data_16380 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 16380 _Entry.Title ; NMR solution structure of A2LD1 (gi:13879369) ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2009-06-30 _Entry.Accession_date 2009-06-30 _Entry.Last_release_date . _Entry.Original_release_date . _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 3.0.9.13 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype SOLUTION _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.Entry_ID 1 Bill Pedrini . . . 16380 2 Pedro Serrano . . . 16380 3 Biswaranjan Mohanty . . . 16380 4 Michael Geralt . . . 16380 5 Torsten Herrmann . . . 16380 6 Kurt Wuthrich . . . 16380 7 Ian Wilson . . . 16380 stop_ loop_ _SG_project.SG_project_ID _SG_project.Project_name _SG_project.Full_name_of_center _SG_project.Initial_of_center _SG_project.Entry_ID . 'PSI, Protein Structure Initiative' 'Joint Center for Structural Genomics' . 16380 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID PROTEIN . 16380 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 16380 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 471 16380 '15N chemical shifts' 153 16380 '1H chemical shifts' 951 16380 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 3 . . 2011-01-24 2009-06-30 update author 'complete citation' 16380 2 . . 2010-06-03 2009-06-30 update BMRB 'edit assembly name' 16380 1 . . 2009-08-07 2009-06-30 original author 'original release' 16380 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 1zko 'X-ray structure' 16380 PDB 2KL2 'BMRB Entry Tracking System' 16380 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 16380 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 20944236 _Citation.Full_citation . _Citation.Title 'Comparison of NMR and crystal structures highlights conformational isomerism in protein active sites' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Acta Crystallogr. Sect F Struct. Biol. Cryst. Commun.' _Citation.Journal_name_full . _Citation.Journal_volume 66 _Citation.Journal_issue 'Pt 10' _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 1393 _Citation.Page_last 1405 _Citation.Year 2010 _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 Pedro Serrano . . . 16380 1 2 Bill Pedrini . . . 16380 1 3 Michael Geralt . . . 16380 1 4 Kristaps Jaudzems . . . 16380 1 5 Biswaranjan Mohanty . . . 16380 1 6 Reto Horst . . . 16380 1 7 Torsten Herrmann . . . 16380 1 8 Marc-Andre Elsliger . . . 16380 1 9 Ian Wilson . A. . 16380 1 10 Kurt Wuthrich . . . 16380 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 16380 _Assembly.ID 1 _Assembly.Name gi-13879369 _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 gi-13879369 1 $gi-13879369 A . yes native no no . . . 16380 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_gi-13879369 _Entity.Sf_category entity _Entity.Sf_framecode gi-13879369 _Entity.Entry_ID 16380 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name gi-13879369 _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID A _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; MAHIFVYGTLKRGQPNHKVM LDHSHGLAAFRGRGCTVESF PLVIAGEHNIPWLLYLPGKG HCVTGEIYEVDEQMLRFLDD FEDCPSMYQRTALQVQVLEW EGDGDPGDSVQCFVYTTATY APEWLFLPYHESYDSEGPHG LRYNPRENR ; _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 149 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method man _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 17099.287 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-11-25 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 1VKB . "Crystal Structure Of An Aig2-Like Protein (A2ld1, Ggact, Mgc7867) From Mus Musculus At 1.90 A Resolution" . . . . . 100.00 161 100.00 100.00 7.94e-107 . . . . 16380 1 2 no PDB 2KL2 . "Nmr Solution Structure Of A2ld1 (Gi:13879369)" . . . . . 100.00 149 100.00 100.00 4.84e-107 . . . . 16380 1 3 no DBJ BAC34147 . "unnamed protein product [Mus musculus]" . . . . . 100.00 149 100.00 100.00 4.84e-107 . . . . 16380 1 4 no GB AAH06662 . "AIG2-like domain 1 [Mus musculus]" . . . . . 100.00 149 100.00 100.00 4.84e-107 . . . . 16380 1 5 no GB EDL00632 . "cDNA sequence BC006662, isoform CRA_a [Mus musculus]" . . . . . 100.00 301 100.00 100.00 2.43e-107 . . . . 16380 1 6 no GB EDL00634 . "cDNA sequence BC006662, isoform CRA_c, partial [Mus musculus]" . . . . . 70.47 123 100.00 100.00 2.46e-71 . . . . 16380 1 7 no REF NP_663441 . "gamma-glutamylaminecyclotransferase [Mus musculus]" . . . . . 100.00 149 100.00 100.00 4.84e-107 . . . . 16380 1 8 no REF XP_006518983 . "PREDICTED: gamma-glutamylaminecyclotransferase isoform X1 [Mus musculus]" . . . . . 100.00 149 100.00 100.00 4.84e-107 . . . . 16380 1 9 no SP Q923B0 . "RecName: Full=Gamma-glutamylaminecyclotransferase; Short=GGACT; AltName: Full=AIG2-like domain-containing protein 1; AltName: F" . . . . . 100.00 149 100.00 100.00 4.84e-107 . . . . 16380 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 . 16380 1 2 . ALA . 16380 1 3 . HIS . 16380 1 4 . ILE . 16380 1 5 . PHE . 16380 1 6 . VAL . 16380 1 7 . TYR . 16380 1 8 . GLY . 16380 1 9 . THR . 16380 1 10 . LEU . 16380 1 11 . LYS . 16380 1 12 . ARG . 16380 1 13 . GLY . 16380 1 14 . GLN . 16380 1 15 . PRO . 16380 1 16 . ASN . 16380 1 17 . HIS . 16380 1 18 . LYS . 16380 1 19 . VAL . 16380 1 20 . MET . 16380 1 21 . LEU . 16380 1 22 . ASP . 16380 1 23 . HIS . 16380 1 24 . SER . 16380 1 25 . HIS . 16380 1 26 . GLY . 16380 1 27 . LEU . 16380 1 28 . ALA . 16380 1 29 . ALA . 16380 1 30 . PHE . 16380 1 31 . ARG . 16380 1 32 . GLY . 16380 1 33 . ARG . 16380 1 34 . GLY . 16380 1 35 . CYS . 16380 1 36 . THR . 16380 1 37 . VAL . 16380 1 38 . GLU . 16380 1 39 . SER . 16380 1 40 . PHE . 16380 1 41 . PRO . 16380 1 42 . LEU . 16380 1 43 . VAL . 16380 1 44 . ILE . 16380 1 45 . ALA . 16380 1 46 . GLY . 16380 1 47 . GLU . 16380 1 48 . HIS . 16380 1 49 . ASN . 16380 1 50 . ILE . 16380 1 51 . PRO . 16380 1 52 . TRP . 16380 1 53 . LEU . 16380 1 54 . LEU . 16380 1 55 . TYR . 16380 1 56 . LEU . 16380 1 57 . PRO . 16380 1 58 . GLY . 16380 1 59 . LYS . 16380 1 60 . GLY . 16380 1 61 . HIS . 16380 1 62 . CYS . 16380 1 63 . VAL . 16380 1 64 . THR . 16380 1 65 . GLY . 16380 1 66 . GLU . 16380 1 67 . ILE . 16380 1 68 . TYR . 16380 1 69 . GLU . 16380 1 70 . VAL . 16380 1 71 . ASP . 16380 1 72 . GLU . 16380 1 73 . GLN . 16380 1 74 . MET . 16380 1 75 . LEU . 16380 1 76 . ARG . 16380 1 77 . PHE . 16380 1 78 . LEU . 16380 1 79 . ASP . 16380 1 80 . ASP . 16380 1 81 . PHE . 16380 1 82 . GLU . 16380 1 83 . ASP . 16380 1 84 . CYS . 16380 1 85 . PRO . 16380 1 86 . SER . 16380 1 87 . MET . 16380 1 88 . TYR . 16380 1 89 . GLN . 16380 1 90 . ARG . 16380 1 91 . THR . 16380 1 92 . ALA . 16380 1 93 . LEU . 16380 1 94 . GLN . 16380 1 95 . VAL . 16380 1 96 . GLN . 16380 1 97 . VAL . 16380 1 98 . LEU . 16380 1 99 . GLU . 16380 1 100 . TRP . 16380 1 101 . GLU . 16380 1 102 . GLY . 16380 1 103 . ASP . 16380 1 104 . GLY . 16380 1 105 . ASP . 16380 1 106 . PRO . 16380 1 107 . GLY . 16380 1 108 . ASP . 16380 1 109 . SER . 16380 1 110 . VAL . 16380 1 111 . GLN . 16380 1 112 . CYS . 16380 1 113 . PHE . 16380 1 114 . VAL . 16380 1 115 . TYR . 16380 1 116 . THR . 16380 1 117 . THR . 16380 1 118 . ALA . 16380 1 119 . THR . 16380 1 120 . TYR . 16380 1 121 . ALA . 16380 1 122 . PRO . 16380 1 123 . GLU . 16380 1 124 . TRP . 16380 1 125 . LEU . 16380 1 126 . PHE . 16380 1 127 . LEU . 16380 1 128 . PRO . 16380 1 129 . TYR . 16380 1 130 . HIS . 16380 1 131 . GLU . 16380 1 132 . SER . 16380 1 133 . TYR . 16380 1 134 . ASP . 16380 1 135 . SER . 16380 1 136 . GLU . 16380 1 137 . GLY . 16380 1 138 . PRO . 16380 1 139 . HIS . 16380 1 140 . GLY . 16380 1 141 . LEU . 16380 1 142 . ARG . 16380 1 143 . TYR . 16380 1 144 . ASN . 16380 1 145 . PRO . 16380 1 146 . ARG . 16380 1 147 . GLU . 16380 1 148 . ASN . 16380 1 149 . ARG . 