data_6964 save_study_list _Study_list.Sf_category study_list _Study_list.Sf_framecode study_list _Study_list.Entry_ID 6964 _Study_list.ID 1 loop_ _Study.ID _Study.Name _Study.Type _Study.Details _Study.Entry_ID _Study.Study_list_ID 1 'Structure Determination of Rpa2829: Northeast Structural Genomics Target RpR43' 'Structure analysis' . 6964 1 stop_ loop_ _Study_keyword.Study_ID _Study_keyword.Keyword _Study_keyword.Entry_ID _Study_keyword.Study_list_ID . 'NMR structure' 6964 1 stop_ save_ ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 6964 _Entry.Title ; NMR Structure of the Rpa2829 protein from Rhodopseudomonas palustris: Northeast Structural Genomics Consortium Target RpR43 ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2005-01-31 _Entry.Accession_date 2005-02-01 _Entry.Last_release_date 2006-03-29 _Entry.Original_release_date 2006-03-29 _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version . _Entry.Experimental_method NMR _Entry.Experimental_method_subtype . _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.Entry_ID 1 John Cort . R. . 6964 2 Michael Kennedy . A. . 6964 stop_ loop_ _Entry_src.ID _Entry_src.Project_name _Entry_src.Organization_full_name _Entry_src.Organization_initials _Entry_src.Entry_ID . . NESGC . 6964 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 6964 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 540 6964 '15N chemical shifts' 133 6964 '1H chemical shifts' 819 6964 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 1 . . 2006-03-29 2006-01-31 original author . 6964 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 2FVT 'BMRB Entry Tracking System' 6964 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 6964 _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 'NMR structure of the Rpa2829 protein from Rhodopseudomonas palustris' _Citation.Status published _Citation.Type 'BMRB only' _Citation.Journal_abbrev . _Citation.Journal_name_full . _Citation.Journal_volume . _Citation.Journal_issue . _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first . _Citation.Page_last . _Citation.Year . _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.Entry_ID _Citation_author.Citation_ID 1 John Cort . R. . 6964 1 2 Michael Kennedy . A. . 6964 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 6964 _Assembly.ID 1 _Assembly.Name Rpa2829 _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands 0 _Assembly.Metal_ions 0 _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states no _Assembly.Ambiguous_chem_comp_sites no _Assembly.Molecules_in_chemical_exchange no _Assembly.Paramagnetic no _Assembly.Thiol_state 'not present' _Assembly.Molecular_mass 16000 _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 Rpa2829 1 $Rpa2829 . . yes native no no . . . 6964 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_Rpa2829 _Entity.Sf_category entity _Entity.Sf_framecode Rpa2829 _Entity.Entry_ID 6964 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name Rpa2829 _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 ; MAQRSEIPHFPRTAAIDAYG KGGFYFAGMSHQGSLLFLPD AVWGWDVTKPEQIDRYSLQR VFDNANAIDTLIVGTGADVW IAPRQLREALRGVNVVLDTM QTGPAIRTYNIMIGERRRVA AALIAVPLEHHHHHH ; _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 135 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method . _Entity.Parent_entity_ID 1 _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 2015-01-28 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 2FVT . "Nmr Structure Of The Rpa2829 Protein From Rhodopseudomonas Palustris: Northeast Structural Genomics Target Rpr43" . . . . . 100.00 135 100.00 100.00 1.04e-93 . . . . 6964 1 2 no EMBL CAE28271 . "conserved hypothetical protein [Rhodopseudomonas palustris CGA009]" . . . . . 94.07 127 99.21 99.21 1.28e-85 . . . . 6964 1 3 no GB ACF01674 . "protein of unknown function DUF498 [Rhodopseudomonas palustris TIE-1]" . . . . . 94.07 127 99.21 99.21 1.28e-85 . . . . 6964 1 4 no REF NP_948172 . "hypothetical protein RPA2829 [Rhodopseudomonas palustris CGA009]" . . . . . 94.07 127 99.21 99.21 1.28e-85 . . . . 6964 1 5 no REF WP_011158380 . "membrane protein [Rhodopseudomonas palustris]" . . . . . 94.07 127 99.21 99.21 1.28e-85 . . . . 6964 1 6 no REF YP_001992149 . "hypothetical protein Rpal_3170 [Rhodopseudomonas palustris TIE-1]" . . . . . 94.07 127 99.21 99.21 1.28e-85 . . . . 6964 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 . MET . 6964 1 2 . ALA . 6964 1 3 . GLN . 6964 1 4 . ARG . 6964 1 5 . SER . 6964 1 6 . GLU . 6964 1 7 . ILE . 6964 1 8 . PRO . 6964 1 9 . HIS . 6964 1 10 . PHE . 6964 1 11 . PRO . 6964 1 12 . ARG . 6964 1 13 . THR . 6964 1 14 . ALA . 6964 1 15 . ALA . 6964 1 16 . ILE . 6964 1 17 . ASP . 6964 1 18 . ALA . 6964 1 19 . TYR . 6964 1 20 . GLY . 6964 1 21 . LYS . 6964 1 22 . GLY . 6964 1 23 . GLY . 6964 1 24 . PHE . 6964 1 25 . TYR . 6964 1 26 . PHE . 6964 1 27 . ALA . 6964 1 28 . GLY . 6964 1 29 . MET . 6964 1 30 . SER . 6964 1 31 . HIS . 6964 1 32 . GLN . 6964 1 33 . GLY . 6964 1 34 . SER . 6964 1 35 . LEU . 6964 1 36 . LEU . 6964 1 37 . PHE . 6964 1 38 . LEU . 6964 1 39 . PRO . 6964 1 40 . ASP . 6964 1 41 . ALA . 6964 1 42 . VAL . 6964 1 43 . TRP . 6964 1 44 . GLY . 6964 1 45 . TRP . 6964 1 46 . ASP . 6964 1 47 . VAL . 6964 1 48 . THR . 6964 1 49 . LYS . 6964 1 50 . PRO . 6964 1 51 . GLU . 6964 1 52 . GLN . 6964 1 53 . ILE . 6964 1 54 . ASP . 6964 1 55 . ARG . 6964 1 56 . TYR . 6964 1 57 . SER . 6964 1 58 . LEU . 6964 1 59 . GLN . 6964 1 60 . ARG . 6964 1 61 . VAL . 6964 1 62 . PHE . 6964 1 63 . ASP . 6964 1 64 . ASN . 6964 1 65 . ALA . 6964 1 66 . ASN . 6964 1 67 . ALA . 6964 1 68 . ILE . 6964 1 69 . ASP . 6964 1 70 . THR . 6964 1 71 . LEU . 6964 1 72 . ILE . 6964 1 73 . VAL . 6964 1 74 . GLY . 6964 1 75 . THR . 6964 1 76 . GLY . 6964 1 77 . ALA . 6964 1 78 . ASP . 6964 1 79 . VAL . 6964 1 80 . TRP . 6964 1 81 . ILE . 6964 1 82 . ALA . 6964 1 83 . PRO . 6964 1 84 . ARG . 6964 1 85 . GLN . 6964 1 86 . LEU . 6964 1 87 . ARG . 6964 1 88 . GLU . 6964 1 89 . ALA . 6964 1 90 . LEU . 6964 1 91 . ARG . 6964 1 92 . GLY . 6964 1 93 . VAL . 6964 1 94 . ASN . 6964 1 95 . VAL . 6964 1 96 . VAL . 6964 1 97 . LEU . 6964 1 98 . ASP . 6964 1 99 . THR . 6964 1 100 . MET . 6964 1 101 . GLN . 6964 1 102 . THR . 6964 1 103 . GLY . 6964 1 104 . PRO . 6964 1 105 . ALA . 6964 1 106 . ILE . 6964 1 107 . ARG . 6964 1 108 . THR . 6964 1 109 . TYR . 6964 1 110 . ASN . 6964 1 111 . ILE . 6964 1 112 . MET . 6964 1 113 . ILE . 6964 1 114 . GLY . 6964 1 115 . GLU . 6964 1 116 . ARG . 6964 1 117 . ARG . 6964 1 118 . ARG . 6964 1 119 . VAL . 6964 1 120 . ALA . 6964 1 121 . ALA . 6964 1 122 . ALA . 6964 1 123 . LEU . 6964 1 124 . ILE . 6964 1 125 . ALA . 6964 1 126 . VAL . 6964 1 127 . PRO . 6964 1 128 . LEU . 6964 1 129 . GLU . 6964 1 130 . HIS . 6964 1 131 . HIS . 6964 1 132 . HIS . 6964 1 133 . HIS . 6964 1 134 . HIS . 6964 1 135 . HIS . 6964 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 . MET 1 1 6964 1 . ALA 2 2 6964 1 . GLN 3 3 6964 1 . ARG 4 4 6964 1 . SER 5 5 6964 1 . GLU 6 6 6964 1 . ILE 7 7 6964 1 . PRO 8 8 6964 1 . HIS 9 9 6964 1 . PHE 10 10 6964 1 . PRO 11 11 6964 1 . ARG 12 12 6964 1 . THR 13 13 6964 1 . ALA 14 14 6964 1 . ALA 15 15 6964 1 . ILE 16 16 6964 1 . ASP 17 17 6964 1 . ALA 18 18 6964 1 . TYR 19 19 6964 1 . GLY 20 20 6964 1 . LYS 21 21 6964 1 . GLY 22 22 6964 1 . GLY 23 23 6964 1 . PHE 24 24 6964 1 . TYR 25 25 6964 1 . PHE 26 26 6964 1 . ALA 27 27 6964 1 . GLY 28 28 6964 1 . MET 29 29 6964 1 . SER 30 30 6964 1 . HIS 31 31 6964 1 . GLN 32 32 6964 1 . GLY 33 33 6964 1 . SER 34 34 6964 1 . LEU 35 35 6964 1 . LEU 36 36 6964 1 . PHE 37 37 6964 1 . LEU 38 38 6964 1 . PRO 39 39 6964 1 . ASP 40 40 6964 1 . ALA 41 41 6964 1 . VAL 42 42 6964 1 . TRP 43 43 6964 1 . GLY 44 44 6964 1 . TRP 45 45 6964 1 . ASP 46 46 6964 1 . VAL 47 47 6964 1 . THR 48 48 6964 1 . LYS 49 49 6964 1 . PRO 50 50 6964 1 . GLU 51 51 6964 1 . GLN 52 52 6964 1 . ILE 53 53 6964 1 . ASP 54 54 6964 1 . ARG 55 55 6964 1 . TYR 56 56 6964 1 . SER 57 57 6964 1 . LEU 58 58 6964 1 . GLN 59 59 6964 1 . ARG 60 60 6964 1 . VAL 61 61 6964 1 . PHE 62 62 6964 1 . ASP 63 63 6964 1 . ASN 64 64 6964 1 . ALA 65 65 6964 1 . ASN 66 66 6964 1 . ALA 67 67 6964 1 . ILE 68 68 6964 1 . ASP 69 69 6964 1 . THR 70 70 6964 1 . LEU 71 71 6964 1 . ILE 72 72 6964 1 . VAL 73 73 6964 1 . GLY 74 74 6964 1 . THR 75 75 6964 1 . GLY 76 76 6964 1 . ALA 77 77 6964 1 . ASP 78 78 6964 1 . VAL 79 79 6964 1 . TRP 80 80 6964 1 . ILE 81 81 6964 1 . ALA 82 82 6964 1 . PRO 83 83 6964 1 . ARG 84 84 6964 1 . GLN 85 85 6964 1 . LEU 86 86 6964 1 . ARG 87 87 6964 1 . GLU 88 88 6964 1 . ALA 89 89 6964 1 . LEU 90 90 6964 1 . ARG 91 91 6964 1 . GLY 92 92 6964 1 . VAL 93 93 6964 1 . ASN 94 94 6964 1 . VAL 95 95 6964 1 . VAL 96 96 6964 1 . LEU 97 97 6964 1 . ASP 98 98 6964 1 . THR 99 99 6964 1 . MET 100 100 6964 1 . GLN 101 101 6964 1 . THR 102 102 6964 1 . GLY 103 103 6964 1 . PRO 104 104 6964 1 . ALA 105 105 6964 1 . ILE 106 106 6964 1 . ARG 107 107 6964 1 . THR 108 108 6964 1 . TYR 109 109 6964 1 . ASN 110 110 6964 1 . ILE 111 111 6964 1 . MET 112 112 6964 1 . ILE 113 113 6964 1 . GLY 114 114 6964 1 . GLU 115 115 6964 1 . ARG 116 116 6964 1 . ARG 117 117 6964 1 . ARG 118 118 6964 1 . VAL 119 119 6964 1 . ALA 120 120 6964 1 . ALA 121 121 6964 1 . ALA 122 122 6964 1 . LEU 123 123 6964 1 . ILE 124 124 6964 1 . ALA 125 125 6964 1 . VAL 126 126 6964 1 . PRO 127 127 6964 1 . LEU 128 128 6964 1 . GLU 129 129 6964 1 . HIS 130 130 6964 1 . HIS 131 131 6964 1 . HIS 132 132 6964 1 . HIS 133 133 6964 1 . HIS 134 134 6964 1 . HIS 135 135 6964 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 6964 _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 $Rpa2829 . 1076 organism . 'Rhodopseudomonas palustris' 'Rhodopseudomonas palustris' . . Bacteria . Rhodopseudomonas palustris . . . . . . . . . . . . . . . . . . . . . 6964 1 stop_ loop_ _Natural_source_db.Entity_natural_src_ID _Natural_source_db.Entity_ID _Natural_source_db.Entity_label _Natural_source_db.Entity_chimera_segment_ID _Natural_source_db.Database_code _Natural_source_db.Database_type _Natural_source_db.Entry_code _Natural_source_db.Entry_type _Natural_source_db.ORF_code _Natural_source_db.Gene_locus_code _Natural_source_db.Gene_cDNA_code _Natural_source_db.Entry_ID _Natural_source_db.Entity_natural_src_list_ID . 1 $Rpa2829 . Swiss-Prot . Q6N5Y9 . . . . 6964 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 6964 _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 $Rpa2829 . 'recombinant technology' . 'E. coli' . . Escherichia coli BL21(DE3)+Magic . . . . . . . . . . . . . . . . . . . . . . 6964 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 6964 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system . _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 Rpa2829 '[U-13C; U-15N]' . . 1 $Rpa2829 . protein 1.2 . . mM 0.1 . . . 6964 1 2 'ammonium acetate' . . . . . . buffer 20 . . mM 1 . . . 6964 1 3 NaCl . . . . . . salt 100 . . mM 5 . . . 6964 1 4 CaCl2 . . . . . . salt 5 . . mM 0.25 . . . 6964 1 stop_ save_ ####################### # Sample conditions # ####################### save_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode conditions_1 _Sample_condition_list.Entry_ID 6964 _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 pH 5.0 .1 pH 6964 1 temperature 293 1 K 6964 1 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_1 _NMR_spectrometer.Entry_ID 6964 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model INOVA _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_2 _NMR_spectrometer.Entry_ID 6964 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model 'Unity Plus' _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 500 save_ save_spectrometer_3 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_3 _NMR_spectrometer.Entry_ID 6964 _NMR_spectrometer.ID 3 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model INOVA _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ save_spectrometer_4 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_4 _NMR_spectrometer.Entry_ID 6964 _NMR_spectrometer.ID 4 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model INOVA _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 750 save_ ############################# # NMR applied experiments # ############################# save_NMR_experiment_list _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode NMR_experiment_list _Experiment_list.Entry_ID 6964 _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 1H15N_HSQC no . . . . . . . . . . 1 $sample_1 . . . 1 $conditions_1 . . . . . . . . . . . . . . . . . . . . . 6964 1 2 1H13C_HSQC no . . . . . . . . . . 1 $sample_1 . . . 1 $conditions_1 . . . . . . . . . . . . . . . . . . . . . 6964 1 3 HNCACB no . . . . . . . . . . 1 $sample_1 . . . 1 $conditions_1 . . . . . . . . . . . . . . . . . . . . . 6964 1 4 CBCACONH no . . . . . . . . . . 1 $sample_1 . . . 1 $conditions_1 . . . . . . . . . . . . . . . . . . . . . 6964 1 5 HNCO no . . . . . . . . . . 1 $sample_1 . . . 1 $conditions_1 . . . . . . . . . . . . . . . . . . . . . 6964 1 6 HNCA no . . . . . . . . . . 1 $sample_1 . . . 1 $conditions_1 . . . . . . . . . . . . . . . . . . . . . 6964 1 7 HNCOCA no . . . . . . . . . . 1 $sample_1 . . . 1 $conditions_1 . . . . . . . . . . . . . . . . . . . . . 6964 1 8 HCCH_TOCSY no . . . . . . . . . . 1 $sample_1 . . . 1 $conditions_1 . . . . . . . . . . . . . . . . . . . . . 6964 1 9 HCCH_COSY no . . . . . . . . . . 1 $sample_1 . . . 1 $conditions_1 . . . . . . . . . . . . . . . . . . . . . 6964 1 10 CBCACOCAHA no . . . . . . . . . . 1 $sample_1 . . . 1 $conditions_1 . . . . . . . . . . . . . . . . . . . . . 6964 1 11 HCC_TOCSY_NH no . . . . . . . . . . 1 $sample_1 . . . 1 $conditions_1 . . . . . . . . . . . . . . . . . . . . . 6964 1 12 CC_TOCSY_NH no . . . . . . . . . . 1 $sample_1 . . . 1 $conditions_1 . . . . . . . . . . . . . . . . . . . . . 6964 1 13 HNHA no . . . . . . . . . . 1 $sample_1 . . . 1 $conditions_1 . . . . . . . . . . . . . . . . . . . . . 6964 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_referencing _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_referencing _Chem_shift_reference.Entry_ID 6964 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.0 . indirect 0.251449530 . . . 1 $entry_citation . . 1 $entry_citation 6964 1 H 1 DSS 'methyl protons' . . . . ppm 0.0 external indirect 1.0 . . . 1 $entry_citation . . 1 $entry_citation 6964 1 N 15 DSS 'methyl protons' . . . . ppm 0.0 . indirect 0.101329118 . . . 1 $entry_citation . . 1 $entry_citation 6964 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_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 6964 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_referencing _Assigned_chem_shift_list.Chem_shift_1H_err 0.02 _Assigned_chem_shift_list.Chem_shift_13C_err 0.2 _Assigned_chem_shift_list.Chem_shift_15N_err 0.2 _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 $sample_1 isotropic 6964 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 1 1 MET C C 13 172.0 0.2 . 