRO HD3 . 10109 1 1297 . 1 1 113 113 PRO C C 13 177.443 0.300 . 1 . . . . 113 PRO C . 10109 1 1298 . 1 1 113 113 PRO CA C 13 63.268 0.300 . 1 . . . . 113 PRO CA . 10109 1 1299 . 1 1 113 113 PRO CB C 13 32.233 0.300 . 1 . . . . 113 PRO CB . 10109 1 1300 . 1 1 113 113 PRO CG C 13 27.235 0.300 . 1 . . . . 113 PRO CG . 10109 1 1301 . 1 1 113 113 PRO CD C 13 51.182 0.300 . 1 . . . . 113 PRO CD . 10109 1 1302 . 1 1 114 114 SER H H 1 8.534 0.030 . 1 . . . . 114 SER H . 10109 1 1303 . 1 1 114 114 SER HA H 1 4.524 0.030 . 1 . . . . 114 SER HA . 10109 1 1304 . 1 1 114 114 SER HB2 H 1 3.951 0.030 . 1 . . . . 114 SER HB2 . 10109 1 1305 . 1 1 114 114 SER HB3 H 1 3.951 0.030 . 1 . . . . 114 SER HB3 . 10109 1 1306 . 1 1 114 114 SER C C 13 174.700 0.300 . 1 . . . . 114 SER C . 10109 1 1307 . 1 1 114 114 SER CA C 13 58.360 0.300 . 1 . . . . 114 SER CA . 10109 1 1308 . 1 1 114 114 SER CB C 13 64.075 0.300 . 1 . . . . 114 SER CB . 10109 1 1309 . 1 1 114 114 SER N N 15 116.429 0.300 . 1 . . . . 114 SER N . 10109 1 1310 . 1 1 115 115 SER H H 1 8.330 0.030 . 1 . . . . 115 SER H . 10109 1 1311 . 1 1 115 115 SER HA H 1 4.524 0.030 . 1 . . . . 115 SER HA . 10109 1 1312 . 1 1 115 115 SER HB2 H 1 3.905 0.030 . 1 . . . . 115 SER HB2 . 10109 1 1313 . 1 1 115 115 SER HB3 H 1 3.905 0.030 . 1 . . . . 115 SER HB3 . 10109 1 1314 . 1 1 115 115 SER C C 13 173.971 0.300 . 1 . . . . 115 SER C . 10109 1 1315 . 1 1 115 115 SER CA C 13 58.395 0.300 . 1 . . . . 115 SER CA . 10109 1 1316 . 1 1 115 115 SER CB C 13 64.157 0.300 . 1 . . . . 115 SER CB . 10109 1 1317 . 1 1 115 115 SER N N 15 117.860 0.300 . 1 . . . . 115 SER N . 10109 1 1318 . 1 1 116 116 GLY H H 1 8.060 0.030 . 1 . . . . 116 GLY H . 10109 1 1319 . 1 1 116 116 GLY HA2 H 1 3.822 0.030 . 2 . . . . 116 GLY HA2 . 10109 1 1320 . 1 1 116 116 GLY HA3 H 1 3.785 0.030 . 2 . . . . 116 GLY HA3 . 10109 1 1321 . 1 1 116 116 GLY C C 13 178.997 0.300 . 1 . . . . 116 GLY C . 10109 1 1322 . 1 1 116 116 GLY CA C 13 46.217 0.300 . 1 . . . . 116 GLY CA . 10109 1 1323 . 1 1 116 116 GLY N N 15 116.899 0.300 . 1 . . . . 116 GLY N . 10109 1 stop_ save_