16380 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 16380 1 . ALA 2 2 16380 1 . HIS 3 3 16380 1 . ILE 4 4 16380 1 . PHE 5 5 16380 1 . VAL 6 6 16380 1 . TYR 7 7 16380 1 . GLY 8 8 16380 1 . THR 9 9 16380 1 . LEU 10 10 16380 1 . LYS 11 11 16380 1 . ARG 12 12 16380 1 . GLY 13 13 16380 1 . GLN 14 14 16380 1 . PRO 15 15 16380 1 . ASN 16 16 16380 1 . HIS 17 17 16380 1 . LYS 18 18 16380 1 . VAL 19 19 16380 1 . MET 20 20 16380 1 . LEU 21 21 16380 1 . ASP 22 22 16380 1 . HIS 23 23 16380 1 . SER 24 24 16380 1 . HIS 25 25 16380 1 . GLY 26 26 16380 1 . LEU 27 27 16380 1 . ALA 28 28 16380 1 . ALA 29 29 16380 1 . PHE 30 30 16380 1 . ARG 31 31 16380 1 . GLY 32 32 16380 1 . ARG 33 33 16380 1 . GLY 34 34 16380 1 . CYS 35 35 16380 1 . THR 36 36 16380 1 . VAL 37 37 16380 1 . GLU 38 38 16380 1 . SER 39 39 16380 1 . PHE 40 40 16380 1 . PRO 41 41 16380 1 . LEU 42 42 16380 1 . VAL 43 43 16380 1 . ILE 44 44 16380 1 . ALA 45 45 16380 1 . GLY 46 46 16380 1 . GLU 47 47 16380 1 . HIS 48 48 16380 1 . ASN 49 49 16380 1 . ILE 50 50 16380 1 . PRO 51 51 16380 1 . TRP 52 52 16380 1 . LEU 53 53 16380 1 . LEU 54 54 16380 1 . TYR 55 55 16380 1 . LEU 56 56 16380 1 . PRO 57 57 16380 1 . GLY 58 58 16380 1 . LYS 59 59 16380 1 . GLY 60 60 16380 1 . HIS 61 61 16380 1 . CYS 62 62 16380 1 . VAL 63 63 16380 1 . THR 64 64 16380 1 . GLY 65 65 16380 1 . GLU 66 66 16380 1 . ILE 67 67 16380 1 . TYR 68 68 16380 1 . GLU 69 69 16380 1 . VAL 70 70 16380 1 . ASP 71 71 16380 1 . GLU 72 72 16380 1 . GLN 73 73 16380 1 . MET 74 74 16380 1 . LEU 75 75 16380 1 . ARG 76 76 16380 1 . PHE 77 77 16380 1 . LEU 78 78 16380 1 . ASP 79 79 16380 1 . ASP 80 80 16380 1 . PHE 81 81 16380 1 . GLU 82 82 16380 1 . ASP 83 83 16380 1 . CYS 84 84 16380 1 . PRO 85 85 16380 1 . SER 86 86 16380 1 . MET 87 87 16380 1 . TYR 88 88 16380 1 . GLN 89 89 16380 1 . ARG 90 90 16380 1 . THR 91 91 16380 1 . ALA 92 92 16380 1 . LEU 93 93 16380 1 . GLN 94 94 16380 1 . VAL 95 95 16380 1 . GLN 96 96 16380 1 . VAL 97 97 16380 1 . LEU 98 98 16380 1 . GLU 99 99 16380 1 . TRP 100 100 16380 1 . GLU 101 101 16380 1 . GLY 102 102 16380 1 . ASP 103 103 16380 1 . GLY 104 104 16380 1 . ASP 105 105 16380 1 . PRO 106 106 16380 1 . GLY 107 107 16380 1 . ASP 108 108 16380 1 . SER 109 109 16380 1 . VAL 110 110 16380 1 . GLN 111 111 16380 1 . CYS 112 112 16380 1 . PHE 113 113 16380 1 . VAL 114 114 16380 1 . TYR 115 115 16380 1 . THR 116 116 16380 1 . THR 117 117 16380 1 . ALA 118 118 16380 1 . THR 119 119 16380 1 . TYR 120 120 16380 1 . ALA 121 121 16380 1 . PRO 122 122 16380 1 . GLU 123 123 16380 1 . TRP 124 124 16380 1 . LEU 125 125 16380 1 . PHE 126 126 16380 1 . LEU 127 127 16380 1 . PRO 128 128 16380 1 . TYR 129 129 16380 1 . HIS 130 130 16380 1 . GLU 131 131 16380 1 . SER 132 132 16380 1 . TYR 133 133 16380 1 . ASP 134 134 16380 1 . SER 135 135 16380 1 . GLU 136 136 16380 1 . GLY 137 137 16380 1 . PRO 138 138 16380 1 . HIS 139 139 16380 1 . GLY 140 140 16380 1 . LEU 141 141 16380 1 . ARG 142 142 16380 1 . TYR 143 143 16380 1 . ASN 144 144 16380 1 . PRO 145 145 16380 1 . ARG 146 146 16380 1 . GLU 147 147 16380 1 . ASN 148 148 16380 1 . ARG 149 149 16380 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 16380 _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 $gi-13879369 . 10090 organism . 'Mus musculus' Mouse . . Eukaryota Metazoa Mus musculus . . . . . . . . . . . . . . . . gi-13879369 . . . . 16380 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 16380 _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 $gi-13879369 . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli 'Rosetta (DE3)' . . . . . . . . . . . . . . . 'pET 25b' . . . . . . 16380 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 16380 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 gi-13879369 '[U-100% 13C; U-100% 15N]' . . 1 $gi-13879369 . . 1.1 . . mM 0.1 . . . 16380 1 2 'sodium phosphate' 'natural abundance' . . . . . . 25 . . mM . . . . 16380 1 3 'sodium chloride' 'natural abundance' . . . . . . 50 . . mM . . . . 16380 1 4 DTT '[U-100% 2H]' . . . . . . 4.5 . . mM . . . . 16380 1 5 DTT 'natural abundance' . . . . . . 0.5 . . mM . . . . 16380 1 6 H2O 'natural abundance' . . . . . . 90 . . % . . . . 16380 1 7 D2O 'natural abundance' . . . . . . 10 . . % . . . . 16380 1 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID 16380 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 80.25 . mM 16380 1 pH 6.0 0.05 pH 16380 1 pressure 1 . atm 16380 1 temperature 298 0.2 K 16380 1 stop_ save_ ############################ # Computer software used # ############################ save_CARA _Software.Sf_category software _Software.Sf_framecode CARA _Software.Entry_ID 16380 _Software.ID 1 _Software.Name CARA _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Keller and Wuthrich' . . 16380 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 16380 1 stop_ save_ save_ATNOS _Software.Sf_category software _Software.Sf_framecode ATNOS _Software.Entry_ID 16380 _Software.ID 2 _Software.Name ATNOS _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Herrmann, Guntert and Wuthrich' . . 16380 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'peak picking' 16380 2 stop_ save_ save_CANDID _Software.Sf_category software _Software.Sf_framecode CANDID _Software.Entry_ID 16380 _Software.ID 3 _Software.Name CANDID _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Herrmann, Guntert and Wuthrich' . . 16380 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'collection of distance restraints' 16380 3 stop_ save_ save_CYANA _Software.Sf_category software _Software.Sf_framecode CYANA _Software.Entry_ID 16380 _Software.ID 4 _Software.Name CYANA _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Guntert, Mumenthaler and Wuthrich' . . 16380 4 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'structure calculation' 16380 4 stop_ save_ save_OPAL _Software.Sf_category software _Software.Sf_framecode OPAL _Software.Entry_ID 16380 _Software.ID 5 _Software.Name OPAL _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Luginbuhl, Guntert, Billeter and Wuthrich' . . 16380 5 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID refinement 16380 5 stop_ save_ save_GAPRO _Software.Sf_category software _Software.Sf_framecode GAPRO _Software.Entry_ID 16380 _Software.ID 6 _Software.Name GAPRO _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Hiller, Fiorito, Wider Wuthrich' . . 16380 6 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'Geometric analysis of 2D APSY projections' 16380 6 stop_ save_ save_MATCH _Software.Sf_category software _Software.Sf_framecode MATCH _Software.Entry_ID 16380 _Software.ID 7 _Software.Name MATCH _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Volk, Herrmann, Wuthrich' . . 16380 7 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'Backbione assignment from APSY peaks' 16380 7 stop_ save_ save_ASCAN _Software.Sf_category software _Software.Sf_framecode ASCAN _Software.Entry_ID 16380 _Software.ID 8 _Software.Name ASCAN _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Fiorito, Herrmann, Wuthrich' . . 16380 8 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'Sidechain assignment with NOESY spectra' 16380 8 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 16380 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ save_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_2 _NMR_spectrometer.Entry_ID 16380 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 16380 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 Bruker Avance . 800 . . . 16380 1 2 spectrometer_2 Bruker Avance . 600 . . . 