1 . . . . 1 MET C . 6964 1 2 . 1 1 1 1 MET CA C 13 61.1 0.2 . 1 . . . . 1 MET CA . 6964 1 3 . 1 1 1 1 MET CB C 13 32.8 0.2 . 1 . . . . 1 MET CB . 6964 1 4 . 1 1 2 2 ALA H H 1 8.67 0.02 . 1 . . . . 2 ALA H . 6964 1 5 . 1 1 2 2 ALA HA H 1 4.34 0.02 . 1 . . . . 2 ALA HA . 6964 1 6 . 1 1 2 2 ALA HB1 H 1 1.35 0.02 . 1 . . . . 2 ALA HB . 6964 1 7 . 1 1 2 2 ALA HB2 H 1 1.35 0.02 . 1 . . . . 2 ALA HB . 6964 1 8 . 1 1 2 2 ALA HB3 H 1 1.35 0.02 . 1 . . . . 2 ALA HB . 6964 1 9 . 1 1 2 2 ALA C C 13 177.3 0.2 . 1 . . . . 2 ALA C . 6964 1 10 . 1 1 2 2 ALA CA C 13 52.4 0.2 . 1 . . . . 2 ALA CA . 6964 1 11 . 1 1 2 2 ALA CB C 13 19.2 0.2 . 1 . . . . 2 ALA CB . 6964 1 12 . 1 1 2 2 ALA N N 15 128.3 0.2 . 1 . . . . 2 ALA N . 6964 1 13 . 1 1 3 3 GLN H H 1 8.52 0.02 . 1 . . . . 3 GLN H . 6964 1 14 . 1 1 3 3 GLN HA H 1 4.29 0.02 . 1 . . . . 3 GLN HA . 6964 1 15 . 1 1 3 3 GLN HB2 H 1 1.94 0.02 . 2 . . . . 3 GLN HB2 . 6964 1 16 . 1 1 3 3 GLN HB3 H 1 2.05 0.02 . 2 . . . . 3 GLN HB3 . 6964 1 17 . 1 1 3 3 GLN HG2 H 1 2.33 0.02 . 2 . . . . 3 GLN HG2 . 6964 1 18 . 1 1 3 3 GLN HG3 H 1 2.35 0.02 . 2 . . . . 3 GLN HG3 . 6964 1 19 . 1 1 3 3 GLN HE21 H 1 6.87 0.02 . 2 . . . . 3 GLN HE21 . 6964 1 20 . 1 1 3 3 GLN HE22 H 1 7.53 0.02 . 2 . . . . 3 GLN HE22 . 6964 1 21 . 1 1 3 3 GLN CA C 13 55.8 0.2 . 1 . . . . 3 GLN CA . 6964 1 22 . 1 1 3 3 GLN CB C 13 29.7 0.2 . 1 . . . . 3 GLN CB . 6964 1 23 . 1 1 3 3 GLN CG C 13 33.5 0.2 . 1 . . . . 3 GLN CG . 6964 1 24 . 1 1 3 3 GLN N N 15 121.0 0.2 . 1 . . . . 3 GLN N . 6964 1 25 . 1 1 3 3 GLN NE2 N 15 112.8 0.2 . 1 . . . . 3 GLN NE2 . 6964 1 26 . 1 1 4 4 ARG C C 13 176.2 0.2 . 1 . . . . 4 ARG C . 6964 1 27 . 1 1 4 4 ARG CA C 13 56.3 0.2 . 1 . . . . 4 ARG CA . 6964 1 28 . 1 1 4 4 ARG CB C 13 31.0 0.2 . 1 . . . . 4 ARG CB . 6964 1 29 . 1 1 4 4 ARG CG C 13 27.0 0.2 . 1 . . . . 4 ARG CG . 6964 1 30 . 1 1 4 4 ARG CD C 13 43.4 0.2 . 1 . . . . 4 ARG CD . 6964 1 31 . 1 1 5 5 SER H H 1 8.43 0.02 . 1 . . . . 5 SER H . 6964 1 32 . 1 1 5 5 SER HB2 H 1 3.80 0.02 . 2 . . . . 5 SER HB2 . 6964 1 33 . 1 1 5 5 SER HB3 H 1 3.83 0.02 . 2 . . . . 5 SER HB3 . 6964 1 34 . 1 1 5 5 SER C C 13 174.2 0.2 . 1 . . . . 5 SER C . 6964 1 35 . 1 1 5 5 SER CA C 13 58.4 0.2 . 1 . . . . 5 SER CA . 6964 1 36 . 1 1 5 5 SER CB C 13 63.9 0.2 . 1 . . . . 5 SER CB . 6964 1 37 . 1 1 5 5 SER N N 15 117.6 0.2 . 1 . . . . 5 SER N . 6964 1 38 . 1 1 6 6 GLU H H 1 8.47 0.02 . 1 . . . . 6 GLU H . 6964 1 39 . 1 1 6 6 GLU CA C 13 56.3 0.2 . 1 . . . . 6 GLU CA . 6964 1 40 . 1 1 6 6 GLU CB C 13 30.4 0.2 . 1 . . . . 6 GLU CB . 6964 1 41 . 1 1 6 6 GLU N N 15 123.1 0.2 . 1 . . . . 6 GLU N . 6964 1 42 . 1 1 7 7 ILE HA H 1 4.47 0.02 . 1 . . . . 7 ILE HA . 6964 1 43 . 1 1 7 7 ILE HB H 1 2.01 0.02 . 1 . . . . 7 ILE HB . 6964 1 44 . 1 1 7 7 ILE HG12 H 1 1.30 0.02 . 2 . . . . 7 ILE HG12 . 6964 1 45 . 1 1 7 7 ILE HG13 H 1 1.61 0.02 . 2 . . . . 7 ILE HG13 . 6964 1 46 . 1 1 7 7 ILE HG21 H 1 1.22 0.02 . 1 . . . . 7 ILE HG2 . 6964 1 47 . 1 1 7 7 ILE HG22 H 1 1.22 0.02 . 1 . . . . 7 ILE HG2 . 6964 1 48 . 1 1 7 7 ILE HG23 H 1 1.22 0.02 . 1 . . . . 7 ILE HG2 . 6964 1 49 . 1 1 7 7 ILE HD11 H 1 0.90 0.02 . 1 . . . . 7 ILE HD1 . 6964 1 50 . 1 1 7 7 ILE HD12 H 1 0.90 0.02 . 1 . . . . 7 ILE HD1 . 6964 1 51 . 1 1 7 7 ILE HD13 H 1 0.90 0.02 . 1 . . . . 7 ILE HD1 . 6964 1 52 . 1 1 7 7 ILE CA C 13 58.8 0.2 . 1 . . . . 7 ILE CA . 6964 1 53 . 1 1 7 7 ILE CB C 13 39.0 0.2 . 1 . . . . 7 ILE CB . 6964 1 54 . 1 1 7 7 ILE CG1 C 13 27.5 0.2 . 1 . . . . 7 ILE CG1 . 6964 1 55 . 1 1 7 7 ILE CG2 C 13 17.3 0.2 . 1 . . . . 7 ILE CG2 . 6964 1 56 . 1 1 7 7 ILE CD1 C 13 12.8 0.2 . 1 . . . . 7 ILE CD1 . 6964 1 57 . 1 1 8 8 PRO HD2 H 1 3.73 0.02 . 2 . . . . 8 PRO HD2 . 6964 1 58 . 1 1 8 8 PRO HD3 H 1 3.98 0.02 . 2 . . . . 8 PRO HD3 . 6964 1 59 . 1 1 8 8 PRO C C 13 174.9 0.2 . 1 . . . . 8 PRO C . 6964 1 60 . 1 1 8 8 PRO CA C 13 63.3 0.2 . 1 . . . . 8 PRO CA . 6964 1 61 . 1 1 8 8 PRO CB C 13 32.3 0.2 . 1 . . . . 8 PRO CB . 6964 1 62 . 1 1 8 8 PRO CG C 13 27.6 0.2 . 1 . . . . 8 PRO CG . 6964 1 63 . 1 1 8 8 PRO CD C 13 51.4 0.2 . 1 . . . . 8 PRO CD . 6964 1 64 . 1 1 9 9 HIS H H 1 7.42 0.02 . 1 . . . . 9 HIS H . 6964 1 65 . 1 1 9 9 HIS HD2 H 1 6.24 0.02 . 1 . . . . 9 HIS HD2 . 6964 1 66 . 1 1 9 9 HIS C C 13 172.3 0.2 . 1 . . . . 9 HIS C . 6964 1 67 . 1 1 9 9 HIS CA C 13 53.5 0.2 . 1 . . . . 9 HIS CA . 6964 1 68 . 1 1 9 9 HIS CB C 13 29.3 0.2 . 1 . . . . 9 HIS CB . 6964 1 69 . 1 1 9 9 HIS CD2 C 13 118.9 0.2 . 1 . . . . 9 HIS CD2 . 6964 1 70 . 1 1 9 9 HIS N N 15 116.3 0.2 . 1 . . . . 9 HIS N . 6964 1 71 . 1 1 10 10 PHE H H 1 8.99 0.02 . 1 . . . . 10 PHE H . 6964 1 72 . 1 1 10 10 PHE HA H 1 4.55 0.02 . 1 . . . . 10 PHE HA . 6964 1 73 . 1 1 10 10 PHE HB2 H 1 2.43 0.02 . 2 . . . . 10 PHE HB2 . 6964 1 74 . 1 1 10 10 PHE HB3 H 1 3.46 0.02 . 2 . . . . 10 PHE HB3 . 6964 1 75 . 1 1 10 10 PHE HD1 H 1 7.03 0.02 . 3 . . . . 10 PHE HD1 . 6964 1 76 . 1 1 10 10 PHE HE1 H 1 7.17 0.02 . 3 . . . . 10 PHE HE1 . 6964 1 77 . 1 1 10 10 PHE CA C 13 54.7 0.2 . 1 . . . . 10 PHE CA . 6964 1 78 . 1 1 10 10 PHE CB C 13 39.7 0.2 . 1 . . . . 10 PHE CB . 6964 1 79 . 1 1 10 10 PHE CD1 C 13 132.4 0.2 . 3 . . . . 10 PHE CD1 . 6964 1 80 . 1 1 10 10 PHE CE1 C 13 131.1 0.2 . 3 . . . . 10 PHE CE1 . 6964 1 81 . 1 1 10 10 PHE N N 15 122.0 0.2 . 1 . . . . 10 PHE N . 6964 1 82 . 1 1 11 11 PRO HA H 1 4.46 0.02 . 1 . . . . 11 PRO HA . 6964 1 83 . 1 1 11 11 PRO HD2 H 1 3.73 0.02 . 2 . . . . 11 PRO HD2 . 6964 1 84 . 1 1 11 11 PRO HD3 H 1 3.89 0.02 . 2 . . . . 11 PRO HD3 . 6964 1 85 . 1 1 11 11 PRO C C 13 175.0 0.2 . 1 . . . . 11 PRO C . 6964 1 86 . 1 1 11 11 PRO CA C 13 62.6 0.2 . 1 . . . . 11 PRO CA . 6964 1 87 . 1 1 11 11 PRO CB C 13 32.0 0.2 . 1 . . . . 11 PRO CB . 6964 1 88 . 1 1 11 11 PRO CG C 13 27.8 0.2 . 1 . . . . 11 PRO CG . 6964 1 89 . 1 1 11 11 PRO CD C 13 50.6 0.2 . 1 . . . . 11 PRO CD . 6964 1 90 . 1 1 12 12 ARG H H 1 8.09 0.02 . 1 . . . . 12 ARG H . 6964 1 91 . 1 1 12 12 ARG HA H 1 3.87 0.02 . 1 . . . . 12 ARG HA . 6964 1 92 . 1 1 12 12 ARG HB2 H 1 1.45 0.02 . 2 . . . . 12 ARG HB2 . 6964 1 93 . 1 1 12 12 ARG HB3 H 1 1.76 0.02 . 2 . . . . 12 ARG HB3 . 6964 1 94 . 1 1 12 12 ARG HG2 H 1 1.49 0.02 . 2 . . . . 12 ARG HG2 . 6964 1 95 . 1 1 12 12 ARG HG3 H 1 1.52 0.02 . 2 . . . . 12 ARG HG3 . 6964 1 96 . 1 1 12 12 ARG HD2 H 1 3.07 0.02 . 2 . . . . 12 ARG HD2 . 6964 1 97 . 1 1 12 12 ARG HD3 H 1 3.20 0.02 . 2 . . . . 12 ARG HD3 . 6964 1 98 . 1 1 12 12 ARG C C 13 175.3 0.2 . 1 . . . . 12 ARG C . 6964 1 99 . 1 1 12 12 ARG CA C 13 56.5 0.2 . 1 . . . . 12 ARG CA . 6964 1 100 . 1 1 12 12 ARG CB C 13 30.4 0.2 . 1 . . . . 12 ARG CB . 6964 1 101 . 1 1 12 12 ARG CG C 13 25.9 0.2 . 1 . . . . 12 ARG CG . 6964 1 102 . 1 1 12 12 ARG CD C 13 43.5 0.2 . 1 . . . . 12 ARG CD . 6964 1 103 . 1 1 12 12 ARG N N 15 118.4 0.2 . 1 . . . . 12 ARG N . 6964 1 104 . 1 1 13 13 THR H H 1 8.12 0.02 . 1 . . . . 13 THR H . 6964 1 105 . 1 1 13 13 THR HA H 1 4.81 0.02 . 1 . . . . 13 THR HA . 6964 1 106 . 1 1 13 13 THR HB H 1 3.94 0.02 . 1 . . . . 13 THR HB . 6964 1 107 . 1 1 13 13 THR HG21 H 1 0.79 0.02 . 1 . . . . 13 THR HG2 . 6964 1 108 . 1 1 13 13 THR HG22 H 1 0.79 0.02 . 1 . . . . 13 THR HG2 . 6964 1 109 . 1 1 13 13 THR HG23 H 1 0.79 0.02 . 1 . . . . 13 THR HG2 . 6964 1 110 . 1 1 13 13 THR C C 13 172.1 0.2 . 1 . . . . 13 THR C . 6964 1 111 . 1 1 13 13 THR CA C 13 59.5 0.2 . 1 . . . . 13 THR CA . 6964 1 112 . 1 1 13 13 THR CB C 13 71.0 0.2 . 1 . . . . 13 THR CB . 6964 1 113 . 1 1 13 13 THR CG2 C 13 19.4 0.2 . 1 . . . . 13 THR CG2 . 6964 1 114 . 1 1 13 13 THR N N 15 116.3 0.2 . 1 . . . . 13 THR N . 6964 1 115 . 1 1 14 14 ALA H H 1 8.75 0.02 . 1 . . . . 14 ALA H . 6964 1 116 . 1 1 14 14 ALA HA H 1 4.31 0.02 . 1 . . . . 14 ALA HA . 6964 1 117 . 1 1 14 14 ALA HB1 H 1 1.37 0.02 . 1 . . . . 14 ALA HB . 6964 1 118 . 1 1 14 14 ALA HB2 H 1 1.37 0.02 . 1 . . . . 14 ALA HB . 6964 1 119 . 1 1 14 14 ALA HB3 H 1 1.37 0.02 . 1 . . . . 14 ALA HB . 6964 1 120 . 1 1 14 14 ALA C C 13 175.1 0.2 . 1 . . . . 14 ALA C . 6964 1 121 . 1 1 14 14 ALA CA C 13 52.3 0.2 . 1 . . . . 14 ALA CA . 6964 1 122 . 1 1 14 14 ALA CB C 13 19.4 0.2 . 1 . . . . 14 ALA CB . 6964 1 123 . 1 1 14 14 ALA N N 15 130.9 0.2 . 1 . . . . 14 ALA N . 6964 1 124 . 1 1 15 15 ALA H H 1 7.63 0.02 . 1 . . . . 15 ALA H . 6964 1 125 . 1 1 15 15 ALA HA H 1 4.64 0.02 . 1 . . . . 15 ALA HA . 6964 1 126 . 1 1 15 15 ALA HB1 H 1 1.19 0.02 . 1 . . . . 15 ALA HB . 6964 1 127 . 1 1 15 15 ALA HB2 H 1 1.19 0.02 . 1 . . . . 15 ALA HB . 6964 1 128 . 1 1 15 15 ALA HB3 H 1 1.19 0.02 . 1 . . . . 15 ALA HB . 6964 1 129 . 1 1 15 15 ALA C C 13 176.6 0.2 . 1 . . . . 15 ALA C . 6964 1 130 . 1 1 15 15 ALA CA C 13 51.5 0.2 . 1 . . . . 15 ALA CA . 6964 1 131 . 1 1 15 15 ALA CB C 13 21.7 0.2 . 1 . . . . 15 ALA CB . 6964 1 132 . 1 1 15 15 ALA N N 15 116.8 0.2 . 1 . . . . 15 ALA N . 6964 1 133 . 1 1 16 16 ILE H H 1 9.72 0.02 . 1 . . . . 16 ILE H . 6964 1 134 . 1 1 16 16 ILE HA H 1 4.16 0.02 . 1 . . . . 16 ILE HA . 6964 1 135 . 1 1 16 16 ILE HB H 1 1.61 0.02 . 1 . . . . 16 ILE HB . 6964 1 136 . 1 1 16 16 ILE HG12 H 1 -0.08 0.02 . 2 . . . . 16 ILE HG12 . 6964 1 137 . 1 1 16 16 ILE HG13 H 1 0.97 0.02 . 2 . . . . 16 ILE HG13 . 6964 1 138 . 1 1 16 16 ILE HG21 H 1 0.94 0.02 . 1 . . . . 16 ILE HG2 . 6964 1 139 . 1 1 16 16 ILE HG22 H 1 0.94 0.02 . 1 . . . . 16 ILE HG2 . 6964 1 140 . 1 1 16 16 ILE HG23 H 1 0.94 0.02 . 1 . . . . 16 ILE HG2 . 6964 1 141 . 1 1 16 16 ILE HD11 H 1 -0.85 0.02 . 1 . . . . 16 ILE HD1 . 6964 1 142 . 1 1 16 16 ILE HD12 H 1 -0.85 0.02 . 1 . . . . 16 ILE HD1 . 6964 1 143 . 1 1 16 16 ILE HD13 H 1 -0.85 0.02 . 1 . . . . 16 ILE HD1 . 6964 1 144 . 1 1 16 16 ILE C C 13 175.9 0.2 . 1 . . . . 16 ILE C . 6964 1 145 . 1 1 16 16 ILE CA C 13 61.8 0.2 . 1 . . . . 16 ILE CA . 6964 1 146 . 1 1 16 16 ILE CB C 13 39.6 0.2 . 1 . . . . 16 ILE CB . 6964 1 147 . 1 1 16 16 ILE CG1 C 13 27.7 0.2 . 1 . . . . 16 ILE CG1 . 6964 1 148 . 1 1 16 16 ILE CG2 C 13 18.3 0.2 . 1 . . . . 16 ILE CG2 . 6964 1 149 . 1 1 16 16 ILE CD1 C 13 13.9 0.2 . 1 . . . . 16 ILE CD1 . 6964 1 150 . 1 1 16 16 ILE N N 15 124.2 0.2 . 1 . . . . 16 ILE N . 6964 1 151 . 1 1 17 17 ASP H H 1 8.50 0.02 . 1 . . . . 17 ASP H . 6964 1 152 . 1 1 17 17 ASP HA H 1 4.57 0.02 . 1 . . . . 17 ASP HA . 6964 1 153 . 1 1 17 17 ASP HB2 H 1 2.58 0.02 . 2 . . . . 17 ASP HB2 . 6964 1 154 . 1 1 17 17 ASP HB3 H 1 2.78 0.02 . 2 . . . . 17 ASP HB3 . 6964 1 155 . 1 1 17 17 ASP C C 13 176.2 0.2 . 1 . . . . 17 ASP C . 6964 1 156 . 1 1 17 17 ASP CA C 13 57.5 0.2 . 1 . . . . 17 ASP CA . 6964 1 157 . 1 1 17 17 ASP CB C 13 42.6 0.2 . 1 . . . . 17 ASP CB . 6964 1 158 . 1 1 17 17 ASP N N 15 127.1 0.2 . 1 . . . . 17 ASP N . 6964 1 159 . 1 1 18 18 ALA H H 1 8.29 0.02 . 1 . . . . 18 ALA H . 6964 1 160 . 1 1 18 18 ALA HA H 1 4.67 0.02 . 1 . . . . 18 ALA HA . 6964 1 161 . 1 1 18 18 ALA HB1 H 1 1.35 0.02 . 1 . . . . 18 ALA HB . 6964 1 162 . 1 1 18 18 ALA HB2 H 1 1.35 0.02 . 1 . . . . 18 ALA HB . 6964 1 163 . 1 1 18 18 ALA HB3 H 1 1.35 0.02 . 1 . . . . 18 ALA HB . 6964 1 164 . 1 1 18 18 ALA C C 13 175.3 0.2 . 1 . . . . 18 ALA C . 6964 1 165 . 1 1 18 18 ALA CA C 13 52.2 0.2 . 1 . . . . 18 ALA CA . 6964 1 166 . 1 1 18 18 ALA CB C 13 21.7 0.2 . 1 . . . . 18 ALA CB . 6964 1 167 . 1 1 18 18 ALA N N 15 117.4 0.2 . 1 . . . . 18 ALA N . 6964 1 168 . 1 1 19 19 TYR H H 1 8.40 0.02 . 1 . . . . 19 TYR H . 6964 1 169 . 1 1 19 19 TYR HA H 1 5.25 0.02 . 1 . . . . 19 TYR HA . 6964 1 170 . 1 1 19 19 TYR HB2 H 1 2.85 0.02 . 2 . . . . 19 TYR HB2 . 6964 1 171 . 1 1 19 19 TYR HB3 H 1 2.97 0.02 . 2 . . . . 19 TYR HB3 . 6964 1 172 . 1 1 19 19 TYR HD1 H 1 6.87 0.02 . 3 . . . . 19 TYR HD1 . 6964 1 173 . 1 1 19 19 TYR HE1 H 1 6.62 0.02 . 3 . . . . 19 TYR HE1 . 6964 1 174 . 1 1 19 19 TYR C C 13 174.0 0.2 . 1 . . . . 19 TYR C . 6964 1 175 . 1 1 19 19 TYR CA C 13 56.1 0.2 . 1 . . . . 19 TYR CA . 6964 1 176 . 1 1 19 19 TYR CB C 13 40.7 0.2 . 1 . . . . 19 TYR CB . 6964 1 177 . 1 1 19 19 TYR CD1 C 13 133.4 0.2 . 3 . . . . 19 TYR CD1 . 6964 1 178 . 1 1 19 19 TYR CE1 C 13 117.8 0.2 . 3 . . . . 19 TYR CE1 . 6964 1 179 . 1 1 19 19 TYR N N 15 118.0 0.2 . 1 . . . . 19 TYR N . 6964 1 180 . 1 1 20 20 GLY H H 1 7.78 0.02 . 1 . . . . 20 GLY H . 6964 1 181 . 1 1 20 20 GLY HA2 H 1 3.78 0.02 . 2 . . . . 20 GLY HA2 . 6964 1 182 . 1 1 20 20 GLY HA3 H 1 4.10 0.02 . 2 . . . . 20 GLY HA3 . 6964 1 183 . 1 1 20 20 GLY C C 13 173.6 0.2 . 1 . . . . 20 GLY C . 6964 1 184 . 1 1 20 20 GLY CA C 13 44.8 0.2 . 1 . . . . 20 GLY CA . 6964 1 185 . 1 1 20 20 GLY N N 15 109.6 0.2 . 1 . . . . 20 GLY N . 6964 1 186 . 1 1 21 21 LYS H H 1 9.07 0.02 . 1 . . . . 21 LYS H . 6964 1 187 . 1 1 21 21 LYS HA H 1 3.80 0.02 . 1 . . . . 21 LYS HA . 6964 1 188 . 1 1 21 21 LYS HB2 H 1 1.75 0.02 . 2 . . . . 21 LYS HB2 . 6964 1 189 . 1 1 21 21 LYS HB3 H 1 1.91 0.02 . 2 . . . . 21 LYS HB3 . 6964 1 190 . 1 1 21 21 LYS C C 13 176.7 0.2 . 1 . . . . 21 LYS C . 6964 1 191 . 1 1 21 21 LYS CA C 13 57.8 0.2 . 1 . . . . 21 LYS CA . 6964 1 192 . 1 1 21 21 LYS CB C 13 30.9 0.2 . 1 . . . . 21 LYS CB . 6964 1 193 . 1 1 21 21 LYS CG C 13 25.3 0.2 . 1 . . . . 21 LYS CG . 6964 1 194 . 1 1 21 21 LYS CD C 13 29.3 0.2 . 1 . . . . 21 LYS CD . 6964 1 195 . 1 1 21 21 LYS CE C 13 42.1 0.2 . 1 . . . . 21 LYS CE . 6964 1 196 . 1 1 21 21 LYS N N 15 119.9 0.2 . 1 . . . . 21 LYS N . 6964 1 197 . 1 1 22 22 GLY H H 1 8.80 0.02 . 1 . . . . 22 GLY H . 6964 1 198 . 1 1 22 22 GLY HA2 H 1 3.74 0.02 . 2 . . . . 22 GLY HA2 . 6964 1 199 . 1 1 22 22 GLY HA3 H 1 3.93 0.02 . 2 . . . . 22 GLY HA3 . 6964 1 200 . 1 1 22 22 GLY C C 13 174.5 0.2 . 1 . . . . 22 GLY C . 6964 1 201 . 1 1 22 22 GLY CA C 13 45.4 0.2 . 1 . . . . 22 GLY CA . 6964 1 202 . 1 1 22 22 GLY N N 15 106.5 0.2 . 1 . . . . 22 GLY N . 6964 1 203 . 1 1 23 23 GLY H H 1 7.63 0.02 . 1 . . . . 23 GLY H . 6964 1 204 . 1 1 23 23 GLY HA2 H 1 4.01 0.02 . 2 . . . . 23 GLY HA2 . 6964 1 205 . 1 1 23 23 GLY HA3 H 1 4.44 0.02 . 2 . . . . 23 GLY HA3 . 6964 1 206 . 1 1 23 23 GLY C C 13 172.5 0.2 . 1 . . . . 23 GLY C . 6964 1 207 . 1 1 23 23 GLY CA C 13 45.6 0.2 . 1 . . . . 23 GLY CA . 6964 1 208 . 1 1 23 23 GLY N N 15 108.8 0.2 . 1 . . . . 23 GLY N . 6964 1 209 . 1 1 24 24 PHE H H 1 8.73 0.02 . 1 . . . . 24 PHE H . 6964 1 210 . 1 1 24 24 PHE HA H 1 5.22 0.02 . 1 . . . . 24 PHE HA . 6964 1 211 . 1 1 24 24 PHE HB2 H 1 3.11 0.02 . 2 . . . . 24 PHE HB2 . 6964 1 212 . 1 1 24 24 PHE HB3 H 1 3.27 0.02 . 2 . . . . 24 PHE HB3 . 6964 1 213 . 1 1 24 24 PHE HD1 H 1 7.48 0.02 . 3 . . . . 24 PHE HD1 . 6964 1 214 . 1 1 24 24 PHE HE1 H 1 7.36 0.02 . 3 . . . . 24 PHE HE1 . 6964 1 215 . 1 1 24 24 PHE HZ H 1 6.94 0.02 . 1 . . . . 24 PHE HZ . 6964 1 216 . 1 1 24 24 PHE C C 13 174.5 0.2 . 1 . . . . 24 PHE C . 6964 1 217 . 1 1 24 24 PHE CA C 13 58.0 0.2 . 1 . . . . 24 PHE CA . 6964 1 218 . 1 1 24 24 PHE CB C 13 43.9 0.2 . 1 . . . . 24 PHE CB . 6964 1 219 . 1 1 24 24 PHE CD1 C 13 132.6 0.2 . 3 . . . . 24 PHE CD1 . 6964 1 220 . 1 1 24 24 PHE CE1 C 13 131.4 0.2 . 3 . . . . 