16380 1 stop_ save_ ############################# # NMR applied experiments # ############################# save_experiment_list _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode experiment_list _Experiment_list.Entry_ID 16380 _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 '5D APSY CBCACONH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 16380 1 2 '5D APSY HACACONH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 16380 1 3 '4D APSY HACANH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 16380 1 4 '3D APSY (HA)CANH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 16380 1 5 '3D HNCA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 16380 1 6 '3D aliphatic 1H-13C NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 16380 1 7 '3D aromatic 1H-13C NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 16380 1 8 '3D 1H-15N NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 16380 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_reference_1 _Chem_shift_reference.Entry_ID 16380 _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 internal indirect 0.25144953 . . . . . . . . . 16380 1 H 1 DSS 'methyl protons' . . . . ppm 0 internal direct 1 . . . . . . . . . 16380 1 N 15 DSS 'methyl protons' . . . . ppm 0 internal indirect 0.101329118 . . . . . . . . . 16380 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 16380 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err 0.008 _Assigned_chem_shift_list.Chem_shift_13C_err 0.2 _Assigned_chem_shift_list.Chem_shift_15N_err 0.15 _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 '5D APSY CBCACONH' . . . 16380 1 2 '5D APSY HACACONH' . . . 16380 1 3 '4D APSY HACANH' . . . 16380 1 4 '3D APSY (HA)CANH' . . . 16380 1 5 '3D HNCA' . . . 16380 1 6 '3D aliphatic 1H-13C NOESY' . . . 16380 1 7 '3D aromatic 1H-13C NOESY' . . . 16380 1 8 '3D 1H-15N NOESY' . . . 16380 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 1 $CARA . . 16380 1 6 $GAPRO . . 16380 1 7 $MATCH . . 16380 1 8 $ASCAN . . 16380 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 2 2 ALA HA H 1 4.182 0.008 . 1 . . . . 2 ALA HA . 16380 1 2 . 1 1 2 2 ALA HB1 H 1 1.579 0.008 . 1 . . . . 2 ALA QB . 16380 1 3 . 1 1 2 2 ALA HB2 H 1 1.579 0.008 . 1 . . . . 2 ALA QB . 16380 1 4 . 1 1 2 2 ALA HB3 H 1 1.579 0.008 . 1 . . . . 2 ALA QB . 16380 1 5 . 1 1 2 2 ALA CA C 13 51.510 0.2 . 1 . . . . 2 ALA CA . 16380 1 6 . 1 1 2 2 ALA CB C 13 20.090 0.2 . 1 . . . . 2 ALA CB . 16380 1 7 . 1 1 3 3 HIS H H 1 9.173 0.008 . 1 . . . . 3 HIS H . 16380 1 8 . 1 1 3 3 HIS HA H 1 5.839 0.008 . 1 . . . . 3 HIS HA . 16380 1 9 . 1 1 3 3 HIS HB2 H 1 3.156 0.008 . 2 . . . . 3 HIS HB2 . 16380 1 10 . 1 1 3 3 HIS HB3 H 1 3.117 0.008 . 2 . . . . 3 HIS HB3 . 16380 1 11 . 1 1 3 3 HIS HD2 H 1 6.608 0.008 . 1 . . . . 3 HIS HD2 . 16380 1 12 . 1 1 3 3 HIS CA C 13 56.960 0.2 . 1 . . . . 3 HIS CA . 16380 1 13 . 1 1 3 3 HIS CB C 13 32.820 0.2 . 1 . . . . 3 HIS CB . 16380 1 14 . 1 1 3 3 HIS CD2 C 13 118.907 0.2 . 1 . . . . 3 HIS CD2 . 16380 1 15 . 1 1 3 3 HIS N N 15 118.801 0.15 . 1 . . . . 3 HIS N . 16380 1 16 . 1 1 4 4 ILE H H 1 9.494 0.008 . 1 . . . . 4 ILE H . 16380 1 17 . 1 1 4 4 ILE HA H 1 5.508 0.008 . 1 . . . . 4 ILE HA . 16380 1 18 . 1 1 4 4 ILE HB H 1 1.735 0.008 . 1 . . . . 4 ILE HB . 16380 1 19 . 1 1 4 4 ILE HD11 H 1 0.654 0.008 . 1 . . . . 4 ILE QD1 . 16380 1 20 . 1 1 4 4 ILE HD12 H 1 0.654 0.008 . 1 . . . . 4 ILE QD1 . 16380 1 21 . 1 1 4 4 ILE HD13 H 1 0.654 0.008 . 1 . . . . 4 ILE QD1 . 16380 1 22 . 1 1 4 4 ILE HG12 H 1 1.498 0.008 . 2 . . . . 4 ILE HG12 . 16380 1 23 . 1 1 4 4 ILE HG13 H 1 1.122 0.008 . 2 . . . . 4 ILE HG13 . 16380 1 24 . 1 1 4 4 ILE HG21 H 1 0.914 0.008 . 1 . . . . 4 ILE QG2 . 16380 1 25 . 1 1 4 4 ILE HG22 H 1 0.914 0.008 . 1 . . . . 4 ILE QG2 . 16380 1 26 . 1 1 4 4 ILE HG23 H 1 0.914 0.008 . 1 . . . . 4 ILE QG2 . 16380 1 27 . 1 1 4 4 ILE CA C 13 58.300 0.2 . 1 . . . . 4 ILE CA . 16380 1 28 . 1 1 4 4 ILE CB C 13 41.930 0.2 . 1 . . . . 4 ILE CB . 16380 1 29 . 1 1 4 4 ILE CD1 C 13 14.665 0.2 . 1 . . . . 4 ILE CD1 . 16380 1 30 . 1 1 4 4 ILE CG1 C 13 27.365 0.2 . 1 . . . . 4 ILE CG1 . 16380 1 31 . 1 1 4 4 ILE CG2 C 13 17.815 0.2 . 1 . . . . 4 ILE CG2 . 16380 1 32 . 1 1 4 4 ILE N N 15 118.202 0.15 . 1 . . . . 4 ILE N . 16380 1 33 . 1 1 5 5 PHE H H 1 8.815 0.008 . 1 . . . . 5 PHE H . 16380 1 34 . 1 1 5 5 PHE HA H 1 5.789 0.008 . 1 . . . . 5 PHE HA . 16380 1 35 . 1 1 5 5 PHE HB2 H 1 2.876 0.008 . 2 . . . . 5 PHE HB2 . 16380 1 36 . 1 1 5 5 PHE HB3 H 1 3.062 0.008 . 2 . . . . 5 PHE HB3 . 16380 1 37 . 1 1 5 5 PHE HD1 H 1 6.947 0.008 . 3 . . . . 5 PHE QD . 16380 1 38 . 1 1 5 5 PHE HD2 H 1 6.947 0.008 . 3 . . . . 5 PHE QD . 16380 1 39 . 1 1 5 5 PHE HE1 H 1 7.404 0.008 . 3 . . . . 5 PHE QE . 16380 1 40 . 1 1 5 5 PHE HE2 H 1 7.404 0.008 . 3 . . . . 5 PHE QE . 16380 1 41 . 1 1 5 5 PHE HZ H 1 6.774 0.008 . 1 . . . . 5 PHE HZ . 16380 1 42 . 1 1 5 5 PHE CA C 13 55.153 0.2 . 1 . . . . 5 PHE CA . 16380 1 43 . 1 1 5 5 PHE CB C 13 40.740 0.2 . 1 . . . . 5 PHE CB . 16380 1 44 . 1 1 5 5 PHE CD1 C 13 132.173 0.2 . 3 . . . . 5 PHE CD1 . 16380 1 45 . 1 1 5 5 PHE CE1 C 13 129.614 0.2 . 3 . . . . 5 PHE CE1 . 16380 1 46 . 1 1 5 5 PHE CZ C 13 129.672 0.2 . 1 . . . . 5 PHE CZ . 16380 1 47 . 1 1 5 5 PHE N N 15 126.107 0.15 . 1 . . . . 5 PHE N . 16380 1 48 . 1 1 6 6 VAL H H 1 9.078 0.008 . 1 . . . . 6 VAL H . 16380 1 49 . 1 1 6 6 VAL HA H 1 4.357 0.008 . 1 . . . . 6 VAL HA . 16380 1 50 . 1 1 6 6 VAL HB H 1 2.171 0.008 . 1 . . . . 6 VAL HB . 16380 1 51 . 1 1 6 6 VAL HG11 H 1 0.812 0.008 . 2 . . . . 6 VAL QG1 . 16380 1 52 . 1 1 6 6 VAL HG12 H 1 0.812 0.008 . 2 . . . . 6 VAL QG1 . 16380 1 53 . 1 1 6 6 VAL HG13 H 1 0.812 0.008 . 2 . . . . 6 VAL QG1 . 16380 1 54 . 1 1 6 6 VAL HG21 H 1 0.690 0.008 . 2 . . . . 6 VAL QG2 . 16380 1 55 . 1 1 6 6 VAL HG22 H 1 0.690 0.008 . 2 . . . . 6 VAL QG2 . 16380 1 56 . 1 1 6 6 VAL HG23 H 1 0.690 0.008 . 2 . . . . 6 VAL QG2 . 16380 1 57 . 1 1 6 6 VAL CA C 13 59.157 0.2 . 1 . . . . 6 VAL CA . 16380 1 58 . 1 1 6 6 VAL CB C 13 33.473 0.2 . 1 . . . . 6 VAL CB . 16380 1 59 . 1 1 6 6 VAL CG1 C 13 19.985 0.2 . 2 . . . . 6 VAL CG1 . 16380 1 60 . 1 1 6 6 VAL CG2 C 13 22.295 0.2 . 2 . . . . 6 VAL CG2 . 16380 1 61 . 1 1 6 6 VAL N N 15 118.658 0.15 . 1 . . . . 6 VAL N . 16380 1 62 . 1 1 7 7 TYR H H 1 6.878 0.008 . 1 . . . . 7 TYR H . 16380 1 63 . 1 1 7 7 TYR HA H 1 4.170 0.008 . 1 . . . . 7 TYR HA . 16380 1 64 . 1 1 7 7 TYR HB2 H 1 2.406 0.008 . 2 . . . . 7 TYR HB2 . 16380 1 65 . 1 1 7 7 TYR HB3 H 1 2.363 0.008 . 2 . . . . 7 TYR HB3 . 16380 1 66 . 1 1 7 7 TYR CB C 13 36.608 0.2 . 1 . . . . 7 TYR CB . 16380 1 67 . 1 1 7 7 TYR N N 15 116.860 0.15 . 1 . . . . 7 TYR N . 16380 1 68 . 1 1 8 8 GLY HA2 H 1 4.195 0.008 . 2 . . . . 8 GLY HA2 . 16380 1 69 . 1 1 8 8 GLY HA3 H 1 2.933 0.008 . 2 . . . . 8 GLY HA3 . 16380 1 70 . 1 1 8 8 GLY CA C 13 46.169 0.2 . 1 . . . . 8 GLY CA . 16380 1 71 . 1 1 9 9 THR H H 1 7.618 0.008 . 1 . . . . 9 THR H . 16380 1 72 . 1 1 9 9 THR HA H 1 3.831 0.008 . 1 . . . . 9 THR HA . 16380 1 73 . 1 1 9 9 THR HB H 1 3.704 0.008 . 1 . . . . 9 THR HB . 16380 1 74 . 1 1 9 9 THR HG21 H 1 0.500 0.008 . 1 . . . . 9 THR QG2 . 16380 1 75 . 1 1 9 9 THR HG22 H 1 0.500 0.008 . 1 . . . . 9 THR QG2 . 16380 1 76 . 1 1 9 9 THR HG23 H 1 0.500 0.008 . 1 . . . . 9 THR QG2 . 16380 1 77 . 1 1 9 9 THR CA C 13 64.570 0.2 . 1 . . . . 9 THR CA . 16380 1 78 . 1 1 9 9 THR CB C 13 68.494 0.2 . 1 . . . . 9 THR CB . 16380 1 79 . 1 1 9 9 THR CG2 C 13 20.690 0.2 . 1 . . . . 9 THR CG2 . 16380 1 80 . 1 1 9 9 THR N N 15 115.934 0.15 . 1 . . . . 9 THR N . 16380 1 81 . 1 1 10 10 LEU H H 1 7.561 0.008 . 1 . . . . 10 LEU H . 16380 1 82 . 1 1 10 10 LEU HA H 1 3.673 0.008 . 1 . . . . 10 LEU HA . 16380 1 83 . 1 1 10 10 LEU HB2 H 1 1.559 0.008 . 2 . . . . 10 LEU HB2 . 16380 1 84 . 1 1 10 10 LEU HB3 H 1 1.276 0.008 . 2 . . . . 10 LEU HB3 . 16380 1 85 . 1 1 10 10 LEU HD11 H 1 0.553 0.008 . 2 . . . . 10 LEU QD1 . 16380 1 86 . 1 1 10 10 LEU HD12 H 1 0.553 0.008 . 2 . . . . 10 LEU QD1 . 16380 1 87 . 1 1 10 10 LEU HD13 H 1 0.553 0.008 . 2 . . . . 10 LEU QD1 . 16380 1 88 . 1 1 10 10 LEU HD21 H 1 0.249 0.008 . 2 . . . . 10 LEU QD2 . 16380 1 89 . 1 1 10 10 LEU HD22 H 1 0.249 0.008 . 2 . . . . 10 LEU QD2 . 16380 1 90 . 1 1 10 10 LEU HD23 H 1 0.249 0.008 . 2 . . . . 10 LEU QD2 . 16380 1 91 . 1 1 10 10 LEU HG H 1 1.216 0.008 . 1 . . . . 10 LEU HG . 16380 1 92 . 1 1 10 10 LEU CA C 13 55.950 0.2 . 1 . . . . 10 LEU CA . 