24 PHE CE1 . 6964 1 221 . 1 1 24 24 PHE CZ C 13 130.2 0.2 . 1 . . . . 24 PHE CZ . 6964 1 222 . 1 1 24 24 PHE N N 15 118.6 0.2 . 1 . . . . 24 PHE N . 6964 1 223 . 1 1 25 25 TYR H H 1 9.26 0.02 . 1 . . . . 25 TYR H . 6964 1 224 . 1 1 25 25 TYR HA H 1 5.25 0.02 . 1 . . . . 25 TYR HA . 6964 1 225 . 1 1 25 25 TYR HB2 H 1 2.76 0.02 . 2 . . . . 25 TYR HB2 . 6964 1 226 . 1 1 25 25 TYR HB3 H 1 3.01 0.02 . 2 . . . . 25 TYR HB3 . 6964 1 227 . 1 1 25 25 TYR HD1 H 1 6.82 0.02 . 3 . . . . 25 TYR HD1 . 6964 1 228 . 1 1 25 25 TYR HE1 H 1 6.54 0.02 . 3 . . . . 25 TYR HE1 . 6964 1 229 . 1 1 25 25 TYR C C 13 174.9 0.2 . 1 . . . . 25 TYR C . 6964 1 230 . 1 1 25 25 TYR CA C 13 57.2 0.2 . 1 . . . . 25 TYR CA . 6964 1 231 . 1 1 25 25 TYR CB C 13 40.4 0.2 . 1 . . . . 25 TYR CB . 6964 1 232 . 1 1 25 25 TYR CD1 C 13 132.9 0.2 . 3 . . . . 25 TYR CD1 . 6964 1 233 . 1 1 25 25 TYR CE1 C 13 117.7 0.2 . 3 . . . . 25 TYR CE1 . 6964 1 234 . 1 1 25 25 TYR N N 15 126.0 0.2 . 1 . . . . 25 TYR N . 6964 1 235 . 1 1 26 26 PHE H H 1 8.09 0.02 . 1 . . . . 26 PHE H . 6964 1 236 . 1 1 26 26 PHE HA H 1 5.03 0.02 . 1 . . . . 26 PHE HA . 6964 1 237 . 1 1 26 26 PHE HB2 H 1 3.33 0.02 . 2 . . . . 26 PHE HB2 . 6964 1 238 . 1 1 26 26 PHE HB3 H 1 3.70 0.02 . 2 . . . . 26 PHE HB3 . 6964 1 239 . 1 1 26 26 PHE HD1 H 1 6.96 0.02 . 3 . . . . 26 PHE HD1 . 6964 1 240 . 1 1 26 26 PHE HE1 H 1 6.83 0.02 . 3 . . . . 26 PHE HE1 . 6964 1 241 . 1 1 26 26 PHE HZ H 1 5.99 0.02 . 1 . . . . 26 PHE HZ . 6964 1 242 . 1 1 26 26 PHE C C 13 174.0 0.2 . 1 . . . . 26 PHE C . 6964 1 243 . 1 1 26 26 PHE CA C 13 56.6 0.2 . 1 . . . . 26 PHE CA . 6964 1 244 . 1 1 26 26 PHE CB C 13 39.9 0.2 . 1 . . . . 26 PHE CB . 6964 1 245 . 1 1 26 26 PHE CD1 C 13 132.2 0.2 . 3 . . . . 26 PHE CD1 . 6964 1 246 . 1 1 26 26 PHE CE1 C 13 130.7 0.2 . 3 . . . . 26 PHE CE1 . 6964 1 247 . 1 1 26 26 PHE CZ C 13 128.1 0.2 . 1 . . . . 26 PHE CZ . 6964 1 248 . 1 1 26 26 PHE N N 15 120.6 0.2 . 1 . . . . 26 PHE N . 6964 1 249 . 1 1 27 27 ALA H H 1 9.67 0.02 . 1 . . . . 27 ALA H . 6964 1 250 . 1 1 27 27 ALA HA H 1 4.13 0.02 . 1 . . . . 27 ALA HA . 6964 1 251 . 1 1 27 27 ALA HB1 H 1 1.54 0.02 . 1 . . . . 27 ALA HB . 6964 1 252 . 1 1 27 27 ALA HB2 H 1 1.54 0.02 . 1 . . . . 27 ALA HB . 6964 1 253 . 1 1 27 27 ALA HB3 H 1 1.54 0.02 . 1 . . . . 27 ALA HB . 6964 1 254 . 1 1 27 27 ALA C C 13 177.3 0.2 . 1 . . . . 27 ALA C . 6964 1 255 . 1 1 27 27 ALA CA C 13 53.2 0.2 . 1 . . . . 27 ALA CA . 6964 1 256 . 1 1 27 27 ALA CB C 13 17.8 0.2 . 1 . . . . 27 ALA CB . 6964 1 257 . 1 1 27 27 ALA N N 15 124.0 0.2 . 1 . . . . 27 ALA N . 6964 1 258 . 1 1 28 28 GLY H H 1 8.76 0.02 . 1 . . . . 28 GLY H . 6964 1 259 . 1 1 28 28 GLY HA2 H 1 3.54 0.02 . 2 . . . . 28 GLY HA2 . 6964 1 260 . 1 1 28 28 GLY HA3 H 1 3.92 0.02 . 2 . . . . 28 GLY HA3 . 6964 1 261 . 1 1 28 28 GLY C C 13 173.9 0.2 . 1 . . . . 28 GLY C . 6964 1 262 . 1 1 28 28 GLY CA C 13 45.9 0.2 . 1 . . . . 28 GLY CA . 6964 1 263 . 1 1 28 28 GLY N N 15 103.8 0.2 . 1 . . . . 28 GLY N . 6964 1 264 . 1 1 29 29 MET H H 1 7.47 0.02 . 1 . . . . 29 MET H . 6964 1 265 . 1 1 29 29 MET HA H 1 4.53 0.02 . 1 . . . . 29 MET HA . 6964 1 266 . 1 1 29 29 MET HG2 H 1 1.72 0.02 . 2 . . . . 29 MET HG2 . 6964 1 267 . 1 1 29 29 MET HG3 H 1 2.00 0.02 . 2 . . . . 29 MET HG3 . 6964 1 268 . 1 1 29 29 MET HE1 H 1 1.82 0.02 . 1 . . . . 29 MET HE . 6964 1 269 . 1 1 29 29 MET HE2 H 1 1.82 0.02 . 1 . . . . 29 MET HE . 6964 1 270 . 1 1 29 29 MET HE3 H 1 1.82 0.02 . 1 . . . . 29 MET HE . 6964 1 271 . 1 1 29 29 MET C C 13 173.4 0.2 . 1 . . . . 29 MET C . 6964 1 272 . 1 1 29 29 MET CA C 13 54.2 0.2 . 1 . . . . 29 MET CA . 6964 1 273 . 1 1 29 29 MET CB C 13 36.2 0.2 . 1 . . . . 29 MET CB . 6964 1 274 . 1 1 29 29 MET CG C 13 31.1 0.2 . 1 . . . . 29 MET CG . 6964 1 275 . 1 1 29 29 MET CE C 13 16.9 0.2 . 1 . . . . 29 MET CE . 6964 1 276 . 1 1 29 29 MET N N 15 117.8 0.2 . 1 . . . . 29 MET N . 6964 1 277 . 1 1 30 30 SER H H 1 8.22 0.02 . 1 . . . . 30 SER H . 6964 1 278 . 1 1 30 30 SER HA H 1 4.39 0.02 . 1 . . . . 30 SER HA . 6964 1 279 . 1 1 30 30 SER HB2 H 1 3.44 0.02 . 2 . . . . 30 SER HB2 . 6964 1 280 . 1 1 30 30 SER HB3 H 1 3.50 0.02 . 2 . . . . 30 SER HB3 . 6964 1 281 . 1 1 30 30 SER C C 13 173.7 0.2 . 1 . . . . 30 SER C . 6964 1 282 . 1 1 30 30 SER CA C 13 57.8 0.2 . 1 . . . . 30 SER CA . 6964 1 283 . 1 1 30 30 SER CB C 13 64.1 0.2 . 1 . . . . 30 SER CB . 6964 1 284 . 1 1 30 30 SER N N 15 115.7 0.2 . 1 . . . . 30 SER N . 6964 1 285 . 1 1 31 31 HIS H H 1 8.18 0.02 . 1 . . . . 31 HIS H . 6964 1 286 . 1 1 31 31 HIS HA H 1 4.62 0.02 . 1 . . . . 31 HIS HA . 6964 1 287 . 1 1 31 31 HIS HB2 H 1 2.97 0.02 . 2 . . . . 31 HIS HB2 . 6964 1 288 . 1 1 31 31 HIS HB3 H 1 3.04 0.02 . 2 . . . . 31 HIS HB3 . 6964 1 289 . 1 1 31 31 HIS C C 13 173.2 0.2 . 1 . . . . 31 HIS C . 6964 1 290 . 1 1 31 31 HIS CA C 13 54.8 0.2 . 1 . . . . 31 HIS CA . 6964 1 291 . 1 1 31 31 HIS CB C 13 30.6 0.2 . 1 . . . . 31 HIS CB . 6964 1 292 . 1 1 31 31 HIS N N 15 120.6 0.2 . 1 . . . . 31 HIS N . 6964 1 293 . 1 1 32 32 GLN H H 1 8.80 0.02 . 1 . . . . 32 GLN H . 6964 1 294 . 1 1 32 32 GLN HA H 1 4.37 0.02 . 1 . . . . 32 GLN HA . 6964 1 295 . 1 1 32 32 GLN HB2 H 1 1.98 0.02 . 2 . . . . 32 GLN HB2 . 6964 1 296 . 1 1 32 32 GLN HB3 H 1 2.04 0.02 . 2 . . . . 32 GLN HB3 . 6964 1 297 . 1 1 32 32 GLN HG2 H 1 2.30 0.02 . 2 . . . . 32 GLN HG2 . 6964 1 298 . 1 1 32 32 GLN HG3 H 1 2.36 0.02 . 2 . . . . 32 GLN HG3 . 6964 1 299 . 1 1 32 32 GLN HE21 H 1 6.90 0.02 . 2 . . . . 32 GLN HE21 . 6964 1 300 . 1 1 32 32 GLN HE22 H 1 7.51 0.02 . 2 . . . . 32 GLN HE22 . 6964 1 301 . 1 1 32 32 GLN C C 13 176.1 0.2 . 1 . . . . 32 GLN C . 6964 1 302 . 1 1 32 32 GLN CA C 13 56.7 0.2 . 1 . . . . 32 GLN CA . 6964 1 303 . 1 1 32 32 GLN CB C 13 30.3 0.2 . 1 . . . . 32 GLN CB . 6964 1 304 . 1 1 32 32 GLN CG C 13 34.1 0.2 . 1 . . . . 32 GLN CG . 6964 1 305 . 1 1 32 32 GLN N N 15 125.0 0.2 . 1 . . . . 32 GLN N . 6964 1 306 . 1 1 32 32 GLN NE2 N 15 111.7 0.2 . 1 . . . . 32 GLN NE2 . 6964 1 307 . 1 1 33 33 GLY H H 1 8.40 0.02 . 1 . . . . 33 GLY H . 6964 1 308 . 1 1 33 33 GLY HA2 H 1 3.83 0.02 . 2 . . . . 33 GLY HA2 . 6964 1 309 . 1 1 33 33 GLY HA3 H 1 4.57 0.02 . 2 . . . . 33 GLY HA3 . 6964 1 310 . 1 1 33 33 GLY C C 13 171.7 0.2 . 1 . . . . 33 GLY C . 6964 1 311 . 1 1 33 33 GLY CA C 13 44.4 0.2 . 1 . . . . 33 GLY CA . 6964 1 312 . 1 1 33 33 GLY N N 15 111.3 0.2 . 1 . . . . 33 GLY N . 6964 1 313 . 1 1 34 34 SER H H 1 8.26 0.02 . 1 . . . . 34 SER H . 6964 1 314 . 1 1 34 34 SER HA H 1 5.09 0.02 . 1 . . . . 34 SER HA . 6964 1 315 . 1 1 34 34 SER HB2 H 1 4.47 0.02 . 2 . . . . 34 SER HB2 . 6964 1 316 . 1 1 34 34 SER HB3 H 1 4.54 0.02 . 2 . . . . 34 SER HB3 . 6964 1 317 . 1 1 34 34 SER C C 13 174.4 0.2 . 1 . . . . 34 SER C . 6964 1 318 . 1 1 34 34 SER CA C 13 59.5 0.2 . 1 . . . . 34 SER CA . 6964 1 319 . 1 1 34 34 SER CB C 13 63.5 0.2 . 1 . . . . 34 SER CB . 6964 1 320 . 1 1 34 34 SER N N 15 113.1 0.2 . 1 . . . . 34 SER N . 6964 1 321 . 1 1 35 35 LEU H H 1 8.40 0.02 . 1 . . . . 35 LEU H . 6964 1 322 . 1 1 35 35 LEU HA H 1 5.17 0.02 . 1 . . . . 35 LEU HA . 6964 1 323 . 1 1 35 35 LEU HB2 H 1 0.48 0.02 . 2 . . . . 35 LEU HB2 . 6964 1 324 . 1 1 35 35 LEU HB3 H 1 1.11 0.02 . 2 . . . . 35 LEU HB3 . 6964 1 325 . 1 1 35 35 LEU HG H 1 1.95 0.02 . 1 . . . . 35 LEU HG . 6964 1 326 . 1 1 35 35 LEU HD11 H 1 0.72 0.02 . 1 . . . . 35 LEU HD1 . 6964 1 327 . 1 1 35 35 LEU HD12 H 1 0.72 0.02 . 1 . . . . 35 LEU HD1 . 6964 1 328 . 1 1 35 35 LEU HD13 H 1 0.72 0.02 . 1 . . . . 35 LEU HD1 . 6964 1 329 . 1 1 35 35 LEU HD21 H 1 0.78 0.02 . 1 . . . . 35 LEU HD2 . 6964 1 330 . 1 1 35 35 LEU HD22 H 1 0.78 0.02 . 1 . . . . 35 LEU HD2 . 6964 1 331 . 1 1 35 35 LEU HD23 H 1 0.78 0.02 . 1 . . . . 35 LEU HD2 . 6964 1 332 . 1 1 35 35 LEU C C 13 173.7 0.2 . 1 . . . . 35 LEU C . 6964 1 333 . 1 1 35 35 LEU CA C 13 54.7 0.2 . 1 . . . . 35 LEU CA . 6964 1 334 . 1 1 35 35 LEU CB C 13 49.7 0.2 . 1 . . . . 35 LEU CB . 6964 1 335 . 1 1 35 35 LEU CG C 13 25.8 0.2 . 1 . . . . 35 LEU CG . 6964 1 336 . 1 1 35 35 LEU CD1 C 13 28.7 0.2 . 1 . . . . 35 LEU CD1 . 6964 1 337 . 1 1 35 35 LEU CD2 C 13 23.4 0.2 . 1 . . . . 35 LEU CD2 . 6964 1 338 . 1 1 35 35 LEU N N 15 122.2 0.2 . 1 . . . . 35 LEU N . 6964 1 339 . 1 1 36 36 LEU H H 1 9.09 0.02 . 1 . . . . 36 LEU H . 6964 1 340 . 1 1 36 36 LEU HA H 1 4.72 0.02 . 1 . . . . 36 LEU HA . 6964 1 341 . 1 1 36 36 LEU HB2 H 1 1.15 0.02 . 2 . . . . 36 LEU HB2 . 6964 1 342 . 1 1 36 36 LEU HB3 H 1 1.20 0.02 . 2 . . . . 36 LEU HB3 . 6964 1 343 . 1 1 36 36 LEU HG H 1 0.97 0.02 . 1 . . . . 36 LEU HG . 6964 1 344 . 1 1 36 36 LEU HD11 H 1 0.35 0.02 . 1 . . . . 36 LEU HD1 . 6964 1 345 . 1 1 36 36 LEU HD12 H 1 0.35 0.02 . 1 . . . . 36 LEU HD1 . 6964 1 346 . 1 1 36 36 LEU HD13 H 1 0.35 0.02 . 1 . . . . 36 LEU HD1 . 6964 1 347 . 1 1 36 36 LEU HD21 H 1 -0.04 0.02 . 1 . . . . 36 LEU HD2 . 6964 1 348 . 1 1 36 36 LEU HD22 H 1 -0.04 0.02 . 1 . . . . 36 LEU HD2 . 6964 1 349 . 1 1 36 36 LEU HD23 H 1 -0.04 0.02 . 1 . . . . 36 LEU HD2 . 6964 1 350 . 1 1 36 36 LEU C C 13 174.4 0.2 . 1 . . . . 36 LEU C . 6964 1 351 . 1 1 36 36 LEU CA C 13 52.9 0.2 . 1 . . . . 36 LEU CA . 6964 1 352 . 1 1 36 36 LEU CB C 13 44.4 0.2 . 1 . . . . 36 LEU CB . 6964 1 353 . 1 1 36 36 LEU CG C 13 26.8 0.2 . 1 . . . . 36 LEU CG . 6964 1 354 . 1 1 36 36 LEU CD1 C 13 25.4 0.2 . 1 . . . . 36 LEU CD1 . 6964 1 355 . 1 1 36 36 LEU CD2 C 13 25.0 0.2 . 1 . . . . 36 LEU CD2 . 6964 1 356 . 1 1 36 36 LEU N N 15 120.3 0.2 . 1 . . . . 36 LEU N . 6964 1 357 . 1 1 37 37 PHE H H 1 9.73 0.02 . 1 . . . . 37 PHE H . 6964 1 358 . 1 1 37 37 PHE HA H 1 4.26 0.02 . 1 . . . . 37 PHE HA . 6964 1 359 . 1 1 37 37 PHE HB2 H 1 2.63 0.02 . 2 . . . . 37 PHE HB2 . 6964 1 360 . 1 1 37 37 PHE HB3 H 1 2.69 0.02 . 2 . . . . 37 PHE HB3 . 6964 1 361 . 1 1 37 37 PHE HD1 H 1 6.56 0.02 . 3 . . . . 37 PHE HD1 . 6964 1 362 . 1 1 37 37 PHE HE1 H 1 5.83 0.02 . 3 . . . . 37 PHE HE1 . 6964 1 363 . 1 1 37 37 PHE HZ H 1 6.06 0.02 . 1 . . . . 37 PHE HZ . 6964 1 364 . 1 1 37 37 PHE C C 13 174.6 0.2 . 1 . . . . 37 PHE C . 6964 1 365 . 1 1 37 37 PHE CA C 13 57.5 0.2 . 1 . . . . 37 PHE CA . 6964 1 366 . 1 1 37 37 PHE CB C 13 38.4 0.2 . 1 . . . . 37 PHE CB . 6964 1 367 . 1 1 37 37 PHE CD1 C 13 131.5 0.2 . 3 . . . . 37 PHE CD1 . 6964 1 368 . 1 1 37 37 PHE CE1 C 13 131.0 0.2 . 3 . . . . 37 PHE CE1 . 6964 1 369 . 1 1 37 37 PHE CZ C 13 128.5 0.2 . 1 . . . . 37 PHE CZ . 6964 1 370 . 1 1 37 37 PHE N N 15 125.1 0.2 . 1 . . . . 37 PHE N . 6964 1 371 . 1 1 38 38 LEU H H 1 8.44 0.02 . 1 . . . . 38 LEU H . 6964 1 372 . 1 1 38 38 LEU HA H 1 4.93 0.02 . 1 . . . . 38 LEU HA . 6964 1 373 . 1 1 38 38 LEU HB2 H 1 1.79 0.02 . 2 . . . . 38 LEU HB2 . 6964 1 374 . 1 1 38 38 LEU HB3 H 1 2.19 0.02 . 2 . . . . 38 LEU HB3 . 6964 1 375 . 1 1 38 38 LEU HG H 1 1.61 0.02 . 1 . . . . 38 LEU HG . 6964 1 376 . 1 1 38 38 LEU HD11 H 1 0.77 0.02 . 1 . . . . 38 LEU HD1 . 6964 1 377 . 1 1 38 38 LEU HD12 H 1 0.77 0.02 . 1 . . . . 38 LEU HD1 . 6964 1 378 . 1 1 38 38 LEU HD13 H 1 0.77 0.02 . 1 . . . . 38 LEU HD1 . 6964 1 379 . 1 1 38 38 LEU HD21 H 1 0.70 0.02 . 1 . . . . 38 LEU HD2 . 6964 1 380 . 1 1 38 38 LEU HD22 H 1 0.70 0.02 . 1 . . . . 38 LEU HD2 . 6964 1 381 . 1 1 38 38 LEU HD23 H 1 0.70 0.02 . 1 . . . . 38 LEU HD2 . 6964 1 382 . 1 1 38 38 LEU CA C 13 52.6 0.2 . 1 . . . . 38 LEU CA . 6964 1 383 . 1 1 38 38 LEU CB C 13 41.8 0.2 . 1 . . . . 38 LEU CB . 6964 1 384 . 1 1 38 38 LEU CG C 13 27.8 0.2 . 1 . . . . 38 LEU CG . 6964 1 385 . 1 1 38 38 LEU CD1 C 13 26.7 0.2 . 1 . . . . 38 LEU CD1 . 6964 1 386 . 1 1 38 38 LEU CD2 C 13 23.9 0.2 . 1 . . . . 38 LEU CD2 . 6964 1 387 . 1 1 38 38 LEU N N 15 123.5 0.2 . 1 . . . . 38 LEU N . 6964 1 388 . 1 1 39 39 PRO HA H 1 4.45 0.02 . 1 . . . . 39 PRO HA . 6964 1 389 . 1 1 39 39 PRO HB2 H 1 1.84 0.02 . 2 . . . . 39 PRO HB2 . 6964 1 390 . 1 1 39 39 PRO HB3 H 1 2.44 0.02 . 2 . . . . 39 PRO HB3 . 6964 1 391 . 1 1 39 39 PRO HG2 H 1 1.97 0.02 . 2 . . . . 39 PRO HG2 . 6964 1 392 . 1 1 39 39 PRO HG3 H 1 2.03 0.02 . 2 . . . . 39 PRO HG3 . 6964 1 393 . 1 1 39 39 PRO HD2 H 1 3.46 0.02 . 2 . . . . 39 PRO HD2 . 6964 1 394 . 1 1 39 39 PRO HD3 H 1 3.74 0.02 . 2 . . . . 39 PRO HD3 . 6964 1 395 . 1 1 39 39 PRO C C 13 176.8 0.2 . 1 . . . . 39 PRO C . 6964 1 396 . 1 1 39 39 PRO CA C 13 65.1 0.2 . 1 . . . . 39 PRO CA . 6964 1 397 . 1 1 39 39 PRO CB C 13 32.1 0.2 . 1 . . . . 39 PRO CB . 6964 1 398 . 1 1 39 39 PRO CG C 13 28.1 0.2 . 1 . . . . 39 PRO CG . 6964 1 399 . 1 1 39 39 PRO CD C 13 50.4 0.2 . 1 . . . . 39 PRO CD . 6964 1 400 . 1 1 40 40 ASP H H 1 8.24 0.02 . 1 . . . . 40 ASP H . 6964 1 401 . 1 1 40 40 ASP HA H 1 4.67 0.02 . 1 . . . . 40 ASP HA . 6964 1 402 . 1 1 40 40 ASP HB2 H 1 2.63 0.02 . 2 . . . . 40 ASP HB2 . 6964 1 403 . 1 1 40 40 ASP HB3 H 1 2.78 0.02 . 2 . . . . 40 ASP HB3 . 6964 1 404 . 1 1 40 40 ASP C C 13 175.9 0.2 . 1 . . . . 40 ASP C . 6964 1 405 . 1 1 40 40 ASP CA C 13 53.4 0.2 . 1 . . . . 40 ASP CA . 6964 1 406 . 1 1 40 40 ASP CB C 13 41.4 0.2 . 1 . . . . 40 ASP CB . 6964 1 407 . 1 1 40 40 ASP N N 15 109.5 0.2 . 1 . . . . 40 ASP N . 6964 1 408 . 1 1 41 41 ALA H H 1 7.58 0.02 . 1 . . . . 41 ALA H . 6964 1 409 . 1 1 41 41 ALA HA H 1 4.24 0.02 . 1 . . . . 41 ALA HA . 6964 1 410 . 1 1 41 41 ALA HB1 H 1 1.01 0.02 . 1 . . . . 41 ALA HB . 6964 1 411 . 1 1 41 41 ALA HB2 H 1 1.01 0.02 . 1 . . . . 41 ALA HB . 6964 1 412 . 1 1 41 41 ALA HB3 H 1 1.01 0.02 . 1 . . . . 41 ALA HB . 6964 1 413 . 1 1 41 41 ALA C C 13 173.5 0.2 . 1 . . . . 41 ALA C . 6964 1 414 . 1 1 41 41 ALA CA C 13 52.4 0.2 . 1 . . . . 41 ALA CA . 6964 1 415 . 1 1 41 41 ALA CB C 13 22.2 0.2 . 1 . . . . 41 ALA CB . 6964 1 416 . 1 1 41 41 ALA N N 15 121.7 0.2 . 1 . . . . 41 ALA N . 6964 1 417 . 1 1 42 42 VAL H H 1 7.95 0.02 . 1 . . . . 42 VAL H . 6964 1 418 . 1 1 42 42 VAL HA H 1 4.68 0.02 . 1 . . . . 42 VAL HA . 6964 1 419 . 1 1 42 42 VAL HB H 1 1.63 0.02 . 1 . . . . 42 VAL HB . 6964 1 420 . 1 1 42 42 VAL HG11 H 1 -0.09 0.02 . 1 . . . . 42 VAL HG1 . 6964 1 421 . 1 1 42 42 VAL HG12 H 1 -0.09 0.02 . 1 . . . . 42 VAL HG1 . 6964 1 422 . 1 1 42 42 VAL HG13 H 1 -0.09 0.02 . 1 . . . . 42 VAL HG1 . 6964 1 423 . 1 1 42 42 VAL HG21 H 1 0.62 0.02 . 1 . . . . 42 VAL HG2 . 6964 1 424 . 1 1 42 42 VAL HG22 H 1 0.62 0.02 . 1 . . . . 42 VAL HG2 . 6964 1 425 . 1 1 42 42 VAL HG23 H 1 0.62 0.02 . 1 . . . . 42 VAL HG2 . 6964 1 426 . 1 1 42 42 VAL C C 13 174.9 0.2 . 1 . . . . 42 VAL C . 6964 1 427 . 1 1 42 42 VAL CA C 13 61.0 0.2 . 1 . . . . 42 VAL CA . 6964 1 428 . 1 1 42 42 VAL CB C 13 33.5 0.2 . 1 . . . . 42 VAL CB . 6964 1 429 . 1 1 42 42 VAL CG1 C 13 21.6 0.2 . 1 . . . . 42 VAL CG1 . 6964 1 430 . 1 1 42 42 VAL CG2 C 13 22.3 0.2 . 1 . . . . 42 VAL CG2 . 6964 1 431 . 1 1 42 42 VAL N N 15 118.2 0.2 . 1 . . . . 42 VAL N . 6964 1 432 . 1 1 43 43 TRP H H 1 9.17 0.02 . 1 . . . . 43 TRP H . 6964 1 433 . 1 1 43 43 TRP HA H 1 4.97 0.02 . 1 . . . . 43 TRP HA . 6964 1 434 . 1 1 43 43 TRP HB2 H 1 2.65 0.02 . 2 . . . . 43 TRP HB2 . 6964 1 435 . 1 1 43 43 TRP HB3 H 1 3.39 0.02 . 2 . . . . 43 TRP HB3 . 6964 1 436 . 1 1 43 43 TRP HD1 H 1 6.65 0.02 . 1 . . . . 43 TRP HD1 . 