16380 1 93 . 1 1 10 10 LEU CB C 13 41.610 0.2 . 1 . . . . 10 LEU CB . 16380 1 94 . 1 1 10 10 LEU CD1 C 13 24.943 0.2 . 2 . . . . 10 LEU CD1 . 16380 1 95 . 1 1 10 10 LEU CD2 C 13 22.756 0.2 . 2 . . . . 10 LEU CD2 . 16380 1 96 . 1 1 10 10 LEU CG C 13 27.302 0.2 . 1 . . . . 10 LEU CG . 16380 1 97 . 1 1 10 10 LEU N N 15 120.151 0.15 . 1 . . . . 10 LEU N . 16380 1 98 . 1 1 11 11 LYS H H 1 6.738 0.008 . 1 . . . . 11 LYS H . 16380 1 99 . 1 1 11 11 LYS HA H 1 4.007 0.008 . 1 . . . . 11 LYS HA . 16380 1 100 . 1 1 11 11 LYS HB2 H 1 1.513 0.008 . 2 . . . . 11 LYS HB2 . 16380 1 101 . 1 1 11 11 LYS HB3 H 1 1.622 0.008 . 2 . . . . 11 LYS HB3 . 16380 1 102 . 1 1 11 11 LYS HG3 H 1 1.252 0.008 . 2 . . . . 11 LYS HG3 . 16380 1 103 . 1 1 11 11 LYS CA C 13 57.390 0.2 . 1 . . . . 11 LYS CA . 16380 1 104 . 1 1 11 11 LYS CB C 13 34.322 0.2 . 1 . . . . 11 LYS CB . 16380 1 105 . 1 1 11 11 LYS CG C 13 26.058 0.2 . 1 . . . . 11 LYS CG . 16380 1 106 . 1 1 11 11 LYS N N 15 116.295 0.15 . 1 . . . . 11 LYS N . 16380 1 107 . 1 1 12 12 ARG H H 1 9.432 0.008 . 1 . . . . 12 ARG H . 16380 1 108 . 1 1 12 12 ARG HA H 1 2.029 0.008 . 1 . . . . 12 ARG HA . 16380 1 109 . 1 1 12 12 ARG HB2 H 1 1.295 0.008 . 2 . . . . 12 ARG HB2 . 16380 1 110 . 1 1 12 12 ARG HB3 H 1 1.642 0.008 . 2 . . . . 12 ARG HB3 . 16380 1 111 . 1 1 12 12 ARG HD2 H 1 2.396 0.008 . 2 . . . . 12 ARG HD2 . 16380 1 112 . 1 1 12 12 ARG HD3 H 1 2.516 0.008 . 2 . . . . 12 ARG HD3 . 16380 1 113 . 1 1 12 12 ARG HG2 H 1 1.598 0.008 . 2 . . . . 12 ARG HG2 . 16380 1 114 . 1 1 12 12 ARG HG3 H 1 1.092 0.008 . 2 . . . . 12 ARG HG3 . 16380 1 115 . 1 1 12 12 ARG CA C 13 58.420 0.2 . 1 . . . . 12 ARG CA . 16380 1 116 . 1 1 12 12 ARG CB C 13 29.190 0.2 . 1 . . . . 12 ARG CB . 16380 1 117 . 1 1 12 12 ARG CD C 13 43.288 0.2 . 1 . . . . 12 ARG CD . 16380 1 118 . 1 1 12 12 ARG CG C 13 26.924 0.2 . 1 . . . . 12 ARG CG . 16380 1 119 . 1 1 12 12 ARG N N 15 120.863 0.15 . 1 . . . . 12 ARG N . 16380 1 120 . 1 1 13 13 GLY H H 1 8.048 0.008 . 1 . . . . 13 GLY H . 16380 1 121 . 1 1 13 13 GLY HA2 H 1 3.990 0.008 . 2 . . . . 13 GLY HA2 . 16380 1 122 . 1 1 13 13 GLY HA3 H 1 3.538 0.008 . 2 . . . . 13 GLY HA3 . 16380 1 123 . 1 1 13 13 GLY CA C 13 45.490 0.2 . 1 . . . . 13 GLY CA . 16380 1 124 . 1 1 13 13 GLY N N 15 111.120 0.15 . 1 . . . . 13 GLY N . 16380 1 125 . 1 1 14 14 GLN H H 1 7.904 0.008 . 1 . . . . 14 GLN H . 16380 1 126 . 1 1 14 14 GLN HA H 1 4.682 0.008 . 1 . . . . 14 GLN HA . 16380 1 127 . 1 1 14 14 GLN HB2 H 1 2.155 0.008 . 2 . . . . 14 GLN HB2 . 16380 1 128 . 1 1 14 14 GLN HB3 H 1 2.315 0.008 . 2 . . . . 14 GLN HB3 . 16380 1 129 . 1 1 14 14 GLN HE21 H 1 7.243 0.008 . 2 . . . . 14 GLN HE21 . 16380 1 130 . 1 1 14 14 GLN HE22 H 1 7.767 0.008 . 2 . . . . 14 GLN HE22 . 16380 1 131 . 1 1 14 14 GLN HG2 H 1 1.987 0.008 . 2 . . . . 14 GLN HG2 . 16380 1 132 . 1 1 14 14 GLN HG3 H 1 2.311 0.008 . 2 . . . . 14 GLN HG3 . 16380 1 133 . 1 1 14 14 GLN CA C 13 53.440 0.2 . 1 . . . . 14 GLN CA . 16380 1 134 . 1 1 14 14 GLN CB C 13 27.115 0.2 . 1 . . . . 14 GLN CB . 16380 1 135 . 1 1 14 14 GLN CG C 13 34.047 0.2 . 1 . . . . 14 GLN CG . 16380 1 136 . 1 1 14 14 GLN N N 15 117.811 0.15 . 1 . . . . 14 GLN N . 16380 1 137 . 1 1 14 14 GLN NE2 N 15 115.458 0.15 . 1 . . . . 14 GLN NE2 . 16380 1 138 . 1 1 15 15 PRO HA H 1 4.342 0.008 . 1 . . . . 15 PRO HA . 16380 1 139 . 1 1 15 15 PRO HB2 H 1 1.576 0.008 . 2 . . . . 15 PRO HB2 . 16380 1 140 . 1 1 15 15 PRO HB3 H 1 2.702 0.008 . 2 . . . . 15 PRO HB3 . 16380 1 141 . 1 1 15 15 PRO HD2 H 1 3.431 0.008 . 2 . . . . 15 PRO HD2 . 16380 1 142 . 1 1 15 15 PRO HD3 H 1 4.207 0.008 . 2 . . . . 15 PRO HD3 . 16380 1 143 . 1 1 15 15 PRO HG2 H 1 2.251 0.008 . 2 . . . . 15 PRO HG2 . 16380 1 144 . 1 1 15 15 PRO HG3 H 1 2.109 0.008 . 2 . . . . 15 PRO HG3 . 16380 1 145 . 1 1 15 15 PRO CA C 13 66.870 0.2 . 1 . . . . 15 PRO CA . 16380 1 146 . 1 1 15 15 PRO CB C 13 34.060 0.2 . 1 . . . . 15 PRO CB . 16380 1 147 . 1 1 15 15 PRO CD C 13 51.952 0.2 . 1 . . . . 15 PRO CD . 16380 1 148 . 1 1 15 15 PRO CG C 13 27.977 0.2 . 1 . . . . 15 PRO CG . 16380 1 149 . 1 1 16 16 ASN H H 1 8.287 0.008 . 1 . . . . 16 ASN H . 16380 1 150 . 1 1 16 16 ASN HA H 1 5.356 0.008 . 1 . . . . 16 ASN HA . 16380 1 151 . 1 1 16 16 ASN HB2 H 1 2.038 0.008 . 2 . . . . 16 ASN HB2 . 16380 1 152 . 1 1 16 16 ASN HB3 H 1 2.870 0.008 . 2 . . . . 16 ASN HB3 . 16380 1 153 . 1 1 16 16 ASN HD21 H 1 6.721 0.008 . 2 . . . . 16 ASN HD21 . 16380 1 154 . 1 1 16 16 ASN HD22 H 1 7.820 0.008 . 2 . . . . 16 ASN HD22 . 16380 1 155 . 1 1 16 16 ASN CA C 13 52.230 0.2 . 1 . . . . 16 ASN CA . 16380 1 156 . 1 1 16 16 ASN CB C 13 39.030 0.2 . 1 . . . . 16 ASN CB . 16380 1 157 . 1 1 16 16 ASN N N 15 110.638 0.15 . 1 . . . . 16 ASN N . 16380 1 158 . 1 1 16 16 ASN ND2 N 15 110.714 0.15 . 1 . . . . 16 ASN ND2 . 16380 1 159 . 1 1 17 17 HIS H H 1 7.819 0.008 . 1 . . . . 17 HIS H . 16380 1 160 . 1 1 17 17 HIS HA H 1 3.815 0.008 . 1 . . . . 17 HIS HA . 16380 1 161 . 1 1 17 17 HIS HB2 H 1 3.495 0.008 . 2 . . . . 17 HIS HB2 . 16380 1 162 . 1 1 17 17 HIS HB3 H 1 3.008 0.008 . 2 . . . . 17 HIS HB3 . 16380 1 163 . 1 1 17 17 HIS HD2 H 1 7.026 0.008 . 1 . . . . 17 HIS HD2 . 16380 1 164 . 1 1 17 17 HIS CA C 13 60.140 0.2 . 1 . . . . 17 HIS CA . 16380 1 165 . 1 1 17 17 HIS CB C 13 27.680 0.2 . 1 . . . . 17 HIS CB . 16380 1 166 . 1 1 17 17 HIS CD2 C 13 124.294 0.2 . 1 . . . . 17 HIS CD2 . 16380 1 167 . 1 1 17 17 HIS N N 15 121.058 0.15 . 1 . . . . 17 HIS N . 16380 1 168 . 1 1 18 18 LYS H H 1 8.326 0.008 . 1 . . . . 18 LYS H . 16380 1 169 . 1 1 18 18 LYS HA H 1 3.695 0.008 . 1 . . . . 18 LYS HA . 16380 1 170 . 1 1 18 18 LYS HB2 H 1 1.776 0.008 . 2 . . . . 18 LYS HB2 . 16380 1 171 . 1 1 18 18 LYS HD2 H 1 1.620 0.008 . 2 . . . . 18 LYS HD2 . 16380 1 172 . 1 1 18 18 LYS HE2 H 1 2.960 0.008 . 2 . . . . 18 LYS HE2 . 16380 1 173 . 1 1 18 18 LYS HG2 H 1 1.305 0.008 . 2 . . . . 18 LYS HG2 . 16380 1 174 . 1 1 18 18 LYS HG3 H 1 1.274 0.008 . 2 . . . . 18 LYS HG3 . 16380 1 175 . 1 1 18 18 LYS CA C 13 58.890 0.2 . 1 . . . . 18 LYS CA . 16380 1 176 . 1 1 18 18 LYS CB C 13 31.070 0.2 . 1 . . . . 18 LYS CB . 16380 1 177 . 1 1 18 18 LYS CD C 13 29.484 0.2 . 1 . . . . 18 LYS CD . 16380 1 178 . 1 1 18 18 LYS CE C 13 42.080 0.2 . 1 . . . . 18 LYS CE . 16380 1 179 . 1 1 18 18 LYS CG C 13 24.305 0.2 . 1 . . . . 18 LYS CG . 16380 1 180 . 1 1 18 18 LYS N N 15 112.812 0.15 . 1 . . . . 18 LYS N . 16380 1 181 . 1 1 19 19 VAL H H 1 7.373 0.008 . 1 . . . . 19 VAL H . 16380 1 182 . 1 1 19 19 VAL HA H 1 3.816 0.008 . 1 . . . . 19 VAL HA . 16380 1 183 . 1 1 19 19 VAL HB H 1 1.789 0.008 . 1 . . . . 19 VAL HB . 16380 1 184 . 1 1 19 19 VAL HG11 H 1 0.528 0.008 . 2 . . . . 19 VAL QG1 . 16380 1 185 . 1 1 19 19 VAL HG12 H 1 0.528 0.008 . 2 . . . . 19 VAL QG1 . 16380 1 186 . 1 1 19 19 VAL HG13 H 1 0.528 0.008 . 2 . . . . 19 VAL QG1 . 16380 1 187 . 1 1 19 19 VAL HG21 H 1 0.430 0.008 . 2 . . . . 19 VAL QG2 . 16380 1 188 . 1 1 19 19 VAL HG22 H 1 0.430 0.008 . 2 . . . . 19 VAL QG2 . 16380 1 189 . 1 1 19 19 VAL HG23 H 1 0.430 0.008 . 2 . . . . 19 VAL QG2 . 16380 1 190 . 1 1 19 19 VAL CA C 13 64.960 0.2 . 1 . . . . 19 VAL CA . 16380 1 191 . 1 1 19 19 VAL CB C 13 30.960 0.2 . 1 . . . . 19 VAL CB . 16380 1 192 . 1 1 19 19 VAL CG1 C 13 20.892 0.2 . 2 . . . . 19 VAL CG1 . 16380 1 193 . 1 1 19 19 VAL CG2 C 13 20.187 0.2 . 2 . . . . 19 VAL CG2 . 16380 1 194 . 1 1 19 19 VAL N N 15 117.691 0.15 . 1 . . . . 19 VAL N . 16380 1 195 . 1 1 20 20 MET H H 1 7.329 0.008 . 1 . . . . 20 MET H . 16380 1 196 . 1 1 20 20 MET HA H 1 3.951 0.008 . 1 . . . . 20 MET HA . 16380 1 197 . 1 1 20 20 MET HB2 H 1 1.397 0.008 . 2 . . . . 20 MET HB2 . 16380 1 198 . 1 1 20 20 MET HB3 H 1 1.496 0.008 . 2 . . . . 20 MET HB3 . 16380 1 199 . 1 1 20 20 MET HE1 H 1 0.938 0.008 . 1 . . . . 20 MET QE . 16380 1 200 . 1 1 20 20 MET HE2 H 1 0.938 0.008 . 1 . . . . 20 MET QE . 16380 1 201 . 1 1 20 20 MET HE3 H 1 0.938 0.008 . 1 . . . . 20 MET QE . 16380 1 202 . 1 1 20 20 MET HG2 H 1 2.036 0.008 . 