6964 1 437 . 1 1 43 43 TRP HE1 H 1 10.23 0.02 . 1 . . . . 43 TRP HE1 . 6964 1 438 . 1 1 43 43 TRP HE3 H 1 7.46 0.02 . 1 . . . . 43 TRP HE3 . 6964 1 439 . 1 1 43 43 TRP HZ2 H 1 7.08 0.02 . 1 . . . . 43 TRP HZ2 . 6964 1 440 . 1 1 43 43 TRP HH2 H 1 6.80 0.02 . 1 . . . . 43 TRP HH2 . 6964 1 441 . 1 1 43 43 TRP C C 13 176.6 0.2 . 1 . . . . 43 TRP C . 6964 1 442 . 1 1 43 43 TRP CA C 13 55.4 0.2 . 1 . . . . 43 TRP CA . 6964 1 443 . 1 1 43 43 TRP CB C 13 33.1 0.2 . 1 . . . . 43 TRP CB . 6964 1 444 . 1 1 43 43 TRP CD1 C 13 125.3 0.2 . 1 . . . . 43 TRP CD1 . 6964 1 445 . 1 1 43 43 TRP CE3 C 13 120.4 0.2 . 1 . . . . 43 TRP CE3 . 6964 1 446 . 1 1 43 43 TRP CZ2 C 13 113.9 0.2 . 1 . . . . 43 TRP CZ2 . 6964 1 447 . 1 1 43 43 TRP CH2 C 13 124.1 0.2 . 1 . . . . 43 TRP CH2 . 6964 1 448 . 1 1 43 43 TRP N N 15 126.0 0.2 . 1 . . . . 43 TRP N . 6964 1 449 . 1 1 43 43 TRP NE1 N 15 129.5 0.2 . 1 . . . . 43 TRP NE1 . 6964 1 450 . 1 1 44 44 GLY H H 1 8.87 0.02 . 1 . . . . 44 GLY H . 6964 1 451 . 1 1 44 44 GLY HA2 H 1 3.79 0.02 . 2 . . . . 44 GLY HA2 . 6964 1 452 . 1 1 44 44 GLY HA3 H 1 4.23 0.02 . 2 . . . . 44 GLY HA3 . 6964 1 453 . 1 1 44 44 GLY C C 13 171.6 0.2 . 1 . . . . 44 GLY C . 6964 1 454 . 1 1 44 44 GLY CA C 13 47.0 0.2 . 1 . . . . 44 GLY CA . 6964 1 455 . 1 1 44 44 GLY N N 15 107.6 0.2 . 1 . . . . 44 GLY N . 6964 1 456 . 1 1 45 45 TRP H H 1 7.85 0.02 . 1 . . . . 45 TRP H . 6964 1 457 . 1 1 45 45 TRP HA H 1 5.27 0.02 . 1 . . . . 45 TRP HA . 6964 1 458 . 1 1 45 45 TRP HB2 H 1 2.60 0.02 . 2 . . . . 45 TRP HB2 . 6964 1 459 . 1 1 45 45 TRP HB3 H 1 3.01 0.02 . 2 . . . . 45 TRP HB3 . 6964 1 460 . 1 1 45 45 TRP HD1 H 1 7.54 0.02 . 1 . . . . 45 TRP HD1 . 6964 1 461 . 1 1 45 45 TRP HE1 H 1 9.78 0.02 . 1 . . . . 45 TRP HE1 . 6964 1 462 . 1 1 45 45 TRP HE3 H 1 7.50 0.02 . 1 . . . . 45 TRP HE3 . 6964 1 463 . 1 1 45 45 TRP HZ2 H 1 6.92 0.02 . 1 . . . . 45 TRP HZ2 . 6964 1 464 . 1 1 45 45 TRP HZ3 H 1 6.86 0.02 . 1 . . . . 45 TRP HZ3 . 6964 1 465 . 1 1 45 45 TRP HH2 H 1 6.59 0.02 . 1 . . . . 45 TRP HH2 . 6964 1 466 . 1 1 45 45 TRP C C 13 175.6 0.2 . 1 . . . . 45 TRP C . 6964 1 467 . 1 1 45 45 TRP CA C 13 53.9 0.2 . 1 . . . . 45 TRP CA . 6964 1 468 . 1 1 45 45 TRP CB C 13 32.2 0.2 . 1 . . . . 45 TRP CB . 6964 1 469 . 1 1 45 45 TRP CD1 C 13 125.1 0.2 . 1 . . . . 45 TRP CD1 . 6964 1 470 . 1 1 45 45 TRP CE3 C 13 120.7 0.2 . 1 . . . . 45 TRP CE3 . 6964 1 471 . 1 1 45 45 TRP CZ2 C 13 113.7 0.2 . 1 . . . . 45 TRP CZ2 . 6964 1 472 . 1 1 45 45 TRP CZ3 C 13 122.9 0.2 . 1 . . . . 45 TRP CZ3 . 6964 1 473 . 1 1 45 45 TRP CH2 C 13 123.6 0.2 . 1 . . . . 45 TRP CH2 . 6964 1 474 . 1 1 45 45 TRP N N 15 125.5 0.2 . 1 . . . . 45 TRP N . 6964 1 475 . 1 1 45 45 TRP NE1 N 15 128.7 0.2 . 1 . . . . 45 TRP NE1 . 6964 1 476 . 1 1 46 46 ASP H H 1 8.79 0.02 . 1 . . . . 46 ASP H . 6964 1 477 . 1 1 46 46 ASP HA H 1 4.54 0.02 . 1 . . . . 46 ASP HA . 6964 1 478 . 1 1 46 46 ASP HB2 H 1 2.53 0.02 . 2 . . . . 46 ASP HB2 . 6964 1 479 . 1 1 46 46 ASP HB3 H 1 2.72 0.02 . 2 . . . . 46 ASP HB3 . 6964 1 480 . 1 1 46 46 ASP C C 13 175.0 0.2 . 1 . . . . 46 ASP C . 6964 1 481 . 1 1 46 46 ASP CA C 13 54.3 0.2 . 1 . . . . 46 ASP CA . 6964 1 482 . 1 1 46 46 ASP CB C 13 39.5 0.2 . 1 . . . . 46 ASP CB . 6964 1 483 . 1 1 46 46 ASP N N 15 128.1 0.2 . 1 . . . . 46 ASP N . 6964 1 484 . 1 1 47 47 VAL H H 1 6.58 0.02 . 1 . . . . 47 VAL H . 6964 1 485 . 1 1 47 47 VAL HA H 1 3.66 0.02 . 1 . . . . 47 VAL HA . 6964 1 486 . 1 1 47 47 VAL HB H 1 -0.30 0.02 . 1 . . . . 47 VAL HB . 6964 1 487 . 1 1 47 47 VAL HG11 H 1 0.03 0.02 . 1 . . . . 47 VAL HG1 . 6964 1 488 . 1 1 47 47 VAL HG12 H 1 0.03 0.02 . 1 . . . . 47 VAL HG1 . 6964 1 489 . 1 1 47 47 VAL HG13 H 1 0.03 0.02 . 1 . . . . 47 VAL HG1 . 6964 1 490 . 1 1 47 47 VAL HG21 H 1 -0.22 0.02 . 1 . . . . 47 VAL HG2 . 6964 1 491 . 1 1 47 47 VAL HG22 H 1 -0.22 0.02 . 1 . . . . 47 VAL HG2 . 6964 1 492 . 1 1 47 47 VAL HG23 H 1 -0.22 0.02 . 1 . . . . 47 VAL HG2 . 6964 1 493 . 1 1 47 47 VAL C C 13 175.2 0.2 . 1 . . . . 47 VAL C . 6964 1 494 . 1 1 47 47 VAL CA C 13 62.1 0.2 . 1 . . . . 47 VAL CA . 6964 1 495 . 1 1 47 47 VAL CB C 13 34.1 0.2 . 1 . . . . 47 VAL CB . 6964 1 496 . 1 1 47 47 VAL CG1 C 13 21.9 0.2 . 1 . . . . 47 VAL CG1 . 6964 1 497 . 1 1 47 47 VAL CG2 C 13 20.6 0.2 . 1 . . . . 47 VAL CG2 . 6964 1 498 . 1 1 47 47 VAL N N 15 120.4 0.2 . 1 . . . . 47 VAL N . 6964 1 499 . 1 1 48 48 THR H H 1 9.02 0.02 . 1 . . . . 48 THR H . 6964 1 500 . 1 1 48 48 THR HA H 1 4.32 0.02 . 1 . . . . 48 THR HA . 6964 1 501 . 1 1 48 48 THR HB H 1 4.24 0.02 . 1 . . . . 48 THR HB . 6964 1 502 . 1 1 48 48 THR HG21 H 1 1.15 0.02 . 1 . . . . 48 THR HG2 . 6964 1 503 . 1 1 48 48 THR HG22 H 1 1.15 0.02 . 1 . . . . 48 THR HG2 . 6964 1 504 . 1 1 48 48 THR HG23 H 1 1.15 0.02 . 1 . . . . 48 THR HG2 . 6964 1 505 . 1 1 48 48 THR C C 13 173.9 0.2 . 1 . . . . 48 THR C . 6964 1 506 . 1 1 48 48 THR CA C 13 61.2 0.2 . 1 . . . . 48 THR CA . 6964 1 507 . 1 1 48 48 THR CB C 13 70.9 0.2 . 1 . . . . 48 THR CB . 6964 1 508 . 1 1 48 48 THR CG2 C 13 21.6 0.2 . 1 . . . . 48 THR CG2 . 6964 1 509 . 1 1 48 48 THR N N 15 115.1 0.2 . 1 . . . . 48 THR N . 6964 1 510 . 1 1 49 49 LYS H H 1 7.45 0.02 . 1 . . . . 49 LYS H . 6964 1 511 . 1 1 49 49 LYS HA H 1 4.70 0.02 . 1 . . . . 49 LYS HA . 6964 1 512 . 1 1 49 49 LYS HB2 H 1 1.52 0.02 . 2 . . . . 49 LYS HB2 . 6964 1 513 . 1 1 49 49 LYS HB3 H 1 1.96 0.02 . 2 . . . . 49 LYS HB3 . 6964 1 514 . 1 1 49 49 LYS HG2 H 1 1.24 0.02 . 2 . . . . 49 LYS HG2 . 6964 1 515 . 1 1 49 49 LYS HG3 H 1 1.33 0.02 . 2 . . . . 49 LYS HG3 . 6964 1 516 . 1 1 49 49 LYS HE2 H 1 2.83 0.02 . 2 . . . . 49 LYS HE2 . 6964 1 517 . 1 1 49 49 LYS HE3 H 1 2.85 0.02 . 2 . . . . 49 LYS HE3 . 6964 1 518 . 1 1 49 49 LYS CA C 13 53.4 0.2 . 1 . . . . 49 LYS CA . 6964 1 519 . 1 1 49 49 LYS CB C 13 34.2 0.2 . 1 . . . . 49 LYS CB . 6964 1 520 . 1 1 49 49 LYS CG C 13 27.1 0.2 . 1 . . . . 49 LYS CG . 6964 1 521 . 1 1 49 49 LYS N N 15 120.5 0.2 . 1 . . . . 49 LYS N . 6964 1 522 . 1 1 50 50 PRO HA H 1 3.30 0.02 . 1 . . . . 50 PRO HA . 6964 1 523 . 1 1 50 50 PRO HB2 H 1 0.85 0.02 . 2 . . . . 50 PRO HB2 . 6964 1 524 . 1 1 50 50 PRO HB3 H 1 0.98 0.02 . 2 . . . . 50 PRO HB3 . 6964 1 525 . 1 1 50 50 PRO HG2 H 1 1.85 0.02 . 2 . . . . 50 PRO HG2 . 6964 1 526 . 1 1 50 50 PRO HG3 H 1 1.87 0.02 . 2 . . . . 50 PRO HG3 . 6964 1 527 . 1 1 50 50 PRO HD2 H 1 3.39 0.02 . 2 . . . . 50 PRO HD2 . 6964 1 528 . 1 1 50 50 PRO HD3 H 1 3.79 0.02 . 2 . . . . 50 PRO HD3 . 6964 1 529 . 1 1 50 50 PRO C C 13 175.5 0.2 . 1 . . . . 50 PRO C . 6964 1 530 . 1 1 50 50 PRO CA C 13 64.2 0.2 . 1 . . . . 50 PRO CA . 6964 1 531 . 1 1 50 50 PRO CB C 13 30.3 0.2 . 1 . . . . 50 PRO CB . 6964 1 532 . 1 1 50 50 PRO CG C 13 28.0 0.2 . 1 . . . . 50 PRO CG . 6964 1 533 . 1 1 50 50 PRO CD C 13 50.3 0.2 . 1 . . . . 50 PRO CD . 6964 1 534 . 1 1 51 51 GLU H H 1 8.75 0.02 . 1 . . . . 51 GLU H . 6964 1 535 . 1 1 51 51 GLU HA H 1 4.20 0.02 . 1 . . . . 51 GLU HA . 6964 1 536 . 1 1 51 51 GLU HB2 H 1 1.98 0.02 . 2 . . . . 51 GLU HB2 . 6964 1 537 . 1 1 51 51 GLU HB3 H 1 2.06 0.02 . 2 . . . . 51 GLU HB3 . 6964 1 538 . 1 1 51 51 GLU HG2 H 1 2.30 0.02 . 2 . . . . 51 GLU HG2 . 6964 1 539 . 1 1 51 51 GLU HG3 H 1 2.33 0.02 . 2 . . . . 51 GLU HG3 . 6964 1 540 . 1 1 51 51 GLU C C 13 177.5 0.2 . 1 . . . . 51 GLU C . 6964 1 541 . 1 1 51 51 GLU CA C 13 59.1 0.2 . 1 . . . . 51 GLU CA . 6964 1 542 . 1 1 51 51 GLU CB C 13 28.4 0.2 . 1 . . . . 51 GLU CB . 6964 1 543 . 1 1 51 51 GLU CG C 13 36.6 0.2 . 1 . . . . 51 GLU CG . 6964 1 544 . 1 1 51 51 GLU N N 15 114.9 0.2 . 1 . . . . 51 GLU N . 6964 1 545 . 1 1 52 52 GLN H H 1 7.49 0.02 . 1 . . . . 52 GLN H . 6964 1 546 . 1 1 52 52 GLN HA H 1 4.17 0.02 . 1 . . . . 52 GLN HA . 6964 1 547 . 1 1 52 52 GLN HB2 H 1 2.07 0.02 . 2 . . . . 52 GLN HB2 . 6964 1 548 . 1 1 52 52 GLN HB3 H 1 2.22 0.02 . 2 . . . . 52 GLN HB3 . 6964 1 549 . 1 1 52 52 GLN HG2 H 1 2.03 0.02 . 2 . . . . 52 GLN HG2 . 6964 1 550 . 1 1 52 52 GLN HG3 H 1 2.37 0.02 . 2 . . . . 52 GLN HG3 . 6964 1 551 . 1 1 52 52 GLN HE21 H 1 6.74 0.02 . 2 . . . . 52 GLN HE21 . 6964 1 552 . 1 1 52 52 GLN HE22 H 1 7.55 0.02 . 2 . . . . 52 GLN HE22 . 6964 1 553 . 1 1 52 52 GLN C C 13 176.3 0.2 . 1 . . . . 52 GLN C . 6964 1 554 . 1 1 52 52 GLN CA C 13 55.4 0.2 . 1 . . . . 52 GLN CA . 6964 1 555 . 1 1 52 52 GLN CB C 13 29.9 0.2 . 1 . . . . 52 GLN CB . 6964 1 556 . 1 1 52 52 GLN CG C 13 34.2 0.2 . 1 . . . . 52 GLN CG . 6964 1 557 . 1 1 52 52 GLN N N 15 115.9 0.2 . 1 . . . . 52 GLN N . 6964 1 558 . 1 1 52 52 GLN NE2 N 15 110.9 0.2 . 1 . . . . 52 GLN NE2 . 6964 1 559 . 1 1 53 53 ILE H H 1 7.72 0.02 . 1 . . . . 53 ILE H . 6964 1 560 . 1 1 53 53 ILE HA H 1 3.59 0.02 . 1 . . . . 53 ILE HA . 6964 1 561 . 1 1 53 53 ILE HB H 1 1.80 0.02 . 1 . . . . 53 ILE HB . 6964 1 562 . 1 1 53 53 ILE HG12 H 1 0.65 0.02 . 2 . . . . 53 ILE HG12 . 6964 1 563 . 1 1 53 53 ILE HG13 H 1 1.28 0.02 . 2 . . . . 53 ILE HG13 . 6964 1 564 . 1 1 53 53 ILE HG21 H 1 0.84 0.02 . 1 . . . . 53 ILE HG2 . 6964 1 565 . 1 1 53 53 ILE HG22 H 1 0.84 0.02 . 1 . . . . 53 ILE HG2 . 6964 1 566 . 1 1 53 53 ILE HG23 H 1 0.84 0.02 . 1 . . . . 53 ILE HG2 . 6964 1 567 . 1 1 53 53 ILE HD11 H 1 0.15 0.02 . 1 . . . . 53 ILE HD1 . 6964 1 568 . 1 1 53 53 ILE HD12 H 1 0.15 0.02 . 1 . . . . 53 ILE HD1 . 6964 1 569 . 1 1 53 53 ILE HD13 H 1 0.15 0.02 . 1 . . . . 53 ILE HD1 . 6964 1 570 . 1 1 53 53 ILE C C 13 173.4 0.2 . 1 . . . . 53 ILE C . 6964 1 571 . 1 1 53 53 ILE CA C 13 63.6 0.2 . 1 . . . . 53 ILE CA . 6964 1 572 . 1 1 53 53 ILE CB C 13 35.9 0.2 . 1 . . . . 53 ILE CB . 6964 1 573 . 1 1 53 53 ILE CG1 C 13 28.3 0.2 . 1 . . . . 53 ILE CG1 . 6964 1 574 . 1 1 53 53 ILE CG2 C 13 18.1 0.2 . 1 . . . . 53 ILE CG2 . 6964 1 575 . 1 1 53 53 ILE CD1 C 13 13.5 0.2 . 1 . . . . 53 ILE CD1 . 6964 1 576 . 1 1 53 53 ILE N N 15 121.3 0.2 . 1 . . . . 53 ILE N . 6964 1 577 . 1 1 54 54 ASP H H 1 8.16 0.02 . 1 . . . . 54 ASP H . 6964 1 578 . 1 1 54 54 ASP HA H 1 4.60 0.02 . 1 . . . . 54 ASP HA . 6964 1 579 . 1 1 54 54 ASP HB2 H 1 2.98 0.02 . 2 . . . . 54 ASP HB2 . 6964 1 580 . 1 1 54 54 ASP HB3 H 1 3.14 0.02 . 2 . . . . 54 ASP HB3 . 6964 1 581 . 1 1 54 54 ASP C C 13 176.1 0.2 . 1 . . . . 54 ASP C . 6964 1 582 . 1 1 54 54 ASP CA C 13 52.4 0.2 . 1 . . . . 54 ASP CA . 6964 1 583 . 1 1 54 54 ASP CB C 13 42.1 0.2 . 1 . . . . 54 ASP CB . 6964 1 584 . 1 1 54 54 ASP N N 15 126.5 0.2 . 1 . . . . 54 ASP N . 6964 1 585 . 1 1 55 55 ARG H H 1 8.89 0.02 . 1 . . . . 55 ARG H . 6964 1 586 . 1 1 55 55 ARG HA H 1 3.74 0.02 . 1 . . . . 55 ARG HA . 6964 1 587 . 1 1 55 55 ARG HB2 H 1 1.33 0.02 . 2 . . . . 55 ARG HB2 . 6964 1 588 . 1 1 55 55 ARG HB3 H 1 1.40 0.02 . 2 . . . . 55 ARG HB3 . 6964 1 589 . 1 1 55 55 ARG HG2 H 1 0.47 0.02 . 2 . . . . 55 ARG HG2 . 6964 1 590 . 1 1 55 55 ARG HG3 H 1 1.05 0.02 . 2 . . . . 55 ARG HG3 . 6964 1 591 . 1 1 55 55 ARG HD2 H 1 2.50 0.02 . 2 . . . . 55 ARG HD2 . 6964 1 592 . 1 1 55 55 ARG HD3 H 1 2.52 0.02 . 2 . . . . 55 ARG HD3 . 6964 1 593 . 1 1 55 55 ARG HE H 1 6.49 0.02 . 1 . . . . 55 ARG HE . 6964 1 594 . 1 1 55 55 ARG C C 13 176.9 0.2 . 1 . . . . 55 ARG C . 6964 1 595 . 1 1 55 55 ARG CA C 13 59.4 0.2 . 1 . . . . 55 ARG CA . 6964 1 596 . 1 1 55 55 ARG CB C 13 29.1 0.2 . 1 . . . . 55 ARG CB . 6964 1 597 . 1 1 55 55 ARG CG C 13 25.5 0.2 . 1 . . . . 55 ARG CG . 6964 1 598 . 1 1 55 55 ARG CD C 13 42.8 0.2 . 1 . . . . 55 ARG CD . 6964 1 599 . 1 1 55 55 ARG N N 15 117.3 0.2 . 1 . . . . 55 ARG N . 6964 1 600 . 1 1 55 55 ARG NE N 15 114.6 0.2 . 1 . . . . 55 ARG NE . 6964 1 601 . 1 1 56 56 TYR H H 1 7.71 0.02 . 1 . . . . 56 TYR H . 6964 1 602 . 1 1 56 56 TYR HA H 1 4.29 0.02 . 1 . . . . 56 TYR HA . 6964 1 603 . 1 1 56 56 TYR HB2 H 1 3.06 0.02 . 2 . . . . 56 TYR HB2 . 6964 1 604 . 1 1 56 56 TYR HB3 H 1 3.16 0.02 . 2 . . . . 56 TYR HB3 . 6964 1 605 . 1 1 56 56 TYR HD1 H 1 7.13 0.02 . 3 . . . . 56 TYR HD1 . 6964 1 606 . 1 1 56 56 TYR HE1 H 1 6.75 0.02 . 3 . . . . 56 TYR HE1 . 6964 1 607 . 1 1 56 56 TYR C C 13 180.0 0.2 . 1 . . . . 56 TYR C . 6964 1 608 . 1 1 56 56 TYR CA C 13 60.6 0.2 . 1 . . . . 56 TYR CA . 6964 1 609 . 1 1 56 56 TYR CB C 13 37.0 0.2 . 1 . . . . 56 TYR CB . 6964 1 610 . 1 1 56 56 TYR CD1 C 13 133.0 0.2 . 3 . . . . 56 TYR CD1 . 6964 1 611 . 1 1 56 56 TYR CE1 C 13 118.2 0.2 . 3 . . . . 56 TYR CE1 . 6964 1 612 . 1 1 56 56 TYR N N 15 119.6 0.2 . 1 . . . . 56 TYR N . 6964 1 613 . 1 1 57 57 SER H H 1 9.15 0.02 . 1 . . . . 57 SER H . 6964 1 614 . 1 1 57 57 SER HA H 1 4.56 0.02 . 1 . . . . 57 SER HA . 6964 1 615 . 1 1 57 57 SER HB2 H 1 4.11 0.02 . 1 . . . . 57 SER HB2 . 6964 1 616 . 1 1 57 57 SER HB3 H 1 4.18 0.02 . 1 . . . . 57 SER HB3 . 6964 1 617 . 1 1 57 57 SER C C 13 177.6 0.2 . 1 . . . . 57 SER C . 6964 1 618 . 1 1 57 57 SER CA C 13 60.5 0.2 . 1 . . . . 57 SER CA . 6964 1 619 . 1 1 57 57 SER CB C 13 62.9 0.2 . 1 . . . . 57 SER CB . 6964 1 620 . 1 1 57 57 SER N N 15 118.2 0.2 . 1 . . . . 57 SER N . 6964 1 621 . 1 1 58 58 LEU H H 1 7.64 0.02 . 1 . . . . 58 LEU H . 6964 1 622 . 1 1 58 58 LEU HA H 1 4.63 0.02 . 1 . . . . 58 LEU HA . 6964 1 623 . 1 1 58 58 LEU HB2 H 1 1.74 0.02 . 2 . . . . 58 LEU HB2 . 6964 1 624 . 1 1 58 58 LEU HB3 H 1 1.85 0.02 . 2 . . . . 58 LEU HB3 . 6964 1 625 . 1 1 58 58 LEU HG H 1 1.98 0.02 . 1 . . . . 58 LEU HG . 6964 1 626 . 1 1 58 58 LEU HD11 H 1 0.72 0.02 . 1 . . . . 58 LEU HD1 . 6964 1 627 . 1 1 58 58 LEU HD12 H 1 0.72 0.02 . 1 . . . . 58 LEU HD1 . 6964 1 628 . 1 1 58 58 LEU HD13 H 1 0.72 0.02 . 1 . . . . 58 LEU HD1 . 6964 1 629 . 1 1 58 58 LEU HD21 H 1 0.60 0.02 . 1 . . . . 58 LEU HD2 . 6964 1 630 . 1 1 58 58 LEU HD22 H 1 0.60 0.02 . 1 . . . . 58 LEU HD2 . 6964 1 631 . 1 1 58 58 LEU HD23 H 1 0.60 0.02 . 1 . . . . 58 LEU HD2 . 6964 1 632 . 1 1 58 58 LEU C C 13 177.2 0.2 . 1 . . . . 58 LEU C . 6964 1 633 . 1 1 58 58 LEU CA C 13 53.6 0.2 . 1 . . . . 58 LEU CA . 6964 1 634 . 1 1 58 58 LEU CB C 13 42.4 0.2 . 1 . . . . 58 LEU CB . 6964 1 635 . 1 1 58 58 LEU CG C 13 25.9 0.2 . 1 . . . . 58 LEU CG . 6964 1 636 . 1 1 58 58 LEU CD1 C 13 26.7 0.2 . 1 . . . . 58 LEU CD1 . 6964 1 637 . 1 1 58 58 LEU CD2 C 13 22.8 0.2 . 1 . . . . 58 LEU CD2 . 6964 1 638 . 1 1 58 58 LEU N N 15 121.4 0.2 . 1 . . . . 58 LEU N . 6964 1 639 . 1 1 59 59 GLN H H 1 7.66 0.02 . 1 . . . . 59 GLN H . 6964 1 640 . 1 1 59 59 GLN HA H 1 3.89 0.02 . 1 . . . . 59 GLN HA . 6964 1 641 . 1 1 59 59 GLN HB2 H 1 1.88 0.02 . 2 . . . . 59 GLN HB2 . 6964 1 642 . 1 1 59 59 GLN HB3 H 1 2.65 0.02 . 2 . . . . 59 GLN HB3 . 6964 1 643 . 1 1 59 59 GLN HG2 H 1 2.30 0.02 . 2 . . . . 59 GLN HG2 . 6964 1 644 . 1 1 59 59 GLN HG3 H 1 2.36 0.02 . 2 . . . . 59 GLN HG3 . 6964 1 645 . 1 1 59 59 GLN HE21 H 1 6.91 0.02 . 1 . . . . 59 GLN HE21 . 6964 1 646 . 1 1 59 59 GLN HE22 H 1 7.98 0.02 . 1 . . . . 59 GLN HE22 . 6964 1 647 . 1 1 59 59 GLN C C 13 176.5 0.2 . 1 . . . . 59 GLN C . 6964 1 648 . 1 1 59 59 GLN CA C 13 60.2 0.2 . 1 . . . . 59 GLN CA . 6964 1 649 . 1 1 59 59 GLN CB C 13 28.9 0.2 . 1 . . . . 59 GLN CB . 6964 1 650 . 1 1 59 59 GLN CG C 13 32.9 0.2 . 1 . . . . 59 GLN CG . 6964 1 651 . 1 1 59 59 GLN N N 15 124.7 0.2 . 1 . . . . 59 GLN N . 6964 1 652 . 