2 . . . . 20 MET HG2 . 16380 1 203 . 1 1 20 20 MET HG3 H 1 1.984 0.008 . 2 . . . . 20 MET HG3 . 16380 1 204 . 1 1 20 20 MET CA C 13 55.560 0.2 . 1 . . . . 20 MET CA . 16380 1 205 . 1 1 20 20 MET CB C 13 31.460 0.2 . 1 . . . . 20 MET CB . 16380 1 206 . 1 1 20 20 MET CE C 13 15.480 0.2 . 1 . . . . 20 MET CE . 16380 1 207 . 1 1 20 20 MET CG C 13 32.430 0.2 . 1 . . . . 20 MET CG . 16380 1 208 . 1 1 20 20 MET N N 15 114.870 0.15 . 1 . . . . 20 MET N . 16380 1 209 . 1 1 21 21 LEU H H 1 6.718 0.008 . 1 . . . . 21 LEU H . 16380 1 210 . 1 1 21 21 LEU HA H 1 4.091 0.008 . 1 . . . . 21 LEU HA . 16380 1 211 . 1 1 21 21 LEU HB2 H 1 1.509 0.008 . 2 . . . . 21 LEU HB2 . 16380 1 212 . 1 1 21 21 LEU HB3 H 1 1.432 0.008 . 2 . . . . 21 LEU HB3 . 16380 1 213 . 1 1 21 21 LEU HD11 H 1 0.801 0.008 . 2 . . . . 21 LEU QD1 . 16380 1 214 . 1 1 21 21 LEU HD12 H 1 0.801 0.008 . 2 . . . . 21 LEU QD1 . 16380 1 215 . 1 1 21 21 LEU HD13 H 1 0.801 0.008 . 2 . . . . 21 LEU QD1 . 16380 1 216 . 1 1 21 21 LEU HD21 H 1 0.734 0.008 . 2 . . . . 21 LEU QD2 . 16380 1 217 . 1 1 21 21 LEU HD22 H 1 0.734 0.008 . 2 . . . . 21 LEU QD2 . 16380 1 218 . 1 1 21 21 LEU HD23 H 1 0.734 0.008 . 2 . . . . 21 LEU QD2 . 16380 1 219 . 1 1 21 21 LEU HG H 1 1.168 0.008 . 1 . . . . 21 LEU HG . 16380 1 220 . 1 1 21 21 LEU CA C 13 54.140 0.2 . 1 . . . . 21 LEU CA . 16380 1 221 . 1 1 21 21 LEU CB C 13 42.310 0.2 . 1 . . . . 21 LEU CB . 16380 1 222 . 1 1 21 21 LEU CD1 C 13 25.391 0.2 . 2 . . . . 21 LEU CD1 . 16380 1 223 . 1 1 21 21 LEU CD2 C 13 22.099 0.2 . 2 . . . . 21 LEU CD2 . 16380 1 224 . 1 1 21 21 LEU CG C 13 26.357 0.2 . 1 . . . . 21 LEU CG . 16380 1 225 . 1 1 21 21 LEU N N 15 116.021 0.15 . 1 . . . . 21 LEU N . 16380 1 226 . 1 1 22 22 ASP H H 1 6.399 0.008 . 1 . . . . 22 ASP H . 16380 1 227 . 1 1 22 22 ASP HA H 1 4.288 0.008 . 1 . . . . 22 ASP HA . 16380 1 228 . 1 1 22 22 ASP HB2 H 1 2.200 0.008 . 2 . . . . 22 ASP HB2 . 16380 1 229 . 1 1 22 22 ASP CA C 13 52.776 0.2 . 1 . . . . 22 ASP CA . 16380 1 230 . 1 1 22 22 ASP CB C 13 40.180 0.2 . 1 . . . . 22 ASP CB . 16380 1 231 . 1 1 22 22 ASP N N 15 117.972 0.15 . 1 . . . . 22 ASP N . 16380 1 232 . 1 1 23 23 HIS H H 1 8.601 0.008 . 1 . . . . 23 HIS H . 16380 1 233 . 1 1 23 23 HIS HA H 1 4.848 0.008 . 1 . . . . 23 HIS HA . 16380 1 234 . 1 1 23 23 HIS HB2 H 1 3.207 0.008 . 2 . . . . 23 HIS HB2 . 16380 1 235 . 1 1 23 23 HIS HB3 H 1 3.109 0.008 . 2 . . . . 23 HIS HB3 . 16380 1 236 . 1 1 23 23 HIS HD2 H 1 7.298 0.008 . 1 . . . . 23 HIS HD2 . 16380 1 237 . 1 1 23 23 HIS CA C 13 55.800 0.2 . 1 . . . . 23 HIS CA . 16380 1 238 . 1 1 23 23 HIS CB C 13 27.860 0.2 . 1 . . . . 23 HIS CB . 16380 1 239 . 1 1 23 23 HIS CD2 C 13 119.640 0.2 . 1 . . . . 23 HIS CD2 . 16380 1 240 . 1 1 23 23 HIS N N 15 123.395 0.15 . 1 . . . . 23 HIS N . 16380 1 241 . 1 1 24 24 SER H H 1 8.526 0.008 . 1 . . . . 24 SER H . 16380 1 242 . 1 1 24 24 SER HA H 1 4.105 0.008 . 1 . . . . 24 SER HA . 16380 1 243 . 1 1 24 24 SER HB2 H 1 3.637 0.008 . 2 . . . . 24 SER HB2 . 16380 1 244 . 1 1 24 24 SER CA C 13 60.870 0.2 . 1 . . . . 24 SER CA . 16380 1 245 . 1 1 24 24 SER CB C 13 62.510 0.2 . 1 . . . . 24 SER CB . 16380 1 246 . 1 1 24 24 SER N N 15 117.035 0.15 . 1 . . . . 24 SER N . 16380 1 247 . 1 1 25 25 HIS H H 1 7.450 0.008 . 1 . . . . 25 HIS H . 16380 1 248 . 1 1 25 25 HIS HA H 1 4.494 0.008 . 1 . . . . 25 HIS HA . 16380 1 249 . 1 1 25 25 HIS HB2 H 1 2.650 0.008 . 2 . . . . 25 HIS HB2 . 16380 1 250 . 1 1 25 25 HIS HB3 H 1 2.429 0.008 . 2 . . . . 25 HIS HB3 . 16380 1 251 . 1 1 25 25 HIS HD2 H 1 6.805 0.008 . 1 . . . . 25 HIS HD2 . 16380 1 252 . 1 1 25 25 HIS CA C 13 53.900 0.2 . 1 . . . . 25 HIS CA . 16380 1 253 . 1 1 25 25 HIS CB C 13 28.320 0.2 . 1 . . . . 25 HIS CB . 16380 1 254 . 1 1 25 25 HIS CD2 C 13 119.623 0.2 . 1 . . . . 25 HIS CD2 . 16380 1 255 . 1 1 25 25 HIS N N 15 117.560 0.15 . 1 . . . . 25 HIS N . 16380 1 256 . 1 1 26 26 GLY H H 1 6.926 0.008 . 1 . . . . 26 GLY H . 16380 1 257 . 1 1 26 26 GLY HA2 H 1 3.587 0.008 . 2 . . . . 26 GLY HA2 . 16380 1 258 . 1 1 26 26 GLY HA3 H 1 4.362 0.008 . 2 . . . . 26 GLY HA3 . 16380 1 259 . 1 1 26 26 GLY CA C 13 43.730 0.2 . 1 . . . . 26 GLY CA . 16380 1 260 . 1 1 26 26 GLY N N 15 103.120 0.15 . 1 . . . . 26 GLY N . 16380 1 261 . 1 1 27 27 LEU H H 1 8.579 0.008 . 1 . . . . 27 LEU H . 16380 1 262 . 1 1 27 27 LEU HA H 1 4.327 0.008 . 1 . . . . 27 LEU HA . 16380 1 263 . 1 1 27 27 LEU HB2 H 1 1.364 0.008 . 2 . . . . 27 LEU HB2 . 16380 1 264 . 1 1 27 27 LEU HD11 H 1 0.754 0.008 . 2 . . . . 27 LEU QD1 . 16380 1 265 . 1 1 27 27 LEU HD12 H 1 0.754 0.008 . 2 . . . . 27 LEU QD1 . 16380 1 266 . 1 1 27 27 LEU HD13 H 1 0.754 0.008 . 2 . . . . 27 LEU QD1 . 16380 1 267 . 1 1 27 27 LEU HD21 H 1 0.615 0.008 . 2 . . . . 27 LEU QD2 . 16380 1 268 . 1 1 27 27 LEU HD22 H 1 0.615 0.008 . 2 . . . . 27 LEU QD2 . 16380 1 269 . 1 1 27 27 LEU HD23 H 1 0.615 0.008 . 2 . . . . 27 LEU QD2 . 16380 1 270 . 1 1 27 27 LEU HG H 1 1.406 0.008 . 1 . . . . 27 LEU HG . 16380 1 271 . 1 1 27 27 LEU CA C 13 54.520 0.2 . 1 . . . . 27 LEU CA . 16380 1 272 . 1 1 27 27 LEU CB C 13 44.250 0.2 . 1 . . . . 27 LEU CB . 16380 1 273 . 1 1 27 27 LEU CD1 C 13 24.398 0.2 . 2 . . . . 27 LEU CD1 . 16380 1 274 . 1 1 27 27 LEU CD2 C 13 24.036 0.2 . 2 . . . . 27 LEU CD2 . 16380 1 275 . 1 1 27 27 LEU CG C 13 26.917 0.2 . 1 . . . . 27 LEU CG . 16380 1 276 . 1 1 27 27 LEU N N 15 121.940 0.15 . 1 . . . . 27 LEU N . 16380 1 277 . 1 1 28 28 ALA H H 1 7.776 0.008 . 1 . . . . 28 ALA H . 16380 1 278 . 1 1 28 28 ALA HA H 1 5.231 0.008 . 1 . . . . 28 ALA HA . 16380 1 279 . 1 1 28 28 ALA HB1 H 1 1.292 0.008 . 1 . . . . 28 ALA QB . 16380 1 280 . 1 1 28 28 ALA HB2 H 1 1.292 0.008 . 1 . . . . 28 ALA QB . 16380 1 281 . 1 1 28 28 ALA HB3 H 1 1.292 0.008 . 1 . . . . 28 ALA QB . 16380 1 282 . 1 1 28 28 ALA CA C 13 50.990 0.2 . 1 . . . . 28 ALA CA . 16380 1 283 . 1 1 28 28 ALA CB C 13 22.580 0.2 . 1 . . . . 28 ALA CB . 16380 1 284 . 1 1 28 28 ALA N N 15 123.020 0.15 . 1 . . . . 28 ALA N . 16380 1 285 . 1 1 29 29 ALA H H 1 9.231 0.008 . 1 . . . . 29 ALA H . 16380 1 286 . 1 1 29 29 ALA HA H 1 4.857 0.008 . 1 . . . . 29 ALA HA . 16380 1 287 . 1 1 29 29 ALA HB1 H 1 1.311 0.008 . 1 . . . . 29 ALA QB . 16380 1 288 . 1 1 29 29 ALA HB2 H 1 1.311 0.008 . 1 . . . . 29 ALA QB . 16380 1 289 . 1 1 29 29 ALA HB3 H 1 1.311 0.008 . 1 . . . . 29 ALA QB . 16380 1 290 . 1 1 29 29 ALA CA C 13 50.661 0.2 . 1 . . . . 29 ALA CA . 16380 1 291 . 1 1 29 29 ALA CB C 13 21.140 0.2 . 1 . . . . 29 ALA CB . 16380 1 292 . 1 1 29 29 ALA N N 15 125.760 0.15 . 1 . . . . 29 ALA N . 16380 1 293 . 1 1 30 30 PHE H H 1 9.083 0.008 . 1 . . . . 30 PHE H . 16380 1 294 . 1 1 30 30 PHE HA H 1 3.397 0.008 . 1 . . . . 30 PHE HA . 16380 1 295 . 1 1 30 30 PHE HB2 H 1 2.994 0.008 . 2 . . . . 30 PHE HB2 . 16380 1 296 . 1 1 30 30 PHE HB3 H 1 2.681 0.008 . 2 . . . . 30 PHE HB3 . 16380 1 297 . 1 1 30 30 PHE HD1 H 1 6.601 0.008 . 3 . . . . 30 PHE QD . 16380 1 298 . 1 1 30 30 PHE HD2 H 1 6.601 0.008 . 3 . . . . 30 PHE QD . 16380 1 299 . 1 1 30 30 PHE HE1 H 1 6.884 0.008 . 3 . . . . 30 PHE QE . 16380 1 300 . 1 1 30 30 PHE HE2 H 1 6.884 0.008 . 3 . . . . 30 PHE QE . 16380 1 301 . 1 1 30 30 PHE CA C 13 59.895 0.2 . 1 . . . . 30 PHE CA . 16380 1 302 . 1 1 30 30 PHE CB C 13 38.810 0.2 . 1 . . . . 30 PHE CB . 16380 1 303 . 1 1 30 30 PHE CD1 C 13 130.984 0.2 . 3 . . . . 30 PHE CD1 . 16380 1 304 . 1 1 30 30 PHE CE1 C 13 130.970 0.2 . 3 . . . . 30 PHE CE1 . 16380 1 305 . 1 1 30 30 PHE N N 15 126.590 0.15 . 1 . . . . 30 PHE N . 16380 1 306 . 1 1 31 31 ARG H H 1 8.102 0.008 . 1 . . . . 31 ARG H . 16380 1 307 . 1 1 31 31 ARG HA H 1 3.941 0.008 . 1 . . . . 31 ARG HA . 16380 1 308 . 1 1 31 31 ARG HB2 H 1 -0.063 0.008 . 2 . . . . 31 ARG HB2 . 16380 1 309 . 1 1 31 31 ARG HB3 H 1 0.442 0.008 . 2 . . . . 31 ARG HB3 . 16380 1 310 . 1 1 31 31 ARG HD2 H 1 2.646 0.008 . 2 . . . . 31 ARG HD2 . 16380 1 311 . 1 1 31 31 ARG HD3 H 1 2.999 0.008 . 2 . . . . 31 ARG HD3 . 16380 1 312 . 1 1 31 31 ARG HE H 1 7.120 0.008 . 1 . . . . 31 ARG HE . 16380 1 313 . 1 1 31 31 ARG HG2 H 1 1.325 0.008 . 2 . . . . 31 ARG HG2 . 16380 1 314 . 1 1 31 31 ARG CA C 13 53.120 0.2 . 1 . . . . 31 ARG CA . 16380 1 315 . 1 1 31 31 ARG CB C 13 31.665 0.2 . 1 . . . . 31 ARG CB . 16380 1 316 . 1 1 31 31 ARG CD C 13 42.284 0.2 . 1 . . . . 31 ARG CD . 16380 1 317 . 1 1 31 31 ARG CG C 13 27.076 0.2 . 1 . . . . 31 ARG CG . 16380 1 318 . 1 1 31 31 ARG N N 15 125.007 0.15 . 1 . . . . 31 ARG N . 16380 1 319 . 1 1 31 31 ARG NE N 15 85.237 0.15 . 1 . . . . 31 ARG NE . 16380 1 320 . 1 1 32 32 GLY H H 1 5.465 0.008 . 1 . . . . 32 GLY H . 16380 1 321 . 1 1 32 32 GLY HA2 H 1 3.264 0.008 . 2 . . . . 32 GLY HA2 . 16380 1 322 . 1 1 32 32 GLY HA3 H 1 4.670 0.008 . 2 . . . . 32 GLY HA3 . 16380 1 323 . 1 1 32 32 GLY CA C 13 45.150 0.2 . 1 . . . . 32 GLY CA . 16380 1 324 . 1 1 32 32 GLY N N 15 101.400 0.15 . 1 . . . . 32 GLY N . 16380 1 325 . 1 1 33 33 ARG H H 1 8.345 0.008 . 1 . . . . 33 ARG H . 16380 1 326 . 1 1 33 33 ARG HA H 1 5.158 0.008 . 1 . . . . 33 ARG HA . 16380 1 327 . 1 1 33 33 ARG HB2 H 1 1.747 0.008 . 2 . . . . 33 ARG HB2 . 16380 1 328 . 1 1 33 33 ARG HB3 H 1 2.061 0.008 . 2 . . . . 33 ARG HB3 . 16380 1 329 . 1 1 33 33 ARG HD2 H 1 3.326 0.008 . 2 . . . . 33 ARG HD2 . 16380 1 330 . 1 1 33 33 ARG HE H 1 7.441 0.008 . 1 . . . . 33 ARG HE . 16380 1 331 . 1 1 33 33 ARG HG2 H 1 1.912 0.008 . 2 . . . . 33 ARG HG2 . 16380 1 332 . 1 1 33 33 ARG CA C 13 54.924 0.2 . 1 . . . . 33 ARG CA . 16380 1 333 . 1 1 33 33 ARG CB C 13 34.180 0.2 . 1 . . . . 33 ARG CB . 16380 1 334 . 1 1 33 33 ARG CD C 13 43.390 0.2 . 1 . . . . 33 ARG CD . 16380 1 335 . 1 1 33 33 ARG CG C 13 28.869 0.2 . 1 . . . . 33 ARG CG . 16380 1 336 . 1 1 33 33 ARG N N 15 116.822 0.15 . 1 . . . . 33 ARG N . 16380 1 337 . 1 1 33 33 ARG NE N 15 84.274 0.15 . 1 . . . . 33 ARG NE . 16380 1 338 . 1 1 34 34 GLY H H 1 8.549 0.008 . 1 . . . . 34 GLY H . 16380 1 339 . 1 1 34 34 GLY HA2 H 1 5.154 0.008 . 2 . . . . 34 GLY HA2 . 16380 1 340 . 1 1 34 34 GLY HA3 H 1 3.752 0.008 . 2 . . . . 34 GLY HA3 . 16380 1 341 . 1 1 34 34 GLY CA C 13 45.620 0.2 . 1 . . . . 34 GLY CA . 16380 1 342 . 1 1 34 34 GLY N N 15 107.400 0.15 . 1 . . . . 34 GLY N . 16380 1 343 . 1 1 35 35 CYS H H 1 8.803 0.008 . 1 . . . . 35 CYS H . 16380 1 344 . 1 1 35 35 CYS HA H 1 5.893 0.008 . 1 . . . . 35 CYS HA . 16380 1 345 . 1 1 35 35 CYS HB2 H 1 2.720 0.008 . 2 . . . . 35 CYS HB2 . 16380 1 346 . 1 1 35 35 CYS HB3 H 1 1.831 0.008 . 2 . . . . 35 CYS HB3 . 16380 1 347 . 1 1 35 35 CYS CA C 13 55.420 0.2 . 1 . . . . 35 CYS CA . 16380 1 348 . 1 1 35 35 CYS CB C 13 30.960 0.2 . 1 . . . . 35 CYS CB . 16380 1 349 . 1 1 35 35 CYS N N 15 117.781 0.15 . 1 . . . . 35 CYS N . 16380 1 350 . 1 1 36 36 THR H H 1 9.033 0.008 . 1 . . . . 36 THR H . 16380 1 351 . 1 1 36 36 THR HA H 1 3.835 0.008 . 1 . . . . 36 THR HA . 16380 1 352 . 1 1 36 36 THR HB H 1 4.889 0.008 . 1 . . . . 36 THR HB . 16380 1 353 . 1 1 36 36 THR HG21 H 1 1.038 0.008 . 1 . . . . 36 THR QG2 . 16380 1 354 . 1 1 36 36 THR HG22 H 1 1.038 0.008 . 1 . . . . 36 THR QG2 . 16380 1 355 . 1 1 36 36 THR HG23 H 1 1.038 0.008 . 1 . . . . 36 THR QG2 . 16380 1 356 . 1 1 36 36 THR CA C 13 64.160 0.2 . 1 . . . . 36 THR CA . 16380 1 357 . 1 1 36 36 THR CB C 13 68.200 0.2 . 1 . . . . 36 THR CB . 16380 1 358 . 1 1 36 36 THR CG2 C 13 23.169 0.2 . 1 . . . . 36 THR CG2 . 16380 1 359 . 1 1 36 36 THR N N 15 117.973 0.15 . 1 . . . . 36 THR N . 16380 1 360 . 1 1 37 37 VAL H H 1 7.545 0.008 . 1 . . . . 37 VAL H . 16380 1 361 . 1 1 37 37 VAL HA H 1 3.709 0.008 . 1 . . . . 37 VAL HA . 16380 1 362 . 1 1 37 37 VAL HB H 1 1.820 0.008 . 1 . . . . 37 VAL HB . 16380 1 363 . 1 1 37 37 VAL HG11 H 1 0.804 0.008 . 2 . . . . 37 VAL QG1 . 16380 1 364 . 1 1 37 37 VAL HG12 H 1 0.804 0.008 . 2 . . . . 37 VAL QG1 . 16380 1 365 . 1 1 37 37 VAL HG13 H 1 0.804 0.008 . 2 . . . . 37 VAL QG1 . 16380 1 366 . 1 1 37 37 VAL HG21 H 1 0.804 0.008 . 2 . . . . 37 VAL QG2 . 16380 1 367 . 1 1 37 37 VAL HG22 H 1 0.804 0.008 . 2 . . . . 37 VAL QG2 . 16380 1 368 . 1 1 37 37 VAL HG23 H 1 0.804 0.008 . 2 . . . . 37 VAL QG2 . 16380 1 369 . 1 1 37 37 VAL CA C 13 65.740 0.2 . 1 . . . . 37 VAL CA . 16380 1 370 . 1 1 37 37 VAL CB C 13 32.410 0.2 . 1 . . . . 37 VAL CB . 16380 1 371 . 1 1 37 37 VAL CG1 C 13 23.083 0.2 . 2 . . . . 37 VAL CG1 . 16380 1 372 . 1 1 37 37 VAL CG2 C 13 20.959 0.2 . 2 . . . . 37 VAL CG2 . 16380 1 373 . 1 1 37 37 VAL N N 15 121.706 0.15 . 1 . . . . 37 VAL N . 16380 1 374 . 1 1 38 38 GLU H H 1 8.540 0.008 . 1 . . . . 38 GLU H . 16380 1 375 . 1 1 38 38 GLU HA H 1 4.264 0.008 . 1 . . . . 38 GLU HA . 16380 1 376 . 1 1 38 38 GLU HB2 H 1 1.651 0.008 . 2 . . . . 38 GLU HB2 . 16380 1 377 . 1 1 38 38 GLU HB3 H 1 1.807 0.008 . 2 . . . . 38 GLU HB3 . 16380 1 378 . 1 1 38 38 GLU HG2 H 1 2.066 0.008 . 2 . . . . 38 GLU HG2 . 16380 1 379 . 1 1 38 38 GLU HG3 H 1 1.980 0.008 . 2 . . . . 38 GLU HG3 . 16380 1 380 . 1 1 38 38 GLU CA C 13 54.260 0.2 . 1 . . . . 38 GLU CA . 16380 1 381 . 1 1 38 38 GLU CB C 13 30.770 0.2 . 1 . . . . 38 GLU CB . 16380 1 382 . 1 1 38 38 GLU CG C 13 36.505 0.2 . 1 . . . . 38 GLU CG . 16380 1 383 . 1 1 38 38 GLU N N 15 119.219 0.15 . 1 . . . . 38 GLU N . 16380 1 384 . 1 1 39 39 SER H H 1 8.692 0.008 . 1 . . . . 39 SER H . 16380 1 385 . 1 1 39 39 SER HA H 1 4.035 0.008 . 1 . . . . 39 SER HA . 16380 1 386 . 1 1 39 39 SER HB2 H 1 3.087 0.008 . 2 . . . . 39 SER HB2 . 16380 1 387 . 1 1 39 39 SER HB3 H 1 2.854 0.008 . 2 . . . . 39 SER HB3 . 16380 1 388 . 1 1 39 39 SER CA C 13 57.370 0.2 . 1 . . . . 39 SER CA . 16380 1 389 . 1 1 39 39 SER CB C 13 63.760 0.2 . 1 . . . . 39 SER CB . 16380 1 390 . 1 1 39 39 SER N N 15 118.941 0.15 . 1 . . . . 39 SER N . 16380 1 391 . 1 1 40 40 PHE H H 1 8.302 0.008 . 1 . . . . 40 PHE H . 16380 1 392 . 1 1 40 40 PHE HA H 1 4.986 0.008 . 1 . . . . 40 PHE HA . 16380 1 393 . 1 1 40 40 PHE HB2 H 1 3.111 0.008 . 2 . . . . 40 PHE HB2 . 16380 1 394 . 1 1 40 40 PHE HB3 H 1 2.317 0.008 . 2 . . . . 40 PHE HB3 . 16380 1 395 . 1 1 40 40 PHE HD1 H 1 7.168 0.008 . 3 . . . . 40 PHE QD . 16380 1 396 . 1 1 40 40 PHE HD2 H 1 7.168 0.008 . 3 . . . . 40 PHE QD . 16380 1 397 . 1 1 40 40 PHE HE1 H 1 6.957 0.008 . 3 . . . . 40 PHE QE . 16380 1 398 . 1 1 40 40 PHE HE2 H 1 6.957 0.008 . 3 . . . . 40 PHE QE . 16380 1 399 . 1 1 40 40 PHE HZ H 1 7.176 0.008 . 1 . . . . 40 PHE HZ . 16380 1 400 . 1 1 40 40 PHE CA C 13 57.320 0.2 . 1 . . . . 40 PHE CA . 16380 1 401 . 1 1 40 40 PHE CB C 13 44.292 0.2 . 1 . . . . 40 PHE CB . 16380 1 402 . 1 1 40 40 PHE CD1 C 13 131.612 0.2 . 3 . . . . 40 PHE CD1 . 16380 1 403 . 1 1 40 40 PHE CE1 C 13 130.583 0.2 . 3 . . . . 40 PHE CE1 . 16380 1 404 . 1 1 40 40 PHE CZ C 13 129.126 0.2 . 1 . . . . 40 PHE CZ . 16380 1 405 . 1 1 40 40 PHE N N 15 119.300 0.15 . 1 . . . . 40 PHE N . 16380 1 406 . 1 1 41 41 PRO HA H 1 3.828 0.008 . 1 . . . . 41 PRO HA . 16380 1 407 . 1 1 41 41 PRO HB2 H 1 0.667 0.008 . 2 . . . . 41 PRO HB2 . 16380 1 408 . 1 1 41 41 PRO HB3 H 1 1.278 0.008 . 2 . . . . 41 PRO HB3 . 16380 1 409 . 1 1 41 41 PRO HD2 H 1 4.034 0.008 . 2 . . . . 41 PRO HD2 . 16380 1 410 . 1 1 41 41 PRO HD3 H 1 3.786 0.008 . 2 . . . . 41 PRO HD3 . 16380 1 411 . 1 1 41 41 PRO HG2 H 1 1.540 0.008 . 2 . . . . 41 PRO HG2 . 16380 1 412 . 1 1 41 41 PRO HG3 H 1 0.894 0.008 . 2 . . . . 41 PRO HG3 . 16380 1 413 . 1 1 41 41 PRO CA C 13 62.270 0.2 . 1 . . . . 41 PRO CA . 16380 1 414 . 1 1 41 41 PRO CB C 13 30.790 0.2 . 1 . . . . 41 PRO CB . 16380 1 415 . 1 1 41 41 PRO CD C 13 50.635 0.2 . 1 . . . . 41 PRO CD . 16380 1 416 . 1 1 41 41 PRO CG C 13 28.428 0.2 . 1 . . . . 41 PRO CG . 16380 1 417 . 1 1 42 42 LEU H H 1 7.964 0.008 . 1 . . . . 42 LEU H . 16380 1 418 . 1 1 42 42 LEU HA H 1 5.352 0.008 . 1 . . . . 42 LEU HA . 16380 1 419 . 1 1 42 42 LEU HB2 H 1 1.185 0.008 . 2 . . . . 42 LEU HB2 . 16380 1 420 . 1 1 42 42 LEU HB3 H 1 2.540 0.008 . 2 . . . . 42 LEU HB3 . 16380 1 421 . 1 1 42 42 LEU HD11 H 1 0.775 0.008 . 2 . . . . 42 LEU QD1 . 16380 1 422 . 