1 1 59 59 GLN NE2 N 15 117.0 0.2 . 1 . . . . 59 GLN NE2 . 6964 1 653 . 1 1 60 60 ARG H H 1 8.89 0.02 . 1 . . . . 60 ARG H . 6964 1 654 . 1 1 60 60 ARG HA H 1 3.90 0.02 . 1 . . . . 60 ARG HA . 6964 1 655 . 1 1 60 60 ARG HB2 H 1 1.22 0.02 . 2 . . . . 60 ARG HB2 . 6964 1 656 . 1 1 60 60 ARG HB3 H 1 1.38 0.02 . 2 . . . . 60 ARG HB3 . 6964 1 657 . 1 1 60 60 ARG HG2 H 1 1.09 0.02 . 2 . . . . 60 ARG HG2 . 6964 1 658 . 1 1 60 60 ARG HG3 H 1 1.27 0.02 . 2 . . . . 60 ARG HG3 . 6964 1 659 . 1 1 60 60 ARG HD2 H 1 1.79 0.02 . 2 . . . . 60 ARG HD2 . 6964 1 660 . 1 1 60 60 ARG HD3 H 1 2.06 0.02 . 2 . . . . 60 ARG HD3 . 6964 1 661 . 1 1 60 60 ARG HE H 1 6.77 0.02 . 1 . . . . 60 ARG HE . 6964 1 662 . 1 1 60 60 ARG C C 13 179.4 0.2 . 1 . . . . 60 ARG C . 6964 1 663 . 1 1 60 60 ARG CA C 13 59.7 0.2 . 1 . . . . 60 ARG CA . 6964 1 664 . 1 1 60 60 ARG CB C 13 30.4 0.2 . 1 . . . . 60 ARG CB . 6964 1 665 . 1 1 60 60 ARG CG C 13 27.8 0.2 . 1 . . . . 60 ARG CG . 6964 1 666 . 1 1 60 60 ARG CD C 13 41.9 0.2 . 1 . . . . 60 ARG CD . 6964 1 667 . 1 1 60 60 ARG N N 15 115.5 0.2 . 1 . . . . 60 ARG N . 6964 1 668 . 1 1 60 60 ARG NE N 15 112.8 0.2 . 1 . . . . 60 ARG NE . 6964 1 669 . 1 1 61 61 VAL H H 1 7.57 0.02 . 1 . . . . 61 VAL H . 6964 1 670 . 1 1 61 61 VAL HA H 1 3.20 0.02 . 1 . . . . 61 VAL HA . 6964 1 671 . 1 1 61 61 VAL HB H 1 2.10 0.02 . 1 . . . . 61 VAL HB . 6964 1 672 . 1 1 61 61 VAL HG11 H 1 0.45 0.02 . 1 . . . . 61 VAL HG1 . 6964 1 673 . 1 1 61 61 VAL HG12 H 1 0.45 0.02 . 1 . . . . 61 VAL HG1 . 6964 1 674 . 1 1 61 61 VAL HG13 H 1 0.45 0.02 . 1 . . . . 61 VAL HG1 . 6964 1 675 . 1 1 61 61 VAL HG21 H 1 0.61 0.02 . 1 . . . . 61 VAL HG2 . 6964 1 676 . 1 1 61 61 VAL HG22 H 1 0.61 0.02 . 1 . . . . 61 VAL HG2 . 6964 1 677 . 1 1 61 61 VAL HG23 H 1 0.61 0.02 . 1 . . . . 61 VAL HG2 . 6964 1 678 . 1 1 61 61 VAL C C 13 177.1 0.2 . 1 . . . . 61 VAL C . 6964 1 679 . 1 1 61 61 VAL CA C 13 66.3 0.2 . 1 . . . . 61 VAL CA . 6964 1 680 . 1 1 61 61 VAL CB C 13 30.5 0.2 . 1 . . . . 61 VAL CB . 6964 1 681 . 1 1 61 61 VAL CG1 C 13 20.6 0.2 . 1 . . . . 61 VAL CG1 . 6964 1 682 . 1 1 61 61 VAL CG2 C 13 23.3 0.2 . 1 . . . . 61 VAL CG2 . 6964 1 683 . 1 1 61 61 VAL N N 15 116.6 0.2 . 1 . . . . 61 VAL N . 6964 1 684 . 1 1 62 62 PHE H H 1 7.23 0.02 . 1 . . . . 62 PHE H . 6964 1 685 . 1 1 62 62 PHE HA H 1 3.70 0.02 . 1 . . . . 62 PHE HA . 6964 1 686 . 1 1 62 62 PHE HB2 H 1 3.00 0.02 . 2 . . . . 62 PHE HB2 . 6964 1 687 . 1 1 62 62 PHE HB3 H 1 3.07 0.02 . 2 . . . . 62 PHE HB3 . 6964 1 688 . 1 1 62 62 PHE HD1 H 1 7.19 0.02 . 3 . . . . 62 PHE HD1 . 6964 1 689 . 1 1 62 62 PHE HE1 H 1 6.94 0.02 . 3 . . . . 62 PHE HE1 . 6964 1 690 . 1 1 62 62 PHE HZ H 1 6.79 0.02 . 1 . . . . 62 PHE HZ . 6964 1 691 . 1 1 62 62 PHE C C 13 179.5 0.2 . 1 . . . . 62 PHE C . 6964 1 692 . 1 1 62 62 PHE CA C 13 63.5 0.2 . 1 . . . . 62 PHE CA . 6964 1 693 . 1 1 62 62 PHE CB C 13 38.4 0.2 . 1 . . . . 62 PHE CB . 6964 1 694 . 1 1 62 62 PHE CD1 C 13 132.3 0.2 . 3 . . . . 62 PHE CD1 . 6964 1 695 . 1 1 62 62 PHE CE1 C 13 130.6 0.2 . 3 . . . . 62 PHE CE1 . 6964 1 696 . 1 1 62 62 PHE CZ C 13 128.0 0.2 . 1 . . . . 62 PHE CZ . 6964 1 697 . 1 1 62 62 PHE N N 15 117.3 0.2 . 1 . . . . 62 PHE N . 6964 1 698 . 1 1 63 63 ASP H H 1 8.68 0.02 . 1 . . . . 63 ASP H . 6964 1 699 . 1 1 63 63 ASP HA H 1 4.40 0.02 . 1 . . . . 63 ASP HA . 6964 1 700 . 1 1 63 63 ASP HB2 H 1 2.48 0.02 . 2 . . . . 63 ASP HB2 . 6964 1 701 . 1 1 63 63 ASP HB3 H 1 2.65 0.02 . 2 . . . . 63 ASP HB3 . 6964 1 702 . 1 1 63 63 ASP C C 13 176.6 0.2 . 1 . . . . 63 ASP C . 6964 1 703 . 1 1 63 63 ASP CA C 13 56.8 0.2 . 1 . . . . 63 ASP CA . 6964 1 704 . 1 1 63 63 ASP CB C 13 40.5 0.2 . 1 . . . . 63 ASP CB . 6964 1 705 . 1 1 63 63 ASP N N 15 118.5 0.2 . 1 . . . . 63 ASP N . 6964 1 706 . 1 1 64 64 ASN H H 1 7.15 0.02 . 1 . . . . 64 ASN H . 6964 1 707 . 1 1 64 64 ASN HA H 1 4.93 0.02 . 1 . . . . 64 ASN HA . 6964 1 708 . 1 1 64 64 ASN HB2 H 1 2.33 0.02 . 2 . . . . 64 ASN HB2 . 6964 1 709 . 1 1 64 64 ASN HB3 H 1 2.94 0.02 . 2 . . . . 64 ASN HB3 . 6964 1 710 . 1 1 64 64 ASN HD21 H 1 7.25 0.02 . 2 . . . . 64 ASN HD21 . 6964 1 711 . 1 1 64 64 ASN HD22 H 1 7.90 0.02 . 2 . . . . 64 ASN HD22 . 6964 1 712 . 1 1 64 64 ASN C C 13 175.0 0.2 . 1 . . . . 64 ASN C . 6964 1 713 . 1 1 64 64 ASN CA C 13 53.0 0.2 . 1 . . . . 64 ASN CA . 6964 1 714 . 1 1 64 64 ASN CB C 13 40.4 0.2 . 1 . . . . 64 ASN CB . 6964 1 715 . 1 1 64 64 ASN N N 15 116.9 0.2 . 1 . . . . 64 ASN N . 6964 1 716 . 1 1 64 64 ASN ND2 N 15 115.9 0.2 . 1 . . . . 64 ASN ND2 . 6964 1 717 . 1 1 65 65 ALA H H 1 7.16 0.02 . 1 . . . . 65 ALA H . 6964 1 718 . 1 1 65 65 ALA HA H 1 3.66 0.02 . 1 . . . . 65 ALA HA . 6964 1 719 . 1 1 65 65 ALA HB1 H 1 1.45 0.02 . 1 . . . . 65 ALA HB . 6964 1 720 . 1 1 65 65 ALA HB2 H 1 1.45 0.02 . 1 . . . . 65 ALA HB . 6964 1 721 . 1 1 65 65 ALA HB3 H 1 1.45 0.02 . 1 . . . . 65 ALA HB . 6964 1 722 . 1 1 65 65 ALA C C 13 177.8 0.2 . 1 . . . . 65 ALA C . 6964 1 723 . 1 1 65 65 ALA CA C 13 56.0 0.2 . 1 . . . . 65 ALA CA . 6964 1 724 . 1 1 65 65 ALA CB C 13 18.5 0.2 . 1 . . . . 65 ALA CB . 6964 1 725 . 1 1 65 65 ALA N N 15 122.4 0.2 . 1 . . . . 65 ALA N . 6964 1 726 . 1 1 66 66 ASN H H 1 8.37 0.02 . 1 . . . . 66 ASN H . 6964 1 727 . 1 1 66 66 ASN HA H 1 4.44 0.02 . 1 . . . . 66 ASN HA . 6964 1 728 . 1 1 66 66 ASN HB2 H 1 2.76 0.02 . 2 . . . . 66 ASN HB2 . 6964 1 729 . 1 1 66 66 ASN HB3 H 1 2.78 0.02 . 2 . . . . 66 ASN HB3 . 6964 1 730 . 1 1 66 66 ASN HD21 H 1 6.95 0.02 . 2 . . . . 66 ASN HD21 . 6964 1 731 . 1 1 66 66 ASN HD22 H 1 7.66 0.02 . 2 . . . . 66 ASN HD22 . 6964 1 732 . 1 1 66 66 ASN C C 13 175.6 0.2 . 1 . . . . 66 ASN C . 6964 1 733 . 1 1 66 66 ASN CA C 13 55.0 0.2 . 1 . . . . 66 ASN CA . 6964 1 734 . 1 1 66 66 ASN CB C 13 37.8 0.2 . 1 . . . . 66 ASN CB . 6964 1 735 . 1 1 66 66 ASN N N 15 112.2 0.2 . 1 . . . . 66 ASN N . 6964 1 736 . 1 1 66 66 ASN ND2 N 15 113.2 0.2 . 1 . . . . 66 ASN ND2 . 6964 1 737 . 1 1 67 67 ALA H H 1 7.89 0.02 . 1 . . . . 67 ALA H . 6964 1 738 . 1 1 67 67 ALA HA H 1 4.43 0.02 . 1 . . . . 67 ALA HA . 6964 1 739 . 1 1 67 67 ALA HB1 H 1 1.40 0.02 . 1 . . . . 67 ALA HB . 6964 1 740 . 1 1 67 67 ALA HB2 H 1 1.40 0.02 . 1 . . . . 67 ALA HB . 6964 1 741 . 1 1 67 67 ALA HB3 H 1 1.40 0.02 . 1 . . . . 67 ALA HB . 6964 1 742 . 1 1 67 67 ALA C C 13 175.7 0.2 . 1 . . . . 67 ALA C . 6964 1 743 . 1 1 67 67 ALA CA C 13 51.8 0.2 . 1 . . . . 67 ALA CA . 6964 1 744 . 1 1 67 67 ALA CB C 13 20.5 0.2 . 1 . . . . 67 ALA CB . 6964 1 745 . 1 1 67 67 ALA N N 15 121.0 0.2 . 1 . . . . 67 ALA N . 6964 1 746 . 1 1 68 68 ILE H H 1 7.26 0.02 . 1 . . . . 68 ILE H . 6964 1 747 . 1 1 68 68 ILE HA H 1 3.99 0.02 . 1 . . . . 68 ILE HA . 6964 1 748 . 1 1 68 68 ILE HB H 1 1.44 0.02 . 1 . . . . 68 ILE HB . 6964 1 749 . 1 1 68 68 ILE HG12 H 1 0.61 0.02 . 2 . . . . 68 ILE HG12 . 6964 1 750 . 1 1 68 68 ILE HG13 H 1 1.45 0.02 . 2 . . . . 68 ILE HG13 . 6964 1 751 . 1 1 68 68 ILE HG21 H 1 0.58 0.02 . 1 . . . . 68 ILE HG2 . 6964 1 752 . 1 1 68 68 ILE HG22 H 1 0.58 0.02 . 1 . . . . 68 ILE HG2 . 6964 1 753 . 1 1 68 68 ILE HG23 H 1 0.58 0.02 . 1 . . . . 68 ILE HG2 . 6964 1 754 . 1 1 68 68 ILE HD11 H 1 0.56 0.02 . 1 . . . . 68 ILE HD1 . 6964 1 755 . 1 1 68 68 ILE HD12 H 1 0.56 0.02 . 1 . . . . 68 ILE HD1 . 6964 1 756 . 1 1 68 68 ILE HD13 H 1 0.56 0.02 . 1 . . . . 68 ILE HD1 . 6964 1 757 . 1 1 68 68 ILE C C 13 172.4 0.2 . 1 . . . . 68 ILE C . 6964 1 758 . 1 1 68 68 ILE CA C 13 60.4 0.2 . 1 . . . . 68 ILE CA . 6964 1 759 . 1 1 68 68 ILE CB C 13 42.9 0.2 . 1 . . . . 68 ILE CB . 6964 1 760 . 1 1 68 68 ILE CG1 C 13 26.0 0.2 . 1 . . . . 68 ILE CG1 . 6964 1 761 . 1 1 68 68 ILE CG2 C 13 18.7 0.2 . 1 . . . . 68 ILE CG2 . 6964 1 762 . 1 1 68 68 ILE CD1 C 13 15.2 0.2 . 1 . . . . 68 ILE CD1 . 6964 1 763 . 1 1 68 68 ILE N N 15 114.6 0.2 . 1 . . . . 68 ILE N . 6964 1 764 . 1 1 69 69 ASP H H 1 8.53 0.02 . 1 . . . . 69 ASP H . 6964 1 765 . 1 1 69 69 ASP HA H 1 5.18 0.02 . 1 . . . . 69 ASP HA . 6964 1 766 . 1 1 69 69 ASP HB2 H 1 2.75 0.02 . 2 . . . . 69 ASP HB2 . 6964 1 767 . 1 1 69 69 ASP HB3 H 1 2.86 0.02 . 2 . . . . 69 ASP HB3 . 6964 1 768 . 1 1 69 69 ASP C C 13 176.9 0.2 . 1 . . . . 69 ASP C . 6964 1 769 . 1 1 69 69 ASP CA C 13 55.0 0.2 . 1 . . . . 69 ASP CA . 6964 1 770 . 1 1 69 69 ASP CB C 13 43.0 0.2 . 1 . . . . 69 ASP CB . 6964 1 771 . 1 1 69 69 ASP N N 15 118.3 0.2 . 1 . . . . 69 ASP N . 6964 1 772 . 1 1 70 70 THR H H 1 7.45 0.02 . 1 . . . . 70 THR H . 6964 1 773 . 1 1 70 70 THR HA H 1 4.89 0.02 . 1 . . . . 70 THR HA . 6964 1 774 . 1 1 70 70 THR HB H 1 3.66 0.02 . 1 . . . . 70 THR HB . 6964 1 775 . 1 1 70 70 THR HG21 H 1 0.98 0.02 . 1 . . . . 70 THR HG2 . 6964 1 776 . 1 1 70 70 THR HG22 H 1 0.98 0.02 . 1 . . . . 70 THR HG2 . 6964 1 777 . 1 1 70 70 THR HG23 H 1 0.98 0.02 . 1 . . . . 70 THR HG2 . 6964 1 778 . 1 1 70 70 THR C C 13 170.9 0.2 . 1 . . . . 70 THR C . 6964 1 779 . 1 1 70 70 THR CA C 13 61.9 0.2 . 1 . . . . 70 THR CA . 6964 1 780 . 1 1 70 70 THR CB C 13 72.7 0.2 . 1 . . . . 70 THR CB . 6964 1 781 . 1 1 70 70 THR CG2 C 13 21.1 0.2 . 1 . . . . 70 THR CG2 . 6964 1 782 . 1 1 70 70 THR N N 15 116.5 0.2 . 1 . . . . 70 THR N . 6964 1 783 . 1 1 71 71 LEU H H 1 9.26 0.02 . 1 . . . . 71 LEU H . 6964 1 784 . 1 1 71 71 LEU HA H 1 4.83 0.02 . 1 . . . . 71 LEU HA . 6964 1 785 . 1 1 71 71 LEU HB2 H 1 0.73 0.02 . 2 . . . . 71 LEU HB2 . 6964 1 786 . 1 1 71 71 LEU HB3 H 1 1.58 0.02 . 2 . . . . 71 LEU HB3 . 6964 1 787 . 1 1 71 71 LEU HG H 1 1.17 0.02 . 1 . . . . 71 LEU HG . 6964 1 788 . 1 1 71 71 LEU HD11 H 1 0.51 0.02 . 1 . . . . 71 LEU HD1 . 6964 1 789 . 1 1 71 71 LEU HD12 H 1 0.51 0.02 . 1 . . . . 71 LEU HD1 . 6964 1 790 . 1 1 71 71 LEU HD13 H 1 0.51 0.02 . 1 . . . . 71 LEU HD1 . 6964 1 791 . 1 1 71 71 LEU HD21 H 1 0.61 0.02 . 1 . . . . 71 LEU HD2 . 6964 1 792 . 1 1 71 71 LEU HD22 H 1 0.61 0.02 . 1 . . . . 71 LEU HD2 . 6964 1 793 . 1 1 71 71 LEU HD23 H 1 0.61 0.02 . 1 . . . . 71 LEU HD2 . 6964 1 794 . 1 1 71 71 LEU C C 13 173.6 0.2 . 1 . . . . 71 LEU C . 6964 1 795 . 1 1 71 71 LEU CA C 13 52.6 0.2 . 1 . . . . 71 LEU CA . 6964 1 796 . 1 1 71 71 LEU CB C 13 44.9 0.2 . 1 . . . . 71 LEU CB . 6964 1 797 . 1 1 71 71 LEU CG C 13 27.4 0.2 . 1 . . . . 71 LEU CG . 6964 1 798 . 1 1 71 71 LEU CD1 C 13 23.3 0.2 . 1 . . . . 71 LEU CD1 . 6964 1 799 . 1 1 71 71 LEU CD2 C 13 27.4 0.2 . 1 . . . . 71 LEU CD2 . 6964 1 800 . 1 1 71 71 LEU N N 15 127.6 0.2 . 1 . . . . 71 LEU N . 6964 1 801 . 1 1 72 72 ILE H H 1 9.00 0.02 . 1 . . . . 72 ILE H . 6964 1 802 . 1 1 72 72 ILE HA H 1 4.81 0.02 . 1 . . . . 72 ILE HA . 6964 1 803 . 1 1 72 72 ILE HB H 1 1.71 0.02 . 1 . . . . 72 ILE HB . 6964 1 804 . 1 1 72 72 ILE HG12 H 1 0.99 0.02 . 2 . . . . 72 ILE HG12 . 6964 1 805 . 1 1 72 72 ILE HG13 H 1 1.53 0.02 . 2 . . . . 72 ILE HG13 . 6964 1 806 . 1 1 72 72 ILE HG21 H 1 0.83 0.02 . 1 . . . . 72 ILE HG2 . 6964 1 807 . 1 1 72 72 ILE HG22 H 1 0.83 0.02 . 1 . . . . 72 ILE HG2 . 6964 1 808 . 1 1 72 72 ILE HG23 H 1 0.83 0.02 . 1 . . . . 72 ILE HG2 . 6964 1 809 . 1 1 72 72 ILE HD11 H 1 0.91 0.02 . 1 . . . . 72 ILE HD1 . 6964 1 810 . 1 1 72 72 ILE HD12 H 1 0.91 0.02 . 1 . . . . 72 ILE HD1 . 6964 1 811 . 1 1 72 72 ILE HD13 H 1 0.91 0.02 . 1 . . . . 72 ILE HD1 . 6964 1 812 . 1 1 72 72 ILE C C 13 175.5 0.2 . 1 . . . . 72 ILE C . 6964 1 813 . 1 1 72 72 ILE CA C 13 59.4 0.2 . 1 . . . . 72 ILE CA . 6964 1 814 . 1 1 72 72 ILE CB C 13 39.7 0.2 . 1 . . . . 72 ILE CB . 6964 1 815 . 1 1 72 72 ILE CG1 C 13 27.6 0.2 . 1 . . . . 72 ILE CG1 . 6964 1 816 . 1 1 72 72 ILE CG2 C 13 17.7 0.2 . 1 . . . . 72 ILE CG2 . 6964 1 817 . 1 1 72 72 ILE CD1 C 13 14.8 0.2 . 1 . . . . 72 ILE CD1 . 6964 1 818 . 1 1 72 72 ILE N N 15 128.2 0.2 . 1 . . . . 72 ILE N . 6964 1 819 . 1 1 73 73 VAL H H 1 8.89 0.02 . 1 . . . . 73 VAL H . 6964 1 820 . 1 1 73 73 VAL HA H 1 5.01 0.02 . 1 . . . . 73 VAL HA . 6964 1 821 . 1 1 73 73 VAL HB H 1 1.97 0.02 . 1 . . . . 73 VAL HB . 6964 1 822 . 1 1 73 73 VAL HG11 H 1 0.98 0.02 . 1 . . . . 73 VAL HG1 . 6964 1 823 . 1 1 73 73 VAL HG12 H 1 0.98 0.02 . 1 . . . . 73 VAL HG1 . 6964 1 824 . 1 1 73 73 VAL HG13 H 1 0.98 0.02 . 1 . . . . 73 VAL HG1 . 6964 1 825 . 1 1 73 73 VAL HG21 H 1 0.85 0.02 . 1 . . . . 73 VAL HG2 . 6964 1 826 . 1 1 73 73 VAL HG22 H 1 0.85 0.02 . 1 . . . . 73 VAL HG2 . 6964 1 827 . 1 1 73 73 VAL HG23 H 1 0.85 0.02 . 1 . . . . 73 VAL HG2 . 6964 1 828 . 1 1 73 73 VAL C C 13 174.6 0.2 . 1 . . . . 73 VAL C . 6964 1 829 . 1 1 73 73 VAL CA C 13 60.5 0.2 . 1 . . . . 73 VAL CA . 6964 1 830 . 1 1 73 73 VAL CB C 13 34.3 0.2 . 1 . . . . 73 VAL CB . 6964 1 831 . 1 1 73 73 VAL CG1 C 13 21.7 0.2 . 1 . . . . 73 VAL CG1 . 6964 1 832 . 1 1 73 73 VAL CG2 C 13 22.9 0.2 . 1 . . . . 73 VAL CG2 . 6964 1 833 . 1 1 73 73 VAL N N 15 128.1 0.2 . 1 . . . . 73 VAL N . 6964 1 834 . 1 1 74 74 GLY H H 1 9.35 0.02 . 1 . . . . 74 GLY H . 6964 1 835 . 1 1 74 74 GLY HA2 H 1 3.16 0.02 . 2 . . . . 74 GLY HA2 . 6964 1 836 . 1 1 74 74 GLY HA3 H 1 5.10 0.02 . 2 . . . . 74 GLY HA3 . 6964 1 837 . 1 1 74 74 GLY C C 13 175.1 0.2 . 1 . . . . 74 GLY C . 6964 1 838 . 1 1 74 74 GLY CA C 13 44.8 0.2 . 1 . . . . 74 GLY CA . 6964 1 839 . 1 1 74 74 GLY N N 15 114.6 0.2 . 1 . . . . 74 GLY N . 6964 1 840 . 1 1 75 75 THR H H 1 9.63 0.02 . 1 . . . . 75 THR H . 6964 1 841 . 1 1 75 75 THR HA H 1 3.80 0.02 . 1 . . . . 75 THR HA . 6964 1 842 . 1 1 75 75 THR HB H 1 4.60 0.02 . 1 . . . . 75 THR HB . 6964 1 843 . 1 1 75 75 THR HG21 H 1 1.41 0.02 . 1 . . . . 75 THR HG2 . 6964 1 844 . 1 1 75 75 THR HG22 H 1 1.41 0.02 . 1 . . . . 75 THR HG2 . 6964 1 845 . 1 1 75 75 THR HG23 H 1 1.41 0.02 . 1 . . . . 75 THR HG2 . 6964 1 846 . 1 1 75 75 THR C C 13 173.3 0.2 . 1 . . . . 75 THR C . 6964 1 847 . 1 1 75 75 THR CA C 13 62.6 0.2 . 1 . . . . 75 THR CA . 6964 1 848 . 1 1 75 75 THR CB C 13 67.8 0.2 . 1 . . . . 75 THR CB . 6964 1 849 . 1 1 75 75 THR CG2 C 13 23.0 0.2 . 1 . . . . 75 THR CG2 . 6964 1 850 . 1 1 75 75 THR N N 15 115.5 0.2 . 1 . . . . 75 THR N . 6964 1 851 . 1 1 76 76 GLY H H 1 8.43 0.02 . 1 . . . . 76 GLY H . 6964 1 852 . 1 1 76 76 GLY HA2 H 1 3.31 0.02 . 2 . . . . 76 GLY HA2 . 6964 1 853 . 1 1 76 76 GLY HA3 H 1 4.19 0.02 . 2 . . . . 76 GLY HA3 . 6964 1 854 . 1 1 76 76 GLY C C 13 174.6 0.2 . 1 . . . . 76 GLY C . 6964 1 855 . 1 1 76 76 GLY CA C 13 44.7 0.2 . 1 . . . . 76 GLY CA . 6964 1 856 . 1 1 76 76 GLY N N 15 111.7 0.2 . 1 . . . . 76 GLY N . 6964 1 857 . 1 1 77 77 ALA H H 1 9.15 0.02 . 1 . . . . 77 ALA H . 6964 1 858 . 1 1 77 77 ALA HA H 1 4.48 0.02 . 1 . . . . 77 ALA HA . 6964 1 859 . 1 1 77 77 ALA HB1 H 1 1.43 0.02 . 1 . . . . 77 ALA HB . 6964 1 860 . 1 1 77 77 ALA HB2 H 1 1.43 0.02 . 1 . . . . 77 ALA HB . 6964 1 861 . 1 1 77 77 ALA HB3 H 1 1.43 0.02 . 1 . . . . 77 ALA HB . 6964 1 862 . 1 1 77 77 ALA C C 13 177.2 0.2 . 1 . . . . 77 ALA C . 6964 1 863 . 1 1 77 77 ALA CA C 13 52.8 0.2 . 1 . . . . 77 ALA CA . 6964 1 864 . 1 1 77 77 ALA CB C 13 19.7 0.2 . 1 . . . . 77 ALA CB . 6964 1 865 . 1 1 77 77 ALA N N 15 128.3 0.2 . 1 . . . . 77 ALA N . 6964 1 866 . 1 1 78 78 ASP H H 1 8.05 0.02 . 1 . . . . 78 ASP H . 6964 1 867 . 1 1 78 78 ASP HA H 1 4.99 0.02 . 1 . . . . 78 ASP HA . 6964 1 868 . 1 1 78 78 ASP HB2 H 1 2.63 0.02 . 2 . . . . 78 ASP HB2 . 6964 1 869 . 1 1 78 78 ASP HB3 H 1 2.78 0.02 . 2 . . . . 78 ASP HB3 . 6964 1 870 . 1 1 78 78 ASP CA C 13 53.1 0.2 . 1 . . . . 78 ASP CA . 6964 1 871 . 1 1 78 78 ASP CB C 13 43.6 0.2 . 1 . . . . 78 ASP CB . 6964 1 872 . 1 1 78 78 ASP N N 15 118.1 0.2 . 1 . . . . 78 ASP N . 6964 1 873 . 1 1 79 79 VAL H H 1 8.57 0.02 . 1 . . . . 79 VAL H . 6964 1 874 . 1 1 79 79 VAL HA H 1 4.08 0.02 . 1 . . . . 79 VAL HA . 6964 1 875 . 1 1 79 79 VAL HB H 1 1.91 0.02 . 1 . . . . 79 VAL HB . 6964 1 876 . 1 1 79 79 VAL HG11 H 1 0.84 0.02 . 1 . . . . 79 VAL HG1 . 6964 1 877 . 1 1 79 79 VAL HG12 H 1 0.84 0.02 . 1 . . . . 79 VAL HG1 . 6964 1 878 . 1 1 79 79 VAL HG13 H 1 0.84 0.02 . 1 . . . . 79 VAL HG1 . 6964 1 879 . 1 1 79 79 VAL HG21 H 1 0.96 0.02 . 1 . . . . 79 VAL HG2 . 6964 1 880 . 1 1 79 79 VAL HG22 H 1 0.96 0.02 . 1 . . . . 79 VAL HG2 . 6964 1 881 . 1 1 79 79 VAL HG23 H 1 0.96 0.02 . 1 . . . . 79 VAL HG2 . 6964 1 882 . 1 1 79 79 VAL C C 13 175.5 0.2 . 1 . . . . 79 VAL C . 6964 1 883 . 1 1 79 79 VAL CA C 13 62.6 0.2 . 1 . . . . 79 VAL CA . 6964 1 884 . 1 1 79 79 VAL CB C 13 32.3 0.2 . 1 . . . . 79 VAL CB . 6964 1 885 . 1 1 79 79 VAL CG1 C 13 21.0 0.2 . 2 . . . . 79 VAL CG1 . 6964 1 886 . 1 1 79 79 VAL CG2 C 13 21.2 0.2 . 2 . . . . 79 VAL CG2 . 6964 1 887 . 1 1 79 79 VAL N N 15 120.5 0.2 . 1 . . . . 79 VAL N . 6964 1 888 . 1 1 80 80 TRP H H 1 8.16 0.02 . 1 . . . . 80 TRP H . 6964 1 889 . 1 1 80 80 TRP HA H 1 4.72 0.02 . 1 . . . . 80 TRP HA . 6964 1 890 . 1 1 80 80 TRP HB2 H 1 2.92 0.02 . 2 . . . . 80 TRP HB2 . 6964 1 891 . 1 1 80 80 TRP HB3 H 1 3.04 0.02 . 2 . . . . 80 TRP HB3 . 6964 1 892 . 1 1 80 80 TRP HD1 H 1 7.29 0.02 . 1 . . . . 80 TRP HD1 . 6964 1 893 . 1 1 80 80 TRP HE1 H 1 10.10 0.02 . 1 . . . . 80 TRP HE1 . 6964 1 894 . 1 1 80 80 TRP HE3 H 1 7.21 0.02 . 1 . . . . 80 TRP HE3 . 6964 1 895 . 1 1 80 80 TRP HZ2 H 1 7.49 0.02 . 1 . . . . 80 TRP HZ2 . 6964 1 896 . 1 1 80 80 TRP HZ3 H 1 6.62 0.02 . 1 . . . . 80 TRP HZ3 . 6964 1 897 . 1 1 80 80 TRP HH2 H 1 6.87 0.02 . 1 . . . . 80 TRP HH2 . 6964 1 898 . 1 1 80 80 TRP C C 13 173.4 0.2 . 1 . . . . 80 TRP C . 6964 1 899 . 1 1 80 80 TRP CA C 13 57.4 0.2 . 1 . . . . 80 TRP CA . 6964 1 900 . 1 1 80 80 TRP CB C 13 32.5 0.2 . 1 . . . . 80 TRP CB . 6964 1 901 . 1 1 80 80 TRP CD1 C 13 127.5 0.2 . 1 . . . . 80 TRP CD1 . 6964 1 902 . 1 1 80 80 TRP CE3 C 13 120.0 0.2 . 1 . . . . 80 TRP CE3 . 6964 1 903 . 1 1 80 80 TRP CZ2 C 13 115.9 0.2 . 1 . . . . 80 TRP CZ2 . 6964 1 904 . 1 1 80 80 TRP CZ3 C 13 119.6 0.2 . 1 . . . . 80 TRP CZ3 . 6964 1 905 . 1 1 80 80 TRP CH2 C 13 121.9 0.2 . 1 . . . . 80 TRP CH2 . 6964 1 906 . 1 1 80 80 TRP N N 15 128.9 0.2 . 1 . . . . 80 TRP N . 6964 1 907 . 1 1 80 80 TRP NE1 N 15 131.1 0.2 . 1 . . . . 80 TRP NE1 . 6964 1 908 . 1 1 81 81 ILE H H 1 7.64 0.02 . 1 . . . . 81 ILE H . 6964 1 909 . 1 1 81 81 ILE HA H 1 3.93 0.02 . 1 . . . . 81 ILE HA . 6964 1 910 . 1 1 81 81 ILE HB H 1 1.42 0.02 . 1 . . . . 81 ILE HB . 6964 1 911 . 1 1 81 81 ILE HG12 H 1 1.01 0.02 . 2 . . . . 81 ILE HG12 . 6964 1 912 . 1 1 81 81 ILE HG13 H 1 1.24 0.02 . 2 . . . . 81 ILE HG13 . 6964 1 913 . 1 1 81 81 ILE HG21 H 1 0.63 0.02 . 1 . . . . 81 ILE HG2 . 6964 1 914 . 1 1 81 81 ILE HG22 H 1 0.63 0.02 . 1 . . . . 81 ILE HG2 . 6964 1 915 . 1 1 81 81 ILE HG23 H 1 0.63 0.02 . 1 . . . . 81 ILE HG2 . 6964 1 916 . 1 1 81 81 ILE HD11 H 1 0.66 0.02 . 1 . . . . 81 ILE HD1 . 6964 1 917 . 1 1 81 81 ILE HD12 H 1 0.66 0.02 . 1 . . . . 81 ILE HD1 . 6964 1 918 . 1 1 81 81 ILE HD13 H 1 0.66 0.02 . 1 . . . . 81 ILE HD1 . 6964 1 919 . 1 1 81 81 ILE C C 13 173.9 0.2 . 1 . . . . 81 ILE C . 6964 1 920 . 1 1 81 81 ILE CA C 13 58.3 0.2 . 1 . . . . 81 ILE CA . 6964 1 921 . 1 1 81 81 ILE CB C 13 38.1 0.2 . 1 . . . . 81 ILE CB . 6964 1 922 . 1 1 81 81 ILE CG1 C 13 26.8 0.2 . 1 . . . . 81 ILE CG1 . 6964 1 923 . 1 1 81 81 ILE CG2 C 13 17.0 0.2 . 1 . . . . 81 ILE CG2 . 6964 1 924 . 1 1 81 81 ILE CD1 C 13 11.7 0.2 . 1 . . . . 81 ILE CD1 . 6964 1 925 . 1 1 81 81 ILE N N 15 128.4 0.2 . 1 . . . . 81 ILE N . 6964 1 926 . 1 1 82 82 ALA H H 1 8.27 0.02 . 1 . . . . 82 ALA H . 6964 1 927 . 1 1 82 82 ALA HA H 1 2.95 0.02 . 1 . . . . 82 ALA HA . 6964 1 928 . 1 1 82 82 ALA HB1 H 1 0.94 0.02 . 1 . . . . 82 ALA HB . 6964 1 929 . 1 1 82 82 ALA HB2 H 1 0.94 0.02 . 1 . . . . 82 ALA HB . 6964 1 930 . 1 1 82 82 ALA HB3 H 1 0.94 0.02 . 1 . . . . 82 ALA HB . 6964 1 931 . 1 1 82 82 ALA CA C 13 49.6 0.2 . 1 . . . . 82 ALA CA . 6964 1 932 . 1 1 82 82 ALA CB C 13 18.6 0.2 . 1 . . . . 82 ALA CB . 6964 1 933 . 1 1 82 82 ALA N N 15 129.4 0.2 . 1 . . . . 82 ALA N . 6964 1 934 . 1 1 83 83 PRO HA H 1 4.38 0.02 . 1 . . . . 83 PRO HA . 6964 1 935 . 1 1 83 83 PRO HB2 H 1 1.97 0.02 . 2 . . . . 83 PRO HB2 . 6964 1 936 . 1 1 83 83 PRO HB3 H 1 2.47 0.02 . 2 . . . . 83 PRO HB3 . 6964 1 937 . 1 1 83 83 PRO HG2 H 1 2.19 0.02 . 2 . . . . 83 PRO HG2 . 6964 1 938 . 1 1 83 83 PRO HG3 H 1 2.24 0.02 . 2 . . . . 83 PRO HG3 . 6964 1 939 . 1 1 83 83 PRO HD2 H 1 3.40 0.02 . 2 . . . . 83 PRO HD2 . 6964 1 940 . 1 1 83 83 PRO HD3 H 1 3.76 0.02 . 2 . . . . 83 PRO HD3 . 6964 1 941 . 1 1 83 83 PRO C C 13 177.7 0.2 . 1 . . . . 83 PRO C . 6964 1 942 . 1 1 83 83 PRO CA C 13 62.2 0.2 . 1 . . . . 83 PRO CA . 6964 1 943 . 1 1 83 83 PRO CB C 13 32.4 0.2 . 1 . . . . 83 PRO CB . 6964 1 944 . 1 1 83 83 PRO CG C 13 27.8 0.2 . 1 . . . . 83 PRO CG . 6964 1 945 . 1 1 83 83 PRO CD C 13 52.0 0.2 . 1 . . . . 83 PRO CD . 6964 1 946 . 1 1 84 84 ARG H H 1 8.88 0.02 . 1 . . . . 84 ARG H . 6964 1 947 . 1 1 84 84 ARG HA H 1 3.88 0.02 . 1 . . . . 84 ARG HA . 6964 1 948 . 1 1 84 84 ARG HB2 H 1 1.73 0.02 . 2 . . . . 84 ARG HB2 . 6964 1 949 . 1 1 84 84 ARG HB3 H 1 1.91 0.02 . 2 . . . . 84 ARG HB3 . 6964 1 950 . 1 1 84 84 ARG C C 13 178.2 0.2 . 1 . . . . 84 ARG C . 6964 1 951 . 1 1 84 84 ARG CA C 13 59.7 0.2 . 1 . . . . 84 ARG CA . 6964 1 952 . 1 1 84 84 ARG CB C 13 29.8 0.2 . 1 . . . . 84 ARG CB . 6964 1 953 . 1 1 84 84 ARG CG C 13 27.1 0.2 . 1 . . . . 84 ARG CG . 6964 1 954 . 1 1 84 84 ARG CD C 13 43.3 0.2 . 1 . . . . 84 ARG CD . 6964 1 955 . 1 1 84 84 ARG N N 15 125.5 0.2 . 1 . . . . 84 ARG N . 6964 1 956 . 1 1 85 85 GLN H H 1 9.18 0.02 . 1 . . . . 85 GLN H . 6964 1 957 . 1 1 85 85 GLN HA H 1 4.06 0.02 . 1 . . . . 85 GLN HA . 6964 1 958 . 1 1 85 85 GLN HB2 H 1 2.00 0.02 . 2 . . . . 85 GLN HB2 . 6964 1 959 . 1 1 85 85 GLN HB3 H 1 2.10 0.02 . 2 . . . . 85 GLN HB3 . 6964 1 960 . 1 1 85 85 GLN HG2 H 1 2.46 0.02 . 2 . . . . 85 GLN HG2 . 6964 1 961 . 1 1 85 85 GLN HG3 H 1 2.50 0.02 . 2 . . . . 85 GLN HG3 . 6964 1 962 . 1 1 85 85 GLN C C 13 179.0 0.2 . 1 . . . . 85 GLN C . 6964 1 963 . 1 1 85 85 GLN CA C 13 59.4 0.2 . 1 . . . . 85 GLN CA . 6964 1 964 . 1 1 85 85 GLN CB C 13 27.8 0.2 . 1 . . . . 85 GLN CB . 6964 1 965 . 1 1 85 85 GLN CG C 13 34.1 0.2 . 1 . . . . 85 GLN CG . 6964 1 966 . 1 1 85 85 GLN N N 15 115.6 0.2 . 1 . . . . 85 GLN N . 6964 1 967 . 1 1 86 86 LEU H H 1 7.14 0.02 . 1 . . . . 86 LEU H . 6964 1 968 . 1 1 86 86 LEU HA H 1 4.32 0.02 . 1 . . . . 86 LEU HA . 6964 1 969 . 1 1 86 86 LEU HB2 H 1 1.81 0.02 . 2 . . . . 86 LEU HB2 . 6964 1 970 . 1 1 86 86 LEU HB3 H 1 1.86 0.02 . 2 . . . . 86 LEU HB3 . 6964 1 971 . 1 1 86 86 LEU HG H 1 1.51 0.02 . 1 . . . . 86 LEU HG . 6964 1 972 . 1 1 86 86 LEU HD11 H 1 0.94 0.02 . 1 . . . . 86 LEU HD1 . 6964 1 973 . 1 1 86 86 LEU HD12 H 1 0.94 0.02 . 1 . . . . 86 LEU HD1 . 6964 1 974 . 1 1 86 86 LEU HD13 H 1 0.94 0.02 . 1 . . . . 86 LEU HD1 . 6964 1 975 . 1 1 86 86 LEU HD21 H 1 1.02 0.02 . 1 . . . . 86 LEU HD2 . 6964 1 976 . 1 1 86 86 LEU HD22 H 1 1.02 0.02 . 1 . . . . 86 LEU HD2 . 6964 1 977 . 1 1 86 86 LEU HD23 H 1 1.02 0.02 . 1 . . . . 86 LEU HD2 . 6964 1 978 . 1 1 86 86 LEU C C 13 177.8 0.2 . 1 . . . . 86 LEU C . 6964 1 979 . 1 1 86 86 LEU CA C 13 57.3 0.2 . 1 . . . . 86 LEU CA . 6964 1 980 . 1 1 86 86 LEU CB C 13 41.9 0.2 . 1 . . . . 86 LEU CB . 6964 1 981 . 1 1 86 86 LEU CG C 13 27.5 0.2 . 1 . . . . 86 LEU CG . 6964 1 982 . 1 1 86 86 LEU CD1 C 13 21.8 0.2 . 1 . . . . 86 LEU CD1 . 6964 1 983 . 1 1 86 86 LEU CD2 C 13 26.2 0.2 . 1 . . . . 86 LEU CD2 . 6964 1 984 . 1 1 86 86 LEU N N 15 120.8 0.2 . 1 . . . . 86 LEU N . 6964 1 985 . 1 1 87 87 ARG H H 1 7.40 0.02 . 1 . . . . 87 ARG H . 6964 1 986 . 1 1 87 87 ARG HA H 1 3.72 0.02 . 1 . . . . 87 ARG HA . 6964 1 987 . 1 1 87 87 ARG HB2 H 1 1.72 0.02 . 2 . . . . 87 ARG HB2 . 6964 1 988 . 1 1 87 87 ARG HB3 H 1 1.91 0.02 . 2 . . . . 87 ARG HB3 . 6964 1 989 . 1 1 87 87 ARG C C 13 179.8 0.2 . 1 . . . . 87 ARG C . 6964 1 990 . 1 1 87 87 ARG CA C 13 60.8 0.2 . 1 . . . . 87 ARG CA . 6964 1 991 . 1 1 87 87 ARG CB C 13 30.0 0.2 . 1 . . . . 87 ARG CB . 6964 1 992 . 1 1 87 87 ARG CG C 13 28.3 0.2 . 1 . . . . 87 ARG CG . 6964 1 993 . 1 1 87 87 ARG CD C 13 42.9 0.2 . 1 . . . . 87 ARG CD . 6964 1 994 . 1 1 87 87 ARG N N 15 118.9 0.2 . 1 . . . . 87 ARG N . 6964 1 995 . 1 1 88 88 GLU H H 1 8.93 0.02 . 1 . . . . 88 GLU H . 6964 1 996 . 1 1 88 88 GLU HA H 1 4.05 0.02 . 1 . . . . 88 GLU HA . 6964 1 997 . 1 1 88 88 GLU HB2 H 1 2.00 0.02 . 2 . . . . 88 GLU HB2 . 6964 1 998 . 1 1 88 88 GLU HB3 H 1 2.07 0.02 . 2 . . . . 88 GLU HB3 . 6964 1 999 . 1 1 88 88 GLU HG2 H 1 2.27 0.02 . 2 . . . . 88 GLU HG2 . 6964 1 1000 . 1 1 88 88 GLU HG3 H 1 2.36 0.02 . 2 . . . . 88 GLU HG3 . 6964 1 1001 . 1 1 88 88 GLU C C 13 179.0 0.2 . 1 . . . . 88 GLU C . 6964 1 1002 . 1 1 88 88 GLU CA C 13 59.0 0.2 . 1 . . . . 88 GLU CA . 6964 1 1003 . 1 1 88 88 GLU CB C 13 29.3 0.2 . 1 . . . . 88 GLU CB . 6964 1 1004 . 1 1 88 88 GLU CG C 13 36.5 0.2 . 1 . . . . 88 GLU CG . 6964 1 1005 . 1 1 88 88 GLU N N 15 118.5 0.2 . 1 . . . . 88 GLU N . 6964 1 1006 . 1 1 89 89 ALA H H 1 7.91 0.02 . 1 . . . . 89 ALA H . 6964 1 1007 . 1 1 89 89 ALA HA H 1 4.26 0.02 . 1 . . . . 89 ALA HA . 6964 1 1008 . 1 1 89 89 ALA HB1 H 1 1.63 0.02 . 1 . . . . 89 ALA HB . 6964 1 1009 . 1 1 89 89 ALA HB2 H 1 1.63 0.02 . 1 . . . . 89 ALA HB . 6964 1 1010 . 1 1 89 89 ALA HB3 H 1 1.63 0.02 . 1 . . . . 89 ALA HB . 6964 1 1011 . 1 1 89 89 ALA C C 13 181.4 0.2 . 1 . . . . 89 ALA C . 6964 1 1012 . 1 1 89 89 ALA CA C 13 55.2 0.2 . 1 . . . . 89 ALA CA . 6964 1 1013 . 1 1 89 89 ALA CB C 13 17.9 0.2 . 1 . . . . 89 ALA CB . 6964 1 1014 . 1 1 89 89 ALA N N 15 124.2 0.2 . 1 . . . . 89 ALA N . 6964 1 1015 . 1 1 90 90 LEU H H 1 7.83 0.02 . 1 . . . . 90 LEU H . 6964 1 1016 . 1 1 90 90 LEU HA H 1 3.94 0.02 . 1 . . . . 90 LEU HA . 6964 1 1017 . 1 1 90 90 LEU HB2 H 1 1.41 0.02 . 2 . . . . 90 LEU HB2 . 6964 1 1018 . 1 1 90 90 LEU HB3 H 1 1.67 0.02 . 2 . . . . 90 LEU HB3 . 6964 1 1019 . 1 1 90 90 LEU HG H 1 1.52 0.02 . 1 . . . . 90 LEU HG . 6964 1 1020 . 1 1 90 90 LEU HD11 H 1 0.64 0.02 . 1 . . . . 90 LEU HD1 . 6964 1 1021 . 1 1 90 90 LEU HD12 H 1 0.64 0.02 . 1 . . . . 90 LEU HD1 . 6964 1 1022 . 1 1 90 90 LEU HD13 H 1 0.64 0.02 . 1 . . . . 90 LEU HD1 . 6964 1 1023 . 1 1 90 90 LEU HD21 H 1 -0.03 0.02 . 1 . . . . 90 LEU HD2 . 6964 1 1024 . 1 1 90 90 LEU HD22 H 1 -0.03 0.02 . 1 . . . . 90 LEU HD2 . 6964 1 1025 . 1 1 90 90 LEU HD23 H 1 -0.03 0.02 . 1 . . . . 90 LEU HD2 . 6964 1 1026 . 1 1 90 90 LEU C C 13 178.9 0.2 . 1 . . . . 90 LEU C . 6964 1 1027 . 1 1 90 90 LEU CA C 13 57.3 0.2 . 1 . . . . 90 LEU CA . 6964 1 1028 . 1 1 90 90 LEU CB C 13 40.5 0.2 . 1 . . . . 90 LEU CB . 6964 1 1029 . 1 1 90 90 LEU CG C 13 27.8 0.2 . 1 . . . . 90 LEU CG . 6964 1 1030 . 1 1 90 90 LEU CD1 C 13 28.4 0.2 . 1 . . . . 90 LEU CD1 . 6964 1 1031 . 1 1 90 90 LEU CD2 C 13 22.3 0.2 . 1 . . . . 90 LEU CD2 . 6964 1 1032 . 1 1 90 90 LEU N N 15 118.5 0.2 . 1 . . . . 90 LEU N . 6964 1 1033 . 1 1 91 91 ARG H H 1 8.30 0.02 . 1 . . . . 91 ARG H . 6964 1 1034 . 1 1 91 91 ARG HA H 1 3.96 0.02 . 1 . . . . 91 ARG HA . 6964 1 1035 . 1 1 91 91 ARG HB2 H 1 1.93 0.02 . 2 . . . . 91 ARG HB2 . 6964 1 1036 . 1 1 91 91 ARG HB3 H 1 1.98 0.02 . 2 . . . . 91 ARG HB3 . 6964 1 1037 . 1 1 91 91 ARG C C 13 180.8 0.2 . 1 . . . . 91 ARG C . 6964 1 1038 . 1 1 91 91 ARG CA C 13 59.4 0.2 . 1 . . . . 91 ARG CA . 6964 1 1039 . 1 1 91 91 ARG CB C 13 29.7 0.2 . 1 . . . . 91 ARG CB . 6964 1 1040 . 1 1 91 91 ARG CG C 13 27.2 0.2 . 1 . . . . 91 ARG CG . 6964 1 1041 . 1 1 91 91 ARG CD C 13 43.2 0.2 . 1 . . . . 91 ARG CD . 6964 1 1042 . 1 1 91 91 ARG N N 15 122.8 0.2 . 1 . . . . 91 ARG N . 6964 1 1043 . 1 1 92 92 GLY H H 1 8.10 0.02 . 1 . . . . 92 GLY H . 6964 1 1044 . 1 1 92 92 GLY HA2 H 1 3.96 0.02 . 2 . . . . 92 GLY HA2 . 6964 1 1045 . 1 1 92 92 GLY HA3 H 1 4.00 0.02 . 2 . . . . 92 GLY HA3 . 6964 1 1046 . 1 1 92 92 GLY C C 13 175.0 0.2 . 1 . . . . 92 GLY C . 6964 1 1047 . 1 1 92 92 GLY CA C 13 46.6 0.2 . 1 . . . . 92 GLY CA . 6964 1 1048 . 1 1 92 92 GLY N N 15 107.1 0.2 . 1 . . . . 92 GLY N . 6964 1 1049 . 1 1 93 93 VAL H H 1 7.26 0.02 . 1 . . . . 93 VAL H . 6964 1 1050 . 1 1 93 93 VAL HA H 1 4.61 0.02 . 1 . . . . 93 VAL HA . 6964 1 1051 . 1 1 93 93 VAL HB H 1 2.50 0.02 . 1 . . . . 93 VAL HB . 6964 1 1052 . 1 1 93 93 VAL HG11 H 1 1.04 0.02 . 1 . . . . 93 VAL HG1 . 6964 1 1053 . 1 1 93 93 VAL HG12 H 1 1.04 0.02 . 1 . . . . 93 VAL HG1 . 6964 1 1054 . 1 1 93 93 VAL HG13 H 1 1.04 0.02 . 1 . . . . 93 VAL HG1 . 6964 1 1055 . 1 1 93 93 VAL HG21 H 1 0.79 0.02 . 1 . . . . 93 VAL HG2 . 6964 1 1056 . 1 1 93 93 VAL HG22 H 1 0.79 0.02 . 1 . . . . 93 VAL HG2 . 6964 1 1057 . 1 1 93 93 VAL HG23 H 1 0.79 0.02 . 1 . . . . 93 VAL HG2 . 6964 1 1058 . 1 1 93 93 VAL C C 13 174.2 0.2 . 1 . . . . 93 VAL C . 6964 1 1059 . 1 1 93 93 VAL CA C 13 60.3 0.2 . 1 . . . . 93 VAL CA . 6964 1 1060 . 1 1 93 93 VAL CB C 13 30.4 0.2 . 1 . . . . 93 VAL CB . 6964 1 1061 . 1 1 93 93 VAL CG1 C 13 21.7 0.2 . 1 . . . . 93 VAL CG1 . 6964 1 1062 . 1 1 93 93 VAL CG2 C 13 19.6 0.2 . 1 . . . . 93 VAL CG2 . 6964 1 1063 . 1 1 93 93 VAL N N 15 111.3 0.2 . 1 . . . . 93 VAL N . 6964 1 1064 . 1 1 94 94 ASN H H 1 8.01 0.02 . 1 . . . . 94 ASN H . 6964 1 1065 . 1 1 94 94 ASN HA H 1 4.26 0.02 . 1 . . . . 94 ASN HA . 6964 1 1066 . 1 1 94 94 ASN HB2 H 1 2.88 0.02 . 2 . . . . 94 ASN HB2 . 6964 1 1067 . 1 1 94 94 ASN HB3 H 1 3.00 0.02 . 2 . . . . 94 ASN HB3 . 6964 1 1068 . 1 1 94 94 ASN HD21 H 1 6.83 0.02 . 2 . . . . 94 ASN HD21 . 6964 1 1069 . 1 1 94 94 ASN HD22 H 1 7.57 0.02 . 2 . . . . 94 ASN HD22 . 6964 1 1070 . 1 1 94 94 ASN C C 13 173.8 0.2 . 1 . . . . 94 ASN C . 6964 1 1071 . 1 1 94 94 ASN CA C 13 54.5 0.2 . 1 . . . . 94 ASN CA . 6964 1 1072 . 1 1 94 94 ASN CB C 13 36.8 0.2 . 1 . . . . 94 ASN CB . 6964 1 1073 . 1 1 94 94 ASN N N 15 115.3 0.2 . 1 . . . . 94 ASN N . 6964 1 1074 . 1 1 94 94 ASN ND2 N 15 113.9 0.2 . 1 . . . . 94 ASN ND2 . 6964 1 1075 . 1 1 95 95 VAL H H 1 7.91 0.02 . 1 . . . . 95 VAL H . 6964 1 1076 . 1 1 95 95 VAL HA H 1 4.11 0.02 . 1 . . . . 95 VAL HA . 6964 1 1077 . 1 1 95 95 VAL HB H 1 1.44 0.02 . 1 . . . . 95 VAL HB . 6964 1 1078 . 1 1 95 95 VAL HG11 H 1 0.36 0.02 . 1 . . . . 95 VAL HG1 . 6964 1 1079 . 1 1 95 95 VAL HG12 H 1 0.36 0.02 . 1 . . . . 95 VAL HG1 . 6964 1 1080 . 1 1 95 95 VAL HG13 H 1 0.36 0.02 . 1 . . . . 95 VAL HG1 . 6964 1 1081 . 1 1 95 95 VAL HG21 H 1 0.61 0.02 . 1 . . . . 95 VAL HG2 . 6964 1 1082 . 1 1 95 95 VAL HG22 H 1 0.61 0.02 . 