1 1 42 42 LEU HD12 H 1 0.775 0.008 . 2 . . . . 42 LEU QD1 . 16380 1 423 . 1 1 42 42 LEU HD13 H 1 0.775 0.008 . 2 . . . . 42 LEU QD1 . 16380 1 424 . 1 1 42 42 LEU HD21 H 1 0.707 0.008 . 2 . . . . 42 LEU QD2 . 16380 1 425 . 1 1 42 42 LEU HD22 H 1 0.707 0.008 . 2 . . . . 42 LEU QD2 . 16380 1 426 . 1 1 42 42 LEU HD23 H 1 0.707 0.008 . 2 . . . . 42 LEU QD2 . 16380 1 427 . 1 1 42 42 LEU CA C 13 53.830 0.2 . 1 . . . . 42 LEU CA . 16380 1 428 . 1 1 42 42 LEU CB C 13 42.380 0.2 . 1 . . . . 42 LEU CB . 16380 1 429 . 1 1 42 42 LEU CD1 C 13 25.569 0.2 . 2 . . . . 42 LEU CD1 . 16380 1 430 . 1 1 42 42 LEU CD2 C 13 25.459 0.2 . 2 . . . . 42 LEU CD2 . 16380 1 431 . 1 1 42 42 LEU N N 15 129.948 0.15 . 1 . . . . 42 LEU N . 16380 1 432 . 1 1 43 43 VAL H H 1 8.607 0.008 . 1 . . . . 43 VAL H . 16380 1 433 . 1 1 43 43 VAL HA H 1 5.296 0.008 . 1 . . . . 43 VAL HA . 16380 1 434 . 1 1 43 43 VAL HB H 1 2.136 0.008 . 1 . . . . 43 VAL HB . 16380 1 435 . 1 1 43 43 VAL HG11 H 1 0.815 0.008 . 2 . . . . 43 VAL QG1 . 16380 1 436 . 1 1 43 43 VAL HG12 H 1 0.815 0.008 . 2 . . . . 43 VAL QG1 . 16380 1 437 . 1 1 43 43 VAL HG13 H 1 0.815 0.008 . 2 . . . . 43 VAL QG1 . 16380 1 438 . 1 1 43 43 VAL HG21 H 1 1.110 0.008 . 2 . . . . 43 VAL QG2 . 16380 1 439 . 1 1 43 43 VAL HG22 H 1 1.110 0.008 . 2 . . . . 43 VAL QG2 . 16380 1 440 . 1 1 43 43 VAL HG23 H 1 1.110 0.008 . 2 . . . . 43 VAL QG2 . 16380 1 441 . 1 1 43 43 VAL CA C 13 58.040 0.2 . 1 . . . . 43 VAL CA . 16380 1 442 . 1 1 43 43 VAL CB C 13 35.220 0.2 . 1 . . . . 43 VAL CB . 16380 1 443 . 1 1 43 43 VAL CG1 C 13 19.012 0.2 . 2 . . . . 43 VAL CG1 . 16380 1 444 . 1 1 43 43 VAL CG2 C 13 21.491 0.2 . 2 . . . . 43 VAL CG2 . 16380 1 445 . 1 1 43 43 VAL N N 15 117.190 0.15 . 1 . . . . 43 VAL N . 16380 1 446 . 1 1 44 44 ILE H H 1 9.056 0.008 . 1 . . . . 44 ILE H . 16380 1 447 . 1 1 44 44 ILE HA H 1 4.426 0.008 . 1 . . . . 44 ILE HA . 16380 1 448 . 1 1 44 44 ILE HB H 1 1.378 0.008 . 1 . . . . 44 ILE HB . 16380 1 449 . 1 1 44 44 ILE HD11 H 1 0.051 0.008 . 1 . . . . 44 ILE QD1 . 16380 1 450 . 1 1 44 44 ILE HD12 H 1 0.051 0.008 . 1 . . . . 44 ILE QD1 . 16380 1 451 . 1 1 44 44 ILE HD13 H 1 0.051 0.008 . 1 . . . . 44 ILE QD1 . 16380 1 452 . 1 1 44 44 ILE HG12 H 1 1.171 0.008 . 2 . . . . 44 ILE HG12 . 16380 1 453 . 1 1 44 44 ILE HG13 H 1 0.375 0.008 . 2 . . . . 44 ILE HG13 . 16380 1 454 . 1 1 44 44 ILE HG21 H 1 0.493 0.008 . 1 . . . . 44 ILE QG2 . 16380 1 455 . 1 1 44 44 ILE HG22 H 1 0.493 0.008 . 1 . . . . 44 ILE QG2 . 16380 1 456 . 1 1 44 44 ILE HG23 H 1 0.493 0.008 . 1 . . . . 44 ILE QG2 . 16380 1 457 . 1 1 44 44 ILE CA C 13 61.156 0.2 . 1 . . . . 44 ILE CA . 16380 1 458 . 1 1 44 44 ILE CB C 13 38.544 0.2 . 1 . . . . 44 ILE CB . 16380 1 459 . 1 1 44 44 ILE CD1 C 13 12.219 0.2 . 1 . . . . 44 ILE CD1 . 16380 1 460 . 1 1 44 44 ILE CG1 C 13 27.385 0.2 . 1 . . . . 44 ILE CG1 . 16380 1 461 . 1 1 44 44 ILE CG2 C 13 17.747 0.2 . 1 . . . . 44 ILE CG2 . 16380 1 462 . 1 1 44 44 ILE N N 15 122.963 0.15 . 1 . . . . 44 ILE N . 16380 1 463 . 1 1 45 45 ALA H H 1 8.701 0.008 . 1 . . . . 45 ALA H . 16380 1 464 . 1 1 45 45 ALA HA H 1 4.626 0.008 . 1 . . . . 45 ALA HA . 16380 1 465 . 1 1 45 45 ALA HB1 H 1 -0.318 0.008 . 1 . . . . 45 ALA QB . 16380 1 466 . 1 1 45 45 ALA HB2 H 1 -0.318 0.008 . 1 . . . . 45 ALA QB . 16380 1 467 . 1 1 45 45 ALA HB3 H 1 -0.318 0.008 . 1 . . . . 45 ALA QB . 16380 1 468 . 1 1 45 45 ALA CA C 13 51.430 0.2 . 1 . . . . 45 ALA CA . 16380 1 469 . 1 1 45 45 ALA CB C 13 21.670 0.2 . 1 . . . . 45 ALA CB . 16380 1 470 . 1 1 45 45 ALA N N 15 126.347 0.15 . 1 . . . . 45 ALA N . 16380 1 471 . 1 1 46 46 GLY H H 1 8.486 0.008 . 1 . . . . 46 GLY H . 16380 1 472 . 1 1 46 46 GLY HA2 H 1 4.587 0.008 . 2 . . . . 46 GLY HA2 . 16380 1 473 . 1 1 46 46 GLY HA3 H 1 4.084 0.008 . 2 . . . . 46 GLY HA3 . 16380 1 474 . 1 1 46 46 GLY CA C 13 44.500 0.2 . 1 . . . . 46 GLY CA . 16380 1 475 . 1 1 46 46 GLY N N 15 108.262 0.15 . 1 . . . . 46 GLY N . 16380 1 476 . 1 1 47 47 GLU H H 1 8.938 0.008 . 1 . . . . 47 GLU H . 16380 1 477 . 1 1 47 47 GLU HA H 1 4.003 0.008 . 1 . . . . 47 GLU HA . 16380 1 478 . 1 1 47 47 GLU HB2 H 1 1.810 0.008 . 2 . . . . 47 GLU HB2 . 16380 1 479 . 1 1 47 47 GLU HB3 H 1 1.740 0.008 . 2 . . . . 47 GLU HB3 . 16380 1 480 . 1 1 47 47 GLU CA C 13 58.820 0.2 . 1 . . . . 47 GLU CA . 16380 1 481 . 1 1 47 47 GLU CB C 13 29.500 0.2 . 1 . . . . 47 GLU CB . 16380 1 482 . 1 1 47 47 GLU N N 15 118.010 0.15 . 1 . . . . 47 GLU N . 16380 1 483 . 1 1 48 48 HIS H H 1 8.742 0.008 . 1 . . . . 48 HIS H . 16380 1 484 . 1 1 48 48 HIS HA H 1 4.704 0.008 . 1 . . . . 48 HIS HA . 16380 1 485 . 1 1 48 48 HIS HB2 H 1 3.008 0.008 . 2 . . . . 48 HIS HB2 . 16380 1 486 . 1 1 48 48 HIS HB3 H 1 3.370 0.008 . 2 . . . . 48 HIS HB3 . 16380 1 487 . 1 1 48 48 HIS HD2 H 1 7.213 0.008 . 1 . . . . 48 HIS HD2 . 16380 1 488 . 1 1 48 48 HIS CA C 13 55.130 0.2 . 1 . . . . 48 HIS CA . 16380 1 489 . 1 1 48 48 HIS CB C 13 29.110 0.2 . 1 . . . . 48 HIS CB . 16380 1 490 . 1 1 48 48 HIS CD2 C 13 120.211 0.2 . 1 . . . . 48 HIS CD2 . 16380 1 491 . 1 1 48 48 HIS N N 15 115.306 0.15 . 1 . . . . 48 HIS N . 16380 1 492 . 1 1 49 49 ASN H H 1 7.810 0.008 . 1 . . . . 49 ASN H . 16380 1 493 . 1 1 49 49 ASN HA H 1 3.878 0.008 . 1 . . . . 49 ASN HA . 16380 1 494 . 1 1 49 49 ASN HB2 H 1 2.188 0.008 . 2 . . . . 49 ASN HB2 . 16380 1 495 . 1 1 49 49 ASN HB3 H 1 3.193 0.008 . 2 . . . . 49 ASN HB3 . 16380 1 496 . 1 1 49 49 ASN HD21 H 1 7.835 0.008 . 2 . . . . 49 ASN HD21 . 16380 1 497 . 1 1 49 49 ASN HD22 H 1 6.871 0.008 . 2 . . . . 49 ASN HD22 . 16380 1 498 . 1 1 49 49 ASN CA C 13 53.876 0.2 . 1 . . . . 49 ASN CA . 16380 1 499 . 1 1 49 49 ASN CB C 13 36.030 0.2 . 1 . . . . 49 ASN CB . 16380 1 500 . 1 1 49 49 ASN N N 15 114.919 0.15 . 1 . . . . 49 ASN N . 16380 1 501 . 1 1 49 49 ASN ND2 N 15 113.084 0.15 . 1 . . . . 49 ASN ND2 . 16380 1 502 . 1 1 50 50 ILE H H 1 7.046 0.008 . 1 . . . . 50 ILE H . 16380 1 503 . 1 1 50 50 ILE HA H 1 4.022 0.008 . 1 . . . . 50 ILE HA . 16380 1 504 . 1 1 50 50 ILE HB H 1 1.471 0.008 . 1 . . . . 50 ILE HB . 16380 1 505 . 1 1 50 50 ILE HD11 H 1 0.878 0.008 . 1 . . . . 50 ILE QD1 . 16380 1 506 . 1 1 50 50 ILE HD12 H 1 0.878 0.008 . 1 . . . . 50 ILE QD1 . 16380 1 507 . 1 1 50 50 ILE HD13 H 1 0.878 0.008 . 1 . . . . 50 ILE QD1 . 16380 1 508 . 1 1 50 50 ILE HG12 H 1 1.585 0.008 . 2 . . . . 50 ILE HG12 . 16380 1 509 . 1 1 50 50 ILE HG13 H 1 1.006 0.008 . 2 . . . . 50 ILE HG13 . 16380 1 510 . 1 1 50 50 ILE HG21 H 1 -0.217 0.008 . 1 . . . . 50 ILE QG2 . 16380 1 511 . 1 1 50 50 ILE HG22 H 1 -0.217 0.008 . 1 . . . . 50 ILE QG2 . 16380 1 512 . 1 1 50 50 ILE HG23 H 1 -0.217 0.008 . 1 . . . . 50 ILE QG2 . 16380 1 513 . 1 1 50 50 ILE CA C 13 59.430 0.2 . 1 . . . . 50 ILE CA . 16380 1 514 . 1 1 50 50 ILE CB C 13 41.326 0.2 . 1 . . . . 50 ILE CB . 16380 1 515 . 1 1 50 50 ILE CD1 C 13 13.726 0.2 . 1 . . . . 50 ILE CD1 . 16380 1 516 . 1 1 50 50 ILE CG1 C 13 30.358 0.2 . 1 . . . . 50 ILE CG1 . 16380 1 517 . 1 1 50 50 ILE CG2 C 13 16.275 0.2 . 1 . . . . 50 ILE CG2 . 16380 1 518 . 1 1 50 50 ILE N N 15 120.995 0.15 . 1 . . . . 50 ILE N . 16380 1 519 . 1 1 51 51 PRO HA H 1 5.194 0.008 . 1 . . . . 51 PRO HA . 16380 1 520 . 1 1 51 51 PRO HB2 H 1 1.261 0.008 . 2 . . . . 51 PRO HB2 . 16380 1 521 . 1 1 51 51 PRO CA C 13 60.560 0.2 . 1 . . . . 51 PRO CA . 16380 1 522 . 1 1 51 51 PRO CB C 13 31.841 0.2 . 1 . . . . 51 PRO CB . 16380 1 523 . 1 1 52 52 TRP H H 1 9.564 0.008 . 1 . . . . 52 TRP H . 16380 1 524 . 1 1 52 52 TRP HA H 1 4.805 0.008 . 1 . . . . 52 TRP HA . 16380 1 525 . 1 1 52 52 TRP HB3 H 1 2.993 0.008 . 2 . . . . 52 TRP HB3 . 16380 1 526 . 1 1 52 52 TRP HD1 H 1 6.728 0.008 . 1 . . . . 52 TRP HD1 . 16380 1 527 . 1 1 52 52 TRP HE1 H 1 8.617 0.008 . 1 . . . . 52 TRP HE1 . 16380 1 528 . 1 1 52 52 TRP HE3 H 1 6.974 0.008 . 1 . . . . 52 TRP HE3 . 16380 1 529 . 1 1 52 52 TRP HH2 H 1 7.016 0.008 . 1 . . . . 52 TRP HH2 . 16380 1 530 . 1 1 52 52 TRP HZ2 H 1 7.366 0.008 . 1 . . . . 52 TRP HZ2 . 16380 1 531 . 