1 . . . . 95 VAL HG2 . 6964 1 1083 . 1 1 95 95 VAL HG23 H 1 0.61 0.02 . 1 . . . . 95 VAL HG2 . 6964 1 1084 . 1 1 95 95 VAL C C 13 175.4 0.2 . 1 . . . . 95 VAL C . 6964 1 1085 . 1 1 95 95 VAL CA C 13 61.6 0.2 . 1 . . . . 95 VAL CA . 6964 1 1086 . 1 1 95 95 VAL CB C 13 33.7 0.2 . 1 . . . . 95 VAL CB . 6964 1 1087 . 1 1 95 95 VAL CG1 C 13 23.2 0.2 . 1 . . . . 95 VAL CG1 . 6964 1 1088 . 1 1 95 95 VAL CG2 C 13 21.1 0.2 . 1 . . . . 95 VAL CG2 . 6964 1 1089 . 1 1 95 95 VAL N N 15 119.3 0.2 . 1 . . . . 95 VAL N . 6964 1 1090 . 1 1 96 96 VAL H H 1 8.08 0.02 . 1 . . . . 96 VAL H . 6964 1 1091 . 1 1 96 96 VAL HA H 1 3.71 0.02 . 1 . . . . 96 VAL HA . 6964 1 1092 . 1 1 96 96 VAL HB H 1 2.02 0.02 . 1 . . . . 96 VAL HB . 6964 1 1093 . 1 1 96 96 VAL HG11 H 1 0.82 0.02 . 2 . . . . 96 VAL HG1 . 6964 1 1094 . 1 1 96 96 VAL HG12 H 1 0.82 0.02 . 2 . . . . 96 VAL HG1 . 6964 1 1095 . 1 1 96 96 VAL HG13 H 1 0.82 0.02 . 2 . . . . 96 VAL HG1 . 6964 1 1096 . 1 1 96 96 VAL HG21 H 1 0.96 0.02 . 2 . . . . 96 VAL HG2 . 6964 1 1097 . 1 1 96 96 VAL HG22 H 1 0.96 0.02 . 2 . . . . 96 VAL HG2 . 6964 1 1098 . 1 1 96 96 VAL HG23 H 1 0.96 0.02 . 2 . . . . 96 VAL HG2 . 6964 1 1099 . 1 1 96 96 VAL C C 13 173.5 0.2 . 1 . . . . 96 VAL C . 6964 1 1100 . 1 1 96 96 VAL CA C 13 62.8 0.2 . 1 . . . . 96 VAL CA . 6964 1 1101 . 1 1 96 96 VAL CB C 13 33.0 0.2 . 1 . . . . 96 VAL CB . 6964 1 1102 . 1 1 96 96 VAL CG1 C 13 21.0 0.2 . 2 . . . . 96 VAL CG1 . 6964 1 1103 . 1 1 96 96 VAL CG2 C 13 22.0 0.2 . 2 . . . . 96 VAL CG2 . 6964 1 1104 . 1 1 96 96 VAL N N 15 128.1 0.2 . 1 . . . . 96 VAL N . 6964 1 1105 . 1 1 97 97 LEU H H 1 7.93 0.02 . 1 . . . . 97 LEU H . 6964 1 1106 . 1 1 97 97 LEU HA H 1 5.03 0.02 . 1 . . . . 97 LEU HA . 6964 1 1107 . 1 1 97 97 LEU HB2 H 1 1.24 0.02 . 2 . . . . 97 LEU HB2 . 6964 1 1108 . 1 1 97 97 LEU HB3 H 1 1.82 0.02 . 2 . . . . 97 LEU HB3 . 6964 1 1109 . 1 1 97 97 LEU HG H 1 1.40 0.02 . 1 . . . . 97 LEU HG . 6964 1 1110 . 1 1 97 97 LEU HD11 H 1 0.77 0.02 . 1 . . . . 97 LEU HD1 . 6964 1 1111 . 1 1 97 97 LEU HD12 H 1 0.77 0.02 . 1 . . . . 97 LEU HD1 . 6964 1 1112 . 1 1 97 97 LEU HD13 H 1 0.77 0.02 . 1 . . . . 97 LEU HD1 . 6964 1 1113 . 1 1 97 97 LEU HD21 H 1 0.61 0.02 . 1 . . . . 97 LEU HD2 . 6964 1 1114 . 1 1 97 97 LEU HD22 H 1 0.61 0.02 . 1 . . . . 97 LEU HD2 . 6964 1 1115 . 1 1 97 97 LEU HD23 H 1 0.61 0.02 . 1 . . . . 97 LEU HD2 . 6964 1 1116 . 1 1 97 97 LEU C C 13 175.0 0.2 . 1 . . . . 97 LEU C . 6964 1 1117 . 1 1 97 97 LEU CA C 13 53.6 0.2 . 1 . . . . 97 LEU CA . 6964 1 1118 . 1 1 97 97 LEU CB C 13 44.2 0.2 . 1 . . . . 97 LEU CB . 6964 1 1119 . 1 1 97 97 LEU CG C 13 27.1 0.2 . 1 . . . . 97 LEU CG . 6964 1 1120 . 1 1 97 97 LEU CD1 C 13 23.5 0.2 . 1 . . . . 97 LEU CD1 . 6964 1 1121 . 1 1 97 97 LEU CD2 C 13 26.0 0.2 . 1 . . . . 97 LEU CD2 . 6964 1 1122 . 1 1 97 97 LEU N N 15 128.1 0.2 . 1 . . . . 97 LEU N . 6964 1 1123 . 1 1 98 98 ASP H H 1 9.14 0.02 . 1 . . . . 98 ASP H . 6964 1 1124 . 1 1 98 98 ASP HA H 1 5.20 0.02 . 1 . . . . 98 ASP HA . 6964 1 1125 . 1 1 98 98 ASP HB2 H 1 2.38 0.02 . 2 . . . . 98 ASP HB2 . 6964 1 1126 . 1 1 98 98 ASP HB3 H 1 2.65 0.02 . 2 . . . . 98 ASP HB3 . 6964 1 1127 . 1 1 98 98 ASP C C 13 174.3 0.2 . 1 . . . . 98 ASP C . 6964 1 1128 . 1 1 98 98 ASP CA C 13 52.1 0.2 . 1 . . . . 98 ASP CA . 6964 1 1129 . 1 1 98 98 ASP CB C 13 41.1 0.2 . 1 . . . . 98 ASP CB . 6964 1 1130 . 1 1 98 98 ASP N N 15 128.8 0.2 . 1 . . . . 98 ASP N . 6964 1 1131 . 1 1 99 99 THR H H 1 8.67 0.02 . 1 . . . . 99 THR H . 6964 1 1132 . 1 1 99 99 THR HA H 1 5.34 0.02 . 1 . . . . 99 THR HA . 6964 1 1133 . 1 1 99 99 THR HB H 1 4.33 0.02 . 1 . . . . 99 THR HB . 6964 1 1134 . 1 1 99 99 THR HG21 H 1 1.30 0.02 . 1 . . . . 99 THR HG2 . 6964 1 1135 . 1 1 99 99 THR HG22 H 1 1.30 0.02 . 1 . . . . 99 THR HG2 . 6964 1 1136 . 1 1 99 99 THR HG23 H 1 1.30 0.02 . 1 . . . . 99 THR HG2 . 6964 1 1137 . 1 1 99 99 THR C C 13 173.5 0.2 . 1 . . . . 99 THR C . 6964 1 1138 . 1 1 99 99 THR CA C 13 60.3 0.2 . 1 . . . . 99 THR CA . 6964 1 1139 . 1 1 99 99 THR CB C 13 70.3 0.2 . 1 . . . . 99 THR CB . 6964 1 1140 . 1 1 99 99 THR CG2 C 13 22.0 0.2 . 1 . . . . 99 THR CG2 . 6964 1 1141 . 1 1 99 99 THR N N 15 115.3 0.2 . 1 . . . . 99 THR N . 6964 1 1142 . 1 1 100 100 MET H H 1 9.14 0.02 . 1 . . . . 100 MET H . 6964 1 1143 . 1 1 100 100 MET HA H 1 4.82 0.02 . 1 . . . . 100 MET HA . 6964 1 1144 . 1 1 100 100 MET HB2 H 1 2.01 0.02 . 2 . . . . 100 MET HB2 . 6964 1 1145 . 1 1 100 100 MET HB3 H 1 2.62 0.02 . 2 . . . . 100 MET HB3 . 6964 1 1146 . 1 1 100 100 MET HG2 H 1 2.23 0.02 . 2 . . . . 100 MET HG2 . 6964 1 1147 . 1 1 100 100 MET HG3 H 1 2.73 0.02 . 2 . . . . 100 MET HG3 . 6964 1 1148 . 1 1 100 100 MET HE1 H 1 1.91 0.02 . 1 . . . . 100 MET HE . 6964 1 1149 . 1 1 100 100 MET HE2 H 1 1.91 0.02 . 1 . . . . 100 MET HE . 6964 1 1150 . 1 1 100 100 MET HE3 H 1 1.91 0.02 . 1 . . . . 100 MET HE . 6964 1 1151 . 1 1 100 100 MET C C 13 174.1 0.2 . 1 . . . . 100 MET C . 6964 1 1152 . 1 1 100 100 MET CA C 13 55.5 0.2 . 1 . . . . 100 MET CA . 6964 1 1153 . 1 1 100 100 MET CB C 13 35.0 0.2 . 1 . . . . 100 MET CB . 6964 1 1154 . 1 1 100 100 MET CG C 13 30.6 0.2 . 1 . . . . 100 MET CG . 6964 1 1155 . 1 1 100 100 MET CE C 13 17.4 0.2 . 1 . . . . 100 MET CE . 6964 1 1156 . 1 1 100 100 MET N N 15 118.9 0.2 . 1 . . . . 100 MET N . 6964 1 1157 . 1 1 101 101 GLN H H 1 8.83 0.02 . 1 . . . . 101 GLN H . 6964 1 1158 . 1 1 101 101 GLN HA H 1 4.33 0.02 . 1 . . . . 101 GLN HA . 6964 1 1159 . 1 1 101 101 GLN HB2 H 1 1.73 0.02 . 2 . . . . 101 GLN HB2 . 6964 1 1160 . 1 1 101 101 GLN HB3 H 1 2.54 0.02 . 2 . . . . 101 GLN HB3 . 6964 1 1161 . 1 1 101 101 GLN HG2 H 1 2.05 0.02 . 2 . . . . 101 GLN HG2 . 6964 1 1162 . 1 1 101 101 GLN HG3 H 1 2.11 0.02 . 2 . . . . 101 GLN HG3 . 6964 1 1163 . 1 1 101 101 GLN HE21 H 1 7.10 0.02 . 2 . . . . 101 GLN HE21 . 6964 1 1164 . 1 1 101 101 GLN HE22 H 1 7.42 0.02 . 2 . . . . 101 GLN HE22 . 6964 1 1165 . 1 1 101 101 GLN C C 13 175.9 0.2 . 1 . . . . 101 GLN C . 6964 1 1166 . 1 1 101 101 GLN CA C 13 57.8 0.2 . 1 . . . . 101 GLN CA . 6964 1 1167 . 1 1 101 101 GLN CB C 13 29.6 0.2 . 1 . . . . 101 GLN CB . 6964 1 1168 . 1 1 101 101 GLN CG C 13 35.6 0.2 . 1 . . . . 101 GLN CG . 6964 1 1169 . 1 1 101 101 GLN N N 15 117.3 0.2 . 1 . . . . 101 GLN N . 6964 1 1170 . 1 1 101 101 GLN NE2 N 15 113.5 0.2 . 1 . . . . 101 GLN NE2 . 6964 1 1171 . 1 1 102 102 THR H H 1 8.95 0.02 . 1 . . . . 102 THR H . 6964 1 1172 . 1 1 102 102 THR HA H 1 3.82 0.02 . 1 . . . . 102 THR HA . 6964 1 1173 . 1 1 102 102 THR HB H 1 3.76 0.02 . 1 . . . . 102 THR HB . 6964 1 1174 . 1 1 102 102 THR HG1 H 1 6.00 0.02 . 1 . . . . 102 THR HG1 . 6964 1 1175 . 1 1 102 102 THR HG21 H 1 1.15 0.02 . 1 . . . . 102 THR HG2 . 6964 1 1176 . 1 1 102 102 THR HG22 H 1 1.15 0.02 . 1 . . . . 102 THR HG2 . 6964 1 1177 . 1 1 102 102 THR HG23 H 1 1.15 0.02 . 1 . . . . 102 THR HG2 . 6964 1 1178 . 1 1 102 102 THR C C 13 174.4 0.2 . 1 . . . . 102 THR C . 6964 1 1179 . 1 1 102 102 THR CA C 13 68.7 0.2 . 1 . . . . 102 THR CA . 6964 1 1180 . 1 1 102 102 THR CB C 13 69.2 0.2 . 1 . . . . 102 THR CB . 6964 1 1181 . 1 1 102 102 THR CG2 C 13 23.0 0.2 . 1 . . . . 102 THR CG2 . 6964 1 1182 . 1 1 102 102 THR N N 15 119.0 0.2 . 1 . . . . 102 THR N . 6964 1 1183 . 1 1 103 103 GLY H H 1 9.06 0.02 . 1 . . . . 103 GLY H . 6964 1 1184 . 1 1 103 103 GLY HA2 H 1 3.59 0.02 . 2 . . . . 103 GLY HA2 . 6964 1 1185 . 1 1 103 103 GLY HA3 H 1 4.05 0.02 . 2 . . . . 103 GLY HA3 . 6964 1 1186 . 1 1 103 103 GLY CA C 13 48.7 0.2 . 1 . . . . 103 GLY CA . 6964 1 1187 . 1 1 103 103 GLY N N 15 107.5 0.2 . 1 . . . . 103 GLY N . 6964 1 1188 . 1 1 104 104 PRO HA H 1 4.25 0.02 . 1 . . . . 104 PRO HA . 6964 1 1189 . 1 1 104 104 PRO HB2 H 1 1.81 0.02 . 2 . . . . 104 PRO HB2 . 6964 1 1190 . 1 1 104 104 PRO HB3 H 1 2.40 0.02 . 2 . . . . 104 PRO HB3 . 6964 1 1191 . 1 1 104 104 PRO HD2 H 1 3.44 0.02 . 2 . . . . 104 PRO HD2 . 6964 1 1192 . 1 1 104 104 PRO HD3 H 1 3.56 0.02 . 2 . . . . 104 PRO HD3 . 6964 1 1193 . 1 1 104 104 PRO C C 13 178.7 0.2 . 1 . . . . 104 PRO C . 6964 1 1194 . 1 1 104 104 PRO CA C 13 64.8 0.2 . 1 . . . . 104 PRO CA . 6964 1 1195 . 1 1 104 104 PRO CB C 13 31.7 0.2 . 1 . . . . 104 PRO CB . 6964 1 1196 . 1 1 104 104 PRO CG C 13 27.8 0.2 . 1 . . . . 104 PRO CG . 6964 1 1197 . 1 1 104 104 PRO CD C 13 50.3 0.2 . 1 . . . . 104 PRO CD . 6964 1 1198 . 1 1 105 105 ALA H H 1 8.23 0.02 . 1 . . . . 105 ALA H . 6964 1 1199 . 1 1 105 105 ALA HA H 1 4.30 0.02 . 1 . . . . 105 ALA HA . 6964 1 1200 . 1 1 105 105 ALA HB1 H 1 1.30 0.02 . 1 . . . . 105 ALA HB . 6964 1 1201 . 1 1 105 105 ALA HB2 H 1 1.30 0.02 . 1 . . . . 105 ALA HB . 6964 1 1202 . 1 1 105 105 ALA HB3 H 1 1.30 0.02 . 1 . . . . 105 ALA HB . 6964 1 1203 . 1 1 105 105 ALA C C 13 179.0 0.2 . 1 . . . . 105 ALA C . 6964 1 1204 . 1 1 105 105 ALA CA C 13 55.7 0.2 . 1 . . . . 105 ALA CA . 6964 1 1205 . 1 1 105 105 ALA CB C 13 19.8 0.2 . 1 . . . . 105 ALA CB . 6964 1 1206 . 1 1 105 105 ALA N N 15 122.8 0.2 . 1 . . . . 105 ALA N . 6964 1 1207 . 1 1 106 106 ILE H H 1 8.02 0.02 . 1 . . . . 106 ILE H . 6964 1 1208 . 1 1 106 106 ILE HA H 1 3.27 0.02 . 1 . . . . 106 ILE HA . 6964 1 1209 . 1 1 106 106 ILE HB H 1 1.99 0.02 . 1 . . . . 106 ILE HB . 6964 1 1210 . 1 1 106 106 ILE HG12 H 1 0.79 0.02 . 2 . . . . 106 ILE HG12 . 6964 1 1211 . 1 1 106 106 ILE HG13 H 1 1.84 0.02 . 2 . . . . 106 ILE HG13 . 6964 1 1212 . 1 1 106 106 ILE HG21 H 1 0.84 0.02 . 1 . . . . 106 ILE HG2 . 6964 1 1213 . 1 1 106 106 ILE HG22 H 1 0.84 0.02 . 1 . . . . 106 ILE HG2 . 6964 1 1214 . 1 1 106 106 ILE HG23 H 1 0.84 0.02 . 1 . . . . 106 ILE HG2 . 6964 1 1215 . 1 1 106 106 ILE HD11 H 1 0.89 0.02 . 1 . . . . 106 ILE HD1 . 6964 1 1216 . 1 1 106 106 ILE HD12 H 1 0.89 0.02 . 1 . . . . 106 ILE HD1 . 6964 1 1217 . 1 1 106 106 ILE HD13 H 1 0.89 0.02 . 1 . . . . 106 ILE HD1 . 6964 1 1218 . 1 1 106 106 ILE C C 13 176.7 0.2 . 1 . . . . 106 ILE C . 6964 1 1219 . 1 1 106 106 ILE CA C 13 65.9 0.2 . 1 . . . . 106 ILE CA . 6964 1 1220 . 1 1 106 106 ILE CB C 13 38.5 0.2 . 1 . . . . 106 ILE CB . 6964 1 1221 . 1 1 106 106 ILE CG1 C 13 29.9 0.2 . 1 . . . . 106 ILE CG1 . 6964 1 1222 . 1 1 106 106 ILE CG2 C 13 16.9 0.2 . 1 . . . . 106 ILE CG2 . 6964 1 1223 . 1 1 106 106 ILE CD1 C 13 15.5 0.2 . 1 . . . . 106 ILE CD1 . 6964 1 1224 . 1 1 106 106 ILE N N 15 118.7 0.2 . 1 . . . . 106 ILE N . 6964 1 1225 . 1 1 107 107 ARG H H 1 6.95 0.02 . 1 . . . . 107 ARG H . 6964 1 1226 . 1 1 107 107 ARG HA H 1 4.03 0.02 . 1 . . . . 107 ARG HA . 6964 1 1227 . 1 1 107 107 ARG HB2 H 1 1.90 0.02 . 2 . . . . 107 ARG HB2 . 6964 1 1228 . 1 1 107 107 ARG HB3 H 1 1.93 0.02 . 2 . . . . 107 ARG HB3 . 6964 1 1229 . 1 1 107 107 ARG HG2 H 1 1.61 0.02 . 2 . . . . 107 ARG HG2 . 6964 1 1230 . 1 1 107 107 ARG HG3 H 1 1.77 0.02 . 2 . . . . 107 ARG HG3 . 6964 1 1231 . 1 1 107 107 ARG HD2 H 1 3.23 0.02 . 2 . . . . 107 ARG HD2 . 6964 1 1232 . 1 1 107 107 ARG HD3 H 1 3.25 0.02 . 2 . . . . 107 ARG HD3 . 6964 1 1233 . 1 1 107 107 ARG C C 13 178.7 0.2 . 1 . . . . 107 ARG C . 6964 1 1234 . 1 1 107 107 ARG CA C 13 59.3 0.2 . 1 . . . . 107 ARG CA . 6964 1 1235 . 1 1 107 107 ARG CB C 13 29.8 0.2 . 1 . . . . 107 ARG CB . 6964 1 1236 . 1 1 107 107 ARG CG C 13 27.4 0.2 . 1 . . . . 107 ARG CG . 6964 1 1237 . 1 1 107 107 ARG CD C 13 43.2 0.2 . 1 . . . . 107 ARG CD . 6964 1 1238 . 1 1 107 107 ARG N N 15 117.5 0.2 . 1 . . . . 107 ARG N . 6964 1 1239 . 1 1 108 108 THR H H 1 8.18 0.02 . 1 . . . . 108 THR H . 6964 1 1240 . 1 1 108 108 THR HA H 1 3.78 0.02 . 1 . . . . 108 THR HA . 6964 1 1241 . 1 1 108 108 THR HB H 1 4.16 0.02 . 1 . . . . 108 THR HB . 6964 1 1242 . 1 1 108 108 THR HG21 H 1 1.18 0.02 . 1 . . . . 108 THR HG2 . 6964 1 1243 . 1 1 108 108 THR HG22 H 1 1.18 0.02 . 1 . . . . 108 THR HG2 . 6964 1 1244 . 1 1 108 108 THR HG23 H 1 1.18 0.02 . 1 . . . . 108 THR HG2 . 6964 1 1245 . 1 1 108 108 THR C C 13 175.3 0.2 . 1 . . . . 108 THR C . 6964 1 1246 . 1 1 108 108 THR CA C 13 67.3 0.2 . 1 . . . . 108 THR CA . 6964 1 1247 . 1 1 108 108 THR CB C 13 68.7 0.2 . 1 . . . . 108 THR CB . 6964 1 1248 . 1 1 108 108 THR CG2 C 13 21.1 0.2 . 1 . . . . 108 THR CG2 . 6964 1 1249 . 1 1 108 108 THR N N 15 115.5 0.2 . 1 . . . . 108 THR N . 6964 1 1250 . 1 1 109 109 TYR H H 1 8.73 0.02 . 1 . . . . 109 TYR H . 6964 1 1251 . 1 1 109 109 TYR HA H 1 3.60 0.02 . 1 . . . . 109 TYR HA . 6964 1 1252 . 1 1 109 109 TYR HB2 H 1 2.56 0.02 . 2 . . . . 109 TYR HB2 . 6964 1 1253 . 1 1 109 109 TYR HB3 H 1 2.87 0.02 . 2 . . . . 109 TYR HB3 . 6964 1 1254 . 1 1 109 109 TYR HD1 H 1 6.63 0.02 . 3 . . . . 109 TYR HD1 . 6964 1 1255 . 1 1 109 109 TYR HE1 H 1 6.15 0.02 . 3 . . . . 109 TYR HE1 . 6964 1 1256 . 1 1 109 109 TYR C C 13 175.5 0.2 . 1 . . . . 109 TYR C . 6964 1 1257 . 1 1 109 109 TYR CA C 13 62.6 0.2 . 1 . . . . 109 TYR CA . 6964 1 1258 . 1 1 109 109 TYR CB C 13 37.9 0.2 . 1 . . . . 109 TYR CB . 6964 1 1259 . 1 1 109 109 TYR CD1 C 13 133.0 0.2 . 3 . . . . 109 TYR CD1 . 6964 1 1260 . 1 1 109 109 TYR CE1 C 13 117.0 0.2 . 3 . . . . 109 TYR CE1 . 6964 1 1261 . 1 1 109 109 TYR N N 15 124.0 0.2 . 1 . . . . 109 TYR N . 6964 1 1262 . 1 1 110 110 ASN H H 1 8.20 0.02 . 1 . . . . 110 ASN H . 6964 1 1263 . 1 1 110 110 ASN HA H 1 4.21 0.02 . 1 . . . . 110 ASN HA . 6964 1 1264 . 1 1 110 110 ASN HB2 H 1 2.77 0.02 . 2 . . . . 110 ASN HB2 . 6964 1 1265 . 1 1 110 110 ASN HB3 H 1 2.94 0.02 . 2 . . . . 110 ASN HB3 . 6964 1 1266 . 1 1 110 110 ASN HD21 H 1 7.33 0.02 . 2 . . . . 110 ASN HD21 . 6964 1 1267 . 1 1 110 110 ASN HD22 H 1 7.48 0.02 . 2 . . . . 110 ASN HD22 . 6964 1 1268 . 1 1 110 110 ASN C C 13 180.1 0.2 . 1 . . . . 110 ASN C . 6964 1 1269 . 1 1 110 110 ASN CA C 13 55.6 0.2 . 1 . . . . 110 ASN CA . 6964 1 1270 . 1 1 110 110 ASN CB C 13 37.2 0.2 . 1 . . . . 110 ASN CB . 6964 1 1271 . 1 1 110 110 ASN N N 15 116.6 0.2 . 1 . . . . 110 ASN N . 6964 1 1272 . 1 1 110 110 ASN ND2 N 15 108.3 0.2 . 1 . . . . 110 ASN ND2 . 6964 1 1273 . 1 1 111 111 ILE H H 1 8.09 0.02 . 1 . . . . 111 ILE H . 6964 1 1274 . 1 1 111 111 ILE HA H 1 3.73 0.02 . 1 . . . . 111 ILE HA . 6964 1 1275 . 1 1 111 111 ILE HB H 1 1.88 0.02 . 1 . . . . 111 ILE HB . 6964 1 1276 . 1 1 111 111 ILE HG12 H 1 1.09 0.02 . 2 . . . . 111 ILE HG12 . 6964 1 1277 . 1 1 111 111 ILE HG13 H 1 1.73 0.02 . 2 . . . . 111 ILE HG13 . 6964 1 1278 . 1 1 111 111 ILE HG21 H 1 0.79 0.02 . 1 . . . . 111 ILE HG2 . 6964 1 1279 . 1 1 111 111 ILE HG22 H 1 0.79 0.02 . 1 . . . . 111 ILE HG2 . 6964 1 1280 . 1 1 111 111 ILE HG23 H 1 0.79 0.02 . 1 . . . . 111 ILE HG2 . 6964 1 1281 . 1 1 111 111 ILE HD11 H 1 0.80 0.02 . 1 . . . . 111 ILE HD1 . 6964 1 1282 . 1 1 111 111 ILE HD12 H 1 0.80 0.02 . 1 . . . . 111 ILE HD1 . 6964 1 1283 . 1 1 111 111 ILE HD13 H 1 0.80 0.02 . 1 . . . . 111 ILE HD1 . 6964 1 1284 . 1 1 111 111 ILE CA C 13 64.6 0.2 . 1 . . . . 111 ILE CA . 6964 1 1285 . 1 1 111 111 ILE CB C 13 38.3 0.2 . 1 . . . . 111 ILE CB . 6964 1 1286 . 1 1 111 111 ILE CG1 C 13 29.2 0.2 . 1 . . . . 111 ILE CG1 . 6964 1 1287 . 1 1 111 111 ILE CG2 C 13 16.7 0.2 . 1 . . . . 111 ILE CG2 . 6964 1 1288 . 1 1 111 111 ILE CD1 C 13 13.3 0.2 . 1 . . . . 111 ILE CD1 . 6964 1 1289 . 1 1 111 111 ILE N N 15 121.6 0.2 . 1 . . . . 111 ILE N . 6964 1 1290 . 1 1 112 112 MET H H 1 8.55 0.02 . 1 . . . . 112 MET H . 6964 1 1291 . 1 1 112 112 MET HA H 1 3.91 0.02 . 1 . . . . 112 MET HA . 6964 1 1292 . 1 1 112 112 MET HG2 H 1 2.34 0.02 . 2 . . . . 112 MET HG2 . 6964 1 1293 . 1 1 112 112 MET HG3 H 1 2.93 0.02 . 2 . . . . 112 MET HG3 . 6964 1 1294 . 1 1 112 112 MET HE1 H 1 1.93 0.02 . 1 . . . . 112 MET HE . 6964 1 1295 . 1 1 112 112 MET HE2 H 1 1.93 0.02 . 1 . . . . 112 MET HE . 6964 1 1296 . 1 1 112 112 MET HE3 H 1 1.93 0.02 . 1 . . . . 112 MET HE . 6964 1 1297 . 1 1 112 112 MET CA C 13 60.6 0.2 . 1 . . . . 112 MET CA . 6964 1 1298 . 1 1 112 112 MET CB C 13 30.8 0.2 . 1 . . . . 112 MET CB . 6964 1 1299 . 1 1 112 112 MET CG C 13 34.3 0.2 . 1 . . . . 112 MET CG . 6964 1 1300 . 1 1 112 112 MET CE C 13 17.6 0.2 . 1 . . . . 112 MET CE . 6964 1 1301 . 1 1 112 112 MET N N 15 120.2 0.2 . 1 . . . . 112 MET N . 6964 1 1302 . 1 1 113 113 ILE H H 1 8.57 0.02 . 1 . . . . 113 ILE H . 6964 1 1303 . 1 1 113 113 ILE HA H 1 3.85 0.02 . 1 . . . . 113 ILE HA . 6964 1 1304 . 1 1 113 113 ILE HB H 1 1.70 0.02 . 1 . . . . 113 ILE HB . 6964 1 1305 . 1 1 113 113 ILE HG12 H 1 0.67 0.02 . 2 . . . . 113 ILE HG12 . 6964 1 1306 . 1 1 113 113 ILE HG13 H 1 0.77 0.02 . 2 . . . . 113 ILE HG13 . 6964 1 1307 . 1 1 113 113 ILE HG21 H 1 0.77 0.02 . 1 . . . . 113 ILE HG2 . 6964 1 1308 . 1 1 113 113 ILE HG22 H 1 0.77 0.02 . 1 . . . . 113 ILE HG2 . 6964 1 1309 . 1 1 113 113 ILE HG23 H 1 0.77 0.02 . 1 . . . . 113 ILE HG2 . 6964 1 1310 . 1 1 113 113 ILE HD11 H 1 0.47 0.02 . 1 . . . . 113 ILE HD1 . 6964 1 1311 . 1 1 113 113 ILE HD12 H 1 0.47 0.02 . 1 . . . . 113 ILE HD1 . 6964 1 1312 . 1 1 113 113 ILE HD13 H 1 0.47 0.02 . 1 . . . . 113 ILE HD1 . 6964 1 1313 . 1 1 113 113 ILE C C 13 181.8 0.2 . 1 . . . . 113 ILE C . 6964 1 1314 . 1 1 113 113 ILE CA C 13 62.3 0.2 . 1 . . . . 113 ILE CA . 6964 1 1315 . 1 1 113 113 ILE CB C 13 35.7 0.2 . 1 . . . . 113 ILE CB . 6964 1 1316 . 1 1 113 113 ILE CG1 C 13 26.1 0.2 . 1 . . . . 113 ILE CG1 . 6964 1 1317 . 1 1 113 113 ILE CG2 C 13 17.8 0.2 . 1 . . . . 113 ILE CG2 . 6964 1 1318 . 1 1 113 113 ILE CD1 C 13 10.5 0.2 . 1 . . . . 113 ILE CD1 . 6964 1 1319 . 1 1 113 113 ILE N N 15 120.4 0.2 . 1 . . . . 113 ILE N . 6964 1 1320 . 1 1 114 114 GLY H H 1 7.63 0.02 . 1 . . . . 114 GLY H . 6964 1 1321 . 1 1 114 114 GLY HA2 H 1 3.90 0.02 . 2 . . . . 114 GLY HA2 . 6964 1 1322 . 1 1 114 114 GLY HA3 H 1 3.93 0.02 . 2 . . . . 114 GLY HA3 . 6964 1 1323 . 1 1 114 114 GLY C C 13 175.3 0.2 . 1 . . . . 114 GLY C . 6964 1 1324 . 1 1 114 114 GLY CA C 13 47.0 0.2 . 1 . . . . 114 GLY CA . 6964 1 1325 . 1 1 114 114 GLY N N 15 111.0 0.2 . 1 . . . . 114 GLY N . 6964 1 1326 . 1 1 115 115 GLU H H 1 7.37 0.02 . 1 . . . . 115 GLU H . 6964 1 1327 . 1 1 115 115 GLU HA H 1 4.26 0.02 . 1 . . . . 115 GLU HA . 6964 1 1328 . 1 1 115 115 GLU HB2 H 1 2.03 0.02 . 2 . . . . 115 GLU HB2 . 6964 1 1329 . 1 1 115 115 GLU HB3 H 1 2.21 0.02 . 2 . . . . 115 GLU HB3 . 6964 1 1330 . 1 1 115 115 GLU HG2 H 1 2.26 0.02 . 2 . . . . 115 GLU HG2 . 6964 1 1331 . 1 1 115 115 GLU HG3 H 1 2.48 0.02 . 2 . . . . 115 GLU HG3 . 6964 1 1332 . 1 1 115 115 GLU C C 13 175.1 0.2 . 1 . . . . 115 GLU C . 6964 1 1333 . 1 1 115 115 GLU CA C 13 56.0 0.2 . 1 . . . . 115 GLU CA . 6964 1 1334 . 1 1 115 115 GLU CB C 13 29.8 0.2 . 1 . . . . 115 GLU CB . 6964 1 1335 . 1 1 115 115 GLU CG C 13 35.4 0.2 . 1 . . . . 115 GLU CG . 6964 1 1336 . 1 1 115 115 GLU N N 15 118.5 0.2 . 1 . . . . 115 GLU N . 6964 1 1337 . 1 1 116 116 ARG H H 1 8.13 0.02 . 1 . . . . 116 ARG H . 6964 1 1338 . 1 1 116 116 ARG HA H 1 3.94 0.02 . 1 . . . . 116 ARG HA . 6964 1 1339 . 1 1 116 116 ARG C C 13 176.2 0.2 . 1 . . . . 116 ARG C . 6964 1 1340 . 1 1 116 116 ARG CA C 13 57.1 0.2 . 1 . . . . 116 ARG CA . 6964 1 1341 . 1 1 116 116 ARG CB C 13 26.2 0.2 . 1 . . . . 116 ARG CB . 6964 1 1342 . 1 1 116 116 ARG CG C 13 27.5 0.2 . 1 . . . . 116 ARG CG . 6964 1 1343 . 1 1 116 116 ARG CD C 13 43.3 0.2 . 1 . . . . 116 ARG CD . 6964 1 1344 . 1 1 116 116 ARG N N 15 114.3 0.2 . 1 . . . . 116 ARG N . 6964 1 1345 . 1 1 117 117 ARG H H 1 7.73 0.02 . 1 . . . . 117 ARG H . 6964 1 1346 . 1 1 117 117 ARG HA H 1 4.27 0.02 . 1 . . . . 117 ARG HA . 6964 1 1347 . 1 1 117 117 ARG C C 13 176.5 0.2 . 1 . . . . 117 ARG C . 6964 1 1348 . 1 1 117 117 ARG CA C 13 54.8 0.2 . 1 . . . . 117 ARG CA . 6964 1 1349 . 1 1 117 117 ARG CB C 13 30.7 0.2 . 1 . . . . 117 ARG CB . 6964 1 1350 . 1 1 117 117 ARG CD C 13 42.3 0.2 . 1 . . . . 117 ARG CD . 6964 1 1351 . 1 1 117 117 ARG N N 15 116.5 0.2 . 1 . . . . 117 ARG N . 6964 1 1352 . 1 1 118 118 ARG H H 1 9.18 0.02 . 1 . . . . 118 ARG H . 6964 1 1353 . 1 1 118 118 ARG HA H 1 4.55 0.02 . 1 . . . . 118 ARG HA . 6964 1 1354 . 1 1 118 118 ARG HG2 H 1 1.56 0.02 . 2 . . . . 118 ARG HG2 . 6964 1 1355 . 1 1 118 118 ARG HG3 H 1 1.69 0.02 . 2 . . . . 118 ARG HG3 . 6964 1 1356 . 1 1 118 118 ARG HD2 H 1 3.10 0.02 . 2 . . . . 118 ARG HD2 . 6964 1 1357 . 1 1 118 118 ARG HD3 H 1 3.21 0.02 . 2 . . . . 118 ARG HD3 . 6964 1 1358 . 1 1 118 118 ARG C C 13 175.3 0.2 . 1 . . . . 118 ARG C . 6964 1 1359 . 1 1 118 118 ARG CA C 13 55.5 0.2 . 1 . . . . 118 ARG CA . 6964 1 1360 . 1 1 118 118 ARG CB C 13 27.4 0.2 . 1 . . . . 118 ARG CB . 6964 1 1361 . 1 1 118 118 ARG CG C 13 25.7 0.2 . 1 . . . . 118 ARG CG . 6964 1 1362 . 1 1 118 118 ARG CD C 13 44.0 0.2 . 1 . . . . 118 ARG CD . 6964 1 1363 . 1 1 118 118 ARG N N 15 122.7 0.2 . 1 . . . . 118 ARG N . 6964 1 1364 . 1 1 119 119 VAL H H 1 7.76 0.02 . 1 . . . . 119 VAL H . 6964 1 1365 . 1 1 119 119 VAL HA H 1 5.36 0.02 . 1 . . . . 119 VAL HA . 6964 1 1366 . 1 1 119 119 VAL HB H 1 1.68 0.02 . 1 . . . . 119 VAL HB . 6964 1 1367 . 1 1 119 119 VAL HG11 H 1 0.72 0.02 . 1 . . . . 119 VAL HG1 . 6964 1 1368 . 1 1 119 119 VAL HG12 H 1 0.72 0.02 . 1 . . . . 119 VAL HG1 . 6964 1 1369 . 1 1 119 119 VAL HG13 H 1 0.72 0.02 . 1 . . . . 119 VAL HG1 . 6964 1 1370 . 1 1 119 119 VAL HG21 H 1 0.88 0.02 . 1 . . . . 119 VAL HG2 . 6964 1 1371 . 1 1 119 119 VAL HG22 H 1 0.88 0.02 . 1 . . . . 119 VAL HG2 . 6964 1 1372 . 1 1 119 119 VAL HG23 H 1 0.88 0.02 . 1 . . . . 119 VAL HG2 . 6964 1 1373 . 1 1 119 119 VAL C C 13 172.1 0.2 . 1 . . . . 119 VAL C . 6964 1 1374 . 1 1 119 119 VAL CA C 13 58.6 0.2 . 1 . . . . 119 VAL CA . 6964 1 1375 . 1 1 119 119 VAL CB C 13 35.7 0.2 . 1 . . . . 119 VAL CB . 6964 1 1376 . 1 1 119 119 VAL CG1 C 13 20.2 0.2 . 1 . . . . 119 VAL CG1 . 6964 1 1377 . 1 1 119 119 VAL CG2 C 13 22.6 0.2 . 1 . . . . 119 VAL CG2 . 6964 1 1378 . 1 1 119 119 VAL N N 15 123.1 0.2 . 1 . . . . 119 VAL N . 6964 1 1379 . 1 1 120 120 ALA H H 1 8.47 0.02 . 1 . . . . 120 ALA H . 6964 1 1380 . 1 1 120 120 ALA HA H 1 5.18 0.02 . 1 . . . . 120 ALA HA . 6964 1 1381 . 1 1 120 120 ALA HB1 H 1 1.30 0.02 . 1 . . . . 120 ALA HB . 6964 1 1382 . 1 1 120 120 ALA HB2 H 1 1.30 0.02 . 1 . . . . 120 ALA HB . 6964 1 1383 . 1 1 120 120 ALA HB3 H 1 1.30 0.02 . 1 . . . . 120 ALA HB . 6964 1 1384 . 1 1 120 120 ALA C C 13 175.0 0.2 . 1 . . . . 120 ALA C . 6964 1 1385 . 1 1 120 120 ALA CA C 13 49.6 0.2 . 1 . . . . 120 ALA CA . 6964 1 1386 . 1 1 120 120 ALA CB C 13 24.8 0.2 . 1 . . . . 120 ALA CB . 6964 1 1387 . 1 1 120 120 ALA N N 15 125.4 0.2 . 1 . . . . 120 ALA N . 6964 1 1388 . 1 1 121 121 ALA H H 1 8.96 0.02 . 1 . . . . 121 ALA H . 6964 1 1389 . 1 1 121 121 ALA HA H 1 5.65 0.02 . 1 . . . . 121 ALA HA . 6964 1 1390 . 1 1 121 121 ALA HB1 H 1 0.73 0.02 . 1 . . . . 121 ALA HB . 6964 1 1391 . 1 1 121 121 ALA HB2 H 1 0.73 0.02 . 1 . . . . 121 ALA HB . 6964 1 1392 . 1 1 121 121 ALA HB3 H 1 0.73 0.02 . 1 . . . . 121 ALA HB . 6964 1 1393 . 1 1 121 121 ALA C C 13 173.8 0.2 . 1 . . . . 121 ALA C . 6964 1 1394 . 1 1 121 121 ALA CA C 13 49.8 0.2 . 1 . . . . 121 ALA CA . 6964 1 1395 . 1 1 121 121 ALA CB C 13 21.1 0.2 . 1 . . . . 121 ALA CB . 6964 1 1396 . 1 1 121 121 ALA N N 15 121.1 0.2 . 1 . . . . 121 ALA N . 6964 1 1397 . 1 1 122 122 ALA H H 1 9.01 0.02 . 1 . . . . 122 ALA H . 6964 1 1398 . 1 1 122 122 ALA HA H 1 4.37 0.02 . 1 . . . . 122 ALA HA . 6964 1 1399 . 1 1 122 122 ALA HB1 H 1 0.15 0.02 . 1 . . . . 122 ALA HB . 6964 1 1400 . 1 1 122 122 ALA HB2 H 1 0.15 0.02 . 1 . . . . 122 ALA HB . 6964 1 1401 . 1 1 122 122 ALA HB3 H 1 0.15 0.02 . 1 . . . . 122 ALA HB . 6964 1 1402 . 1 1 122 122 ALA C C 13 174.1 0.2 . 1 . . . . 122 ALA C . 6964 1 1403 . 1 1 122 122 ALA CA C 13 50.3 0.2 . 1 . . . . 122 ALA CA . 6964 1 1404 . 1 1 122 122 ALA CB C 13 19.4 0.2 . 1 . . . . 122 ALA CB . 6964 1 1405 . 1 1 122 122 ALA N N 15 129.9 0.2 . 1 . . . . 122 ALA N . 6964 1 1406 . 1 1 123 123 LEU H H 1 8.93 0.02 . 1 . . . . 123 LEU H . 6964 1 1407 . 1 1 123 123 LEU HA H 1 4.80 0.02 . 1 . . . . 123 LEU HA . 6964 1 1408 . 1 1 123 123 LEU HB2 H 1 1.11 0.02 . 2 . . . . 123 LEU HB2 . 6964 1 1409 . 1 1 123 123 LEU HB3 H 1 1.66 0.02 . 2 . . . . 123 LEU HB3 . 6964 1 1410 . 1 1 123 123 LEU HG H 1 1.23 0.02 . 1 . . . . 123 LEU HG . 6964 1 1411 . 1 1 123 123 LEU HD11 H 1 0.15 0.02 . 1 . . . . 123 LEU HD1 . 6964 1 1412 . 1 1 123 123 LEU HD12 H 1 0.15 0.02 . 1 . . . . 123 LEU HD1 . 6964 1 1413 . 1 1 123 123 LEU HD13 H 1 0.15 0.02 . 1 . . . . 123 LEU HD1 . 6964 1 1414 . 1 1 123 123 LEU HD21 H 1 0.58 0.02 . 1 . . . . 123 LEU HD2 . 6964 1 1415 . 1 1 123 123 LEU HD22 H 1 0.58 0.02 . 1 . . . . 123 LEU HD2 . 6964 1 1416 . 1 1 123 123 LEU HD23 H 1 0.58 0.02 . 1 . . . . 123 LEU HD2 . 6964 1 1417 . 1 1 123 123 LEU C C 13 174.7 0.2 . 1 . . . . 123 LEU C . 6964 1 1418 . 1 1 123 123 LEU CA C 13 53.6 0.2 . 1 . . . . 123 LEU CA . 6964 1 1419 . 1 1 123 123 LEU CB C 13 45.0 0.2 . 1 . . . . 123 LEU CB . 6964 1 1420 . 1 1 123 123 LEU CG C 13 26.0 0.2 . 1 . . . . 123 LEU CG . 6964 1 1421 . 1 1 123 123 LEU CD1 C 13 27.6 0.2 . 1 . . . . 123 LEU CD1 . 6964 1 1422 . 1 1 123 123 LEU CD2 C 13 25.0 0.2 . 1 . . . . 123 LEU CD2 . 6964 1 1423 . 1 1 123 123 LEU N N 15 122.0 0.2 . 1 . . . . 123 LEU N . 6964 1 1424 . 1 1 124 124 ILE H H 1 8.38 0.02 . 1 . . . . 124 ILE H . 6964 1 1425 . 1 1 124 124 ILE HA H 1 4.41 0.02 . 1 . . . . 124 ILE HA . 6964 1 1426 . 1 1 124 124 ILE HB H 1 1.54 0.02 . 1 . . . . 124 ILE HB . 6964 1 1427 . 1 1 124 124 ILE HG12 H 1 0.50 0.02 . 2 . . . . 124 ILE HG12 . 6964 1 1428 . 1 1 124 124 ILE HG13 H 1 1.80 0.02 . 2 . . . . 124 ILE HG13 . 6964 1 1429 . 1 1 124 124 ILE HG21 H 1 0.61 0.02 . 1 . . . . 124 ILE HG2 . 6964 1 1430 . 1 1 124 124 ILE HG22 H 1 0.61 0.02 . 1 . . . . 124 ILE HG2 . 6964 1 1431 . 1 1 124 124 ILE HG23 H 1 0.61 0.02 . 1 . . . . 124 ILE HG2 . 6964 1 1432 . 1 1 124 124 ILE HD11 H 1 0.10 0.02 . 1 . . . . 124 ILE HD1 . 6964 1 1433 . 1 1 124 124 ILE HD12 H 1 0.10 0.02 . 1 . . . . 124 ILE HD1 . 6964 1 1434 . 1 1 124 124 ILE HD13 H 1 0.10 0.02 . 1 . . . . 124 ILE HD1 . 6964 1 1435 . 1 1 124 124 ILE C C 13 177.4 0.2 . 1 . . . . 124 ILE C . 6964 1 1436 . 1 1 124 124 ILE CA C 13 61.1 0.2 . 1 . . . . 124 ILE CA . 6964 1 1437 . 1 1 124 124 ILE CB C 13 37.6 0.2 . 1 . . . . 124 ILE CB . 6964 1 1438 . 1 1 124 124 ILE CG1 C 13 28.7 0.2 . 1 . . . . 124 ILE CG1 . 6964 1 1439 . 1 1 124 124 ILE CG2 C 13 16.9 0.2 . 1 . . . . 124 ILE CG2 . 6964 1 1440 . 1 1 124 124 ILE CD1 C 13 13.3 0.2 . 1 . . . . 124 ILE CD1 . 6964 1 1441 . 1 1 124 124 ILE N N 15 123.4 0.2 . 1 . . . . 124 ILE N . 6964 1 1442 . 1 1 125 125 ALA H H 1 8.13 0.02 . 1 . . . . 125 ALA H . 6964 1 1443 . 1 1 125 125 ALA HA H 1 4.19 0.02 . 1 . . . . 125 ALA HA . 6964 1 1444 . 1 1 125 125 ALA HB1 H 1 1.14 0.02 . 1 . . . . 125 ALA HB . 6964 1 1445 . 1 1 125 125 ALA HB2 H 1 1.14 0.02 . 1 . . . . 125 ALA HB . 6964 1 1446 . 1 1 125 125 ALA HB3 H 1 1.14 0.02 . 1 . . . . 125 ALA HB . 6964 1 1447 . 1 1 125 125 ALA C C 13 176.9 0.2 . 1 . . . . 125 ALA C . 6964 1 1448 . 1 1 125 125 ALA CA C 13 52.0 0.2 . 1 . . . . 125 ALA CA . 6964 1 1449 . 1 1 125 125 ALA CB C 13 18.4 0.2 . 1 . . . . 125 ALA CB . 6964 1 1450 . 1 1 125 125 ALA N N 15 130.9 0.2 . 1 . . . . 125 ALA N . 6964 1 1451 . 1 1 126 126 VAL H H 1 8.08 0.02 . 1 . . . . 126 VAL H . 6964 1 1452 . 1 1 126 126 VAL HA H 1 4.22 0.02 . 1 . . . . 126 VAL HA . 6964 1 1453 . 1 1 126 126 VAL HB H 1 1.98 0.02 . 1 . . . . 126 VAL HB . 6964 1 1454 . 1 1 126 126 VAL HG11 H 1 0.99 0.02 . 2 . . . . 126 VAL HG1 . 6964 1 1455 . 1 1 126 126 VAL HG12 H 1 0.99 0.02 . 2 . . . . 126 VAL HG1 . 6964 1 1456 . 1 1 126 126 VAL HG13 H 1 0.99 0.02 . 2 . . . . 126 VAL HG1 . 6964 1 1457 . 1 1 126 126 VAL HG21 H 1 0.81 0.02 . 2 . . . . 126 VAL HG2 . 6964 1 1458 . 1 1 126 126 VAL HG22 H 1 0.81 0.02 . 2 . . . . 126 VAL HG2 . 6964 1 1459 . 1 1 126 126 VAL HG23 H 1 0.81 0.02 . 2 . . . . 126 VAL HG2 . 6964 1 1460 . 1 1 126 126 VAL CA C 13 60.3 0.2 . 1 . . . . 126 VAL CA . 6964 1 1461 . 1 1 126 126 VAL CB C 13 32.5 0.2 . 1 . . . . 126 VAL CB . 6964 1 1462 . 1 1 126 126 VAL CG1 C 13 21.0 0.2 . 1 . . . . 126 VAL CG1 . 6964 1 1463 . 1 1 126 126 VAL N N 15 122.7 0.2 . 1 . . . . 126 VAL N . 6964 1 1464 . 1 1 127 127 PRO HD2 H 1 3.63 0.02 . 2 . . . . 127 PRO HD2 . 6964 1 1465 . 1 1 127 127 PRO HD3 H 1 4.04 0.02 . 2 . . . . 127 PRO HD3 . 6964 1 1466 . 1 1 127 127 PRO C C 13 176.9 0.2 . 1 . . . . 127 PRO C . 6964 1 1467 . 1 1 127 127 PRO CA C 13 62.9 0.2 . 1 . . . . 127 PRO CA . 6964 1 1468 . 1 1 127 127 PRO CB C 13 32.3 0.2 . 1 . . . . 127 PRO CB . 6964 1 1469 . 1 1 127 127 PRO CG C 13 27.3 0.2 . 1 . . . . 127 PRO CG . 6964 1 1470 . 1 1 127 127 PRO CD C 13 51.3 0.2 . 1 . . . . 127 PRO CD . 6964 1 1471 . 1 1 128 128 LEU H H 1 8.33 0.02 . 1 . . . . 128 LEU H . 6964 1 1472 . 1 1 128 128 LEU HA H 1 4.17 0.02 . 1 . . . . 128 LEU HA . 6964 1 1473 . 1 1 128 128 LEU HB2 H 1 1.39 0.02 . 2 . . . . 128 LEU HB2 . 6964 1 1474 . 1 1 128 128 LEU HB3 H 1 1.43 0.02 . 2 . . . . 128 LEU HB3 . 6964 1 1475 . 1 1 128 128 LEU HG H 1 1.47 0.02 . 1 . . . . 128 LEU HG . 6964 1 1476 . 1 1 128 128 LEU HD11 H 1 0.82 0.02 . 1 . . . . 128 LEU HD1 . 6964 1 1477 . 1 1 128 128 LEU HD12 H 1 0.82 0.02 . 1 . . . . 128 LEU HD1 . 6964 1 1478 . 1 1 128 128 LEU HD13 H 1 0.82 0.02 . 1 . . . . 128 LEU HD1 . 6964 1 1479 . 1 1 128 128 LEU HD21 H 1 0.78 0.02 . 1 . . . . 128 LEU HD2 . 6964 1 1480 . 1 1 128 128 LEU HD22 H 1 0.78 0.02 . 1 . . . . 128 LEU HD2 . 6964 1 1481 . 1 1 128 128 LEU HD23 H 1 0.78 0.02 . 1 . . . . 128 LEU HD2 . 6964 1 1482 . 1 1 128 128 LEU C C 13 176.9 0.2 . 1 . . . . 128 LEU C . 6964 1 1483 . 1 1 128 128 LEU CA C 13 55.4 0.2 . 1 . . . . 128 LEU CA . 6964 1 1484 . 1 1 128 128 LEU CB C 13 42.4 0.2 . 1 . . . . 128 LEU CB . 6964 1 1485 . 1 1 128 128 LEU CG C 13 26.9 0.2 . 1 . . . . 128 LEU CG . 6964 1 1486 . 1 1 128 128 LEU CD1 C 13 24.7 0.2 . 1 . . . . 128 LEU CD1 . 6964 1 1487 . 1 1 128 128 LEU CD2 C 13 23.9 0.2 . 1 . . . . 128 LEU CD2 . 6964 1 1488 . 1 1 128 128 LEU N N 15 121.9 0.2 . 1 . . . . 128 LEU N . 6964 1 1489 . 1 1 129 129 GLU H H 1 8.42 0.02 . 1 . . . . 129 GLU H . 6964 1 1490 . 1 1 129 129 GLU CA C 13 56.1 0.2 . 1 . . . . 129 GLU CA . 6964 1 1491 . 1 1 129 129 GLU CB C 13 30.5 0.2 . 1 . . . . 129 GLU CB . 6964 1 1492 . 1 1 129 129 GLU N N 15 124.1 0.2 . 1 . . . . 129 GLU N . 6964 1 stop_ save_