1 1 52 52 TRP HZ3 H 1 6.225 0.008 . 1 . . . . 52 TRP HZ3 . 16380 1 532 . 1 1 52 52 TRP CA C 13 56.550 0.2 . 1 . . . . 52 TRP CA . 16380 1 533 . 1 1 52 52 TRP CB C 13 32.300 0.2 . 1 . . . . 52 TRP CB . 16380 1 534 . 1 1 52 52 TRP CD1 C 13 130.410 0.2 . 1 . . . . 52 TRP CD1 . 16380 1 535 . 1 1 52 52 TRP CE3 C 13 120.588 0.2 . 1 . . . . 52 TRP CE3 . 16380 1 536 . 1 1 52 52 TRP CH2 C 13 123.117 0.2 . 1 . . . . 52 TRP CH2 . 16380 1 537 . 1 1 52 52 TRP CZ2 C 13 113.681 0.2 . 1 . . . . 52 TRP CZ2 . 16380 1 538 . 1 1 52 52 TRP CZ3 C 13 120.777 0.2 . 1 . . . . 52 TRP CZ3 . 16380 1 539 . 1 1 52 52 TRP N N 15 123.070 0.15 . 1 . . . . 52 TRP N . 16380 1 540 . 1 1 52 52 TRP NE1 N 15 129.382 0.15 . 1 . . . . 52 TRP NE1 . 16380 1 541 . 1 1 53 53 LEU H H 1 7.227 0.008 . 1 . . . . 53 LEU H . 16380 1 542 . 1 1 53 53 LEU HA H 1 4.863 0.008 . 1 . . . . 53 LEU HA . 16380 1 543 . 1 1 53 53 LEU HB2 H 1 1.728 0.008 . 2 . . . . 53 LEU HB2 . 16380 1 544 . 1 1 53 53 LEU HB3 H 1 0.164 0.008 . 2 . . . . 53 LEU HB3 . 16380 1 545 . 1 1 53 53 LEU HD11 H 1 0.179 0.008 . 2 . . . . 53 LEU QD1 . 16380 1 546 . 1 1 53 53 LEU HD12 H 1 0.179 0.008 . 2 . . . . 53 LEU QD1 . 16380 1 547 . 1 1 53 53 LEU HD13 H 1 0.179 0.008 . 2 . . . . 53 LEU QD1 . 16380 1 548 . 1 1 53 53 LEU HD21 H 1 0.495 0.008 . 2 . . . . 53 LEU QD2 . 16380 1 549 . 1 1 53 53 LEU HD22 H 1 0.495 0.008 . 2 . . . . 53 LEU QD2 . 16380 1 550 . 1 1 53 53 LEU HD23 H 1 0.495 0.008 . 2 . . . . 53 LEU QD2 . 16380 1 551 . 1 1 53 53 LEU HG H 1 0.973 0.008 . 1 . . . . 53 LEU HG . 16380 1 552 . 1 1 53 53 LEU CA C 13 53.790 0.2 . 1 . . . . 53 LEU CA . 16380 1 553 . 1 1 53 53 LEU CB C 13 42.250 0.2 . 1 . . . . 53 LEU CB . 16380 1 554 . 1 1 53 53 LEU CD1 C 13 25.436 0.2 . 2 . . . . 53 LEU CD1 . 16380 1 555 . 1 1 53 53 LEU CD2 C 13 27.117 0.2 . 2 . . . . 53 LEU CD2 . 16380 1 556 . 1 1 53 53 LEU CG C 13 27.052 0.2 . 1 . . . . 53 LEU CG . 16380 1 557 . 1 1 53 53 LEU N N 15 124.700 0.15 . 1 . . . . 53 LEU N . 16380 1 558 . 1 1 54 54 LEU H H 1 9.021 0.008 . 1 . . . . 54 LEU H . 16380 1 559 . 1 1 54 54 LEU HA H 1 4.618 0.008 . 1 . . . . 54 LEU HA . 16380 1 560 . 1 1 54 54 LEU HB2 H 1 1.476 0.008 . 2 . . . . 54 LEU HB2 . 16380 1 561 . 1 1 54 54 LEU HB3 H 1 0.782 0.008 . 2 . . . . 54 LEU HB3 . 16380 1 562 . 1 1 54 54 LEU HD11 H 1 0.253 0.008 . 2 . . . . 54 LEU QD1 . 16380 1 563 . 1 1 54 54 LEU HD12 H 1 0.253 0.008 . 2 . . . . 54 LEU QD1 . 16380 1 564 . 1 1 54 54 LEU HD13 H 1 0.253 0.008 . 2 . . . . 54 LEU QD1 . 16380 1 565 . 1 1 54 54 LEU HD21 H 1 0.500 0.008 . 2 . . . . 54 LEU QD2 . 16380 1 566 . 1 1 54 54 LEU HD22 H 1 0.500 0.008 . 2 . . . . 54 LEU QD2 . 16380 1 567 . 1 1 54 54 LEU HD23 H 1 0.500 0.008 . 2 . . . . 54 LEU QD2 . 16380 1 568 . 1 1 54 54 LEU HG H 1 1.622 0.008 . 1 . . . . 54 LEU HG . 16380 1 569 . 1 1 54 54 LEU CA C 13 54.030 0.2 . 1 . . . . 54 LEU CA . 16380 1 570 . 1 1 54 54 LEU CB C 13 40.360 0.2 . 1 . . . . 54 LEU CB . 16380 1 571 . 1 1 54 54 LEU CD1 C 13 24.698 0.2 . 2 . . . . 54 LEU CD1 . 16380 1 572 . 1 1 54 54 LEU CD2 C 13 22.839 0.2 . 2 . . . . 54 LEU CD2 . 16380 1 573 . 1 1 54 54 LEU CG C 13 26.535 0.2 . 1 . . . . 54 LEU CG . 16380 1 574 . 1 1 54 54 LEU N N 15 126.893 0.15 . 1 . . . . 54 LEU N . 16380 1 575 . 1 1 55 55 TYR H H 1 8.884 0.008 . 1 . . . . 55 TYR H . 16380 1 576 . 1 1 55 55 TYR HA H 1 4.562 0.008 . 1 . . . . 55 TYR HA . 16380 1 577 . 1 1 55 55 TYR HB2 H 1 2.764 0.008 . 2 . . . . 55 TYR HB2 . 16380 1 578 . 1 1 55 55 TYR HB3 H 1 3.303 0.008 . 2 . . . . 55 TYR HB3 . 16380 1 579 . 1 1 55 55 TYR HD1 H 1 7.128 0.008 . 3 . . . . 55 TYR QD . 16380 1 580 . 1 1 55 55 TYR HD2 H 1 7.128 0.008 . 3 . . . . 55 TYR QD . 16380 1 581 . 1 1 55 55 TYR HE1 H 1 6.862 0.008 . 3 . . . . 55 TYR QE . 16380 1 582 . 1 1 55 55 TYR HE2 H 1 6.862 0.008 . 3 . . . . 55 TYR QE . 16380 1 583 . 1 1 55 55 TYR CA C 13 58.420 0.2 . 1 . . . . 55 TYR CA . 16380 1 584 . 1 1 55 55 TYR CB C 13 36.180 0.2 . 1 . . . . 55 TYR CB . 16380 1 585 . 1 1 55 55 TYR CD1 C 13 133.152 0.2 . 3 . . . . 55 TYR CD1 . 16380 1 586 . 1 1 55 55 TYR CE1 C 13 117.976 0.2 . 3 . . . . 55 TYR CE1 . 16380 1 587 . 1 1 55 55 TYR N N 15 123.430 0.15 . 1 . . . . 55 TYR N . 16380 1 588 . 1 1 56 56 LEU H H 1 8.192 0.008 . 1 . . . . 56 LEU H . 16380 1 589 . 1 1 56 56 LEU HA H 1 4.530 0.008 . 1 . . . . 56 LEU HA . 16380 1 590 . 1 1 56 56 LEU HB2 H 1 1.368 0.008 . 2 . . . . 56 LEU HB2 . 16380 1 591 . 1 1 56 56 LEU HB3 H 1 0.974 0.008 . 2 . . . . 56 LEU HB3 . 16380 1 592 . 1 1 56 56 LEU HD11 H 1 0.708 0.008 . 2 . . . . 56 LEU QD1 . 16380 1 593 . 1 1 56 56 LEU HD12 H 1 0.708 0.008 . 2 . . . . 56 LEU QD1 . 16380 1 594 . 1 1 56 56 LEU HD13 H 1 0.708 0.008 . 2 . . . . 56 LEU QD1 . 16380 1 595 . 1 1 56 56 LEU HD21 H 1 0.803 0.008 . 2 . . . . 56 LEU QD2 . 16380 1 596 . 1 1 56 56 LEU HD22 H 1 0.803 0.008 . 2 . . . . 56 LEU QD2 . 16380 1 597 . 1 1 56 56 LEU HD23 H 1 0.803 0.008 . 2 . . . . 56 LEU QD2 . 16380 1 598 . 1 1 56 56 LEU CA C 13 51.720 0.2 . 1 . . . . 56 LEU CA . 16380 1 599 . 1 1 56 56 LEU CB C 13 43.260 0.2 . 1 . . . . 56 LEU CB . 16380 1 600 . 1 1 56 56 LEU CD1 C 13 25.367 0.2 . 2 . . . . 56 LEU CD1 . 16380 1 601 . 1 1 56 56 LEU CD2 C 13 25.270 0.2 . 2 . . . . 56 LEU CD2 . 16380 1 602 . 1 1 56 56 LEU N N 15 130.832 0.15 . 1 . . . . 56 LEU N . 16380 1 603 . 1 1 57 57 PRO HA H 1 3.779 0.008 . 1 . . . . 57 PRO HA . 16380 1 604 . 1 1 57 57 PRO HB2 H 1 1.730 0.008 . 2 . . . . 57 PRO HB2 . 16380 1 605 . 1 1 57 57 PRO HB3 H 1 1.566 0.008 . 2 . . . . 57 PRO HB3 . 16380 1 606 . 1 1 57 57 PRO HD2 H 1 2.527 0.008 . 2 . . . . 57 PRO HD2 . 16380 1 607 . 1 1 57 57 PRO HD3 H 1 3.353 0.008 . 2 . . . . 57 PRO HD3 . 16380 1 608 . 1 1 57 57 PRO HG2 H 1 1.618 0.008 . 2 . . . . 57 PRO HG2 . 16380 1 609 . 1 1 57 57 PRO HG3 H 1 1.844 0.008 . 2 . . . . 57 PRO HG3 . 16380 1 610 . 1 1 57 57 PRO CA C 13 62.240 0.2 . 1 . . . . 57 PRO CA . 16380 1 611 . 1 1 57 57 PRO CB C 13 31.130 0.2 . 1 . . . . 57 PRO CB . 16380 1 612 . 1 1 57 57 PRO CD C 13 49.606 0.2 . 1 . . . . 57 PRO CD . 16380 1 613 . 1 1 57 57 PRO CG C 13 27.418 0.2 . 1 . . . . 57 PRO CG . 16380 1 614 . 1 1 58 58 GLY H H 1 8.908 0.008 . 1 . . . . 58 GLY H . 16380 1 615 . 1 1 58 58 GLY HA2 H 1 4.027 0.008 . 2 . . . . 58 GLY HA2 . 16380 1 616 . 1 1 58 58 GLY HA3 H 1 3.433 0.008 . 2 . . . . 58 GLY HA3 . 16380 1 617 . 1 1 58 58 GLY CA C 13 44.860 0.2 . 1 . . . . 58 GLY CA . 16380 1 618 . 1 1 58 58 GLY N N 15 112.351 0.15 . 1 . . . . 58 GLY N . 16380 1 619 . 1 1 59 59 LYS H H 1 7.214 0.008 . 1 . . . . 59 LYS H . 16380 1 620 . 1 1 59 59 LYS HA H 1 4.386 0.008 . 1 . . . . 59 LYS HA . 16380 1 621 . 1 1 59 59 LYS HB2 H 1 1.550 0.008 . 2 . . . . 59 LYS HB2 . 16380 1 622 . 1 1 59 59 LYS HB3 H 1 1.515 0.008 . 2 . . . . 59 LYS HB3 . 16380 1 623 . 1 1 59 59 LYS HD2 H 1 1.481 0.008 . 2 . . . . 59 LYS HD2 . 16380 1 624 . 1 1 59 59 LYS HD3 H 1 1.575 0.008 . 2 . . . . 59 LYS HD3 . 16380 1 625 . 1 1 59 59 LYS HE2 H 1 2.895 0.008 . 2 . . . . 59 LYS HE2 . 16380 1 626 . 1 1 59 59 LYS HE3 H 1 2.837 0.008 . 2 . . . . 59 LYS HE3 . 16380 1 627 . 1 1 59 59 LYS HG2 H 1 1.144 0.008 . 2 . . . . 59 LYS HG2 . 16380 1 628 . 1 1 59 59 LYS HG3 H 1 1.251 0.008 . 2 . . . . 59 LYS HG3 . 16380 1 629 . 1 1 59 59 LYS CA C 13 53.760 0.2 . 1 . . . . 59 LYS CA . 16380 1 630 . 1 1 59 59 LYS CB C 13 34.590 0.2 . 1 . . . . 59 LYS CB . 16380 1 631 . 1 1 59 59 LYS CD C 13 28.483 0.2 . 1 . . . . 59 LYS CD . 16380 1 632 . 1 1 59 59 LYS CE C 13 42.284 0.2 . 1 . . . . 59 LYS CE . 16380 1 633 . 1 1 59 59 LYS CG C 13 24.985 0.2 . 1 . . . . 59 LYS CG . 16380 1 634 . 1 1 59 59 LYS N N 15 121.458 0.15 . 1 . . . . 59 LYS N . 16380 1 635 . 1 1 60 60 GLY H H 1 8.312 0.008 . 1 . . . . 60 GLY H . 16380 1 636 . 1 1 60 60 GLY HA2 H 1 3.379 0.008 . 2 . . . . 60 GLY HA2 . 16380 1 637 . 1 1 60 60 GLY HA3 H 1 3.229 0.008 . 2 . . . . 60 GLY HA3 . 16380 1 638 . 1 1 60 60 GLY CA C 13 45.350 0.2 . 1 . . . . 60 GLY CA . 16380 1 639 . 1 1 60 60 GLY N N 15 103.990 0.15 . 1 . . . . 60 GLY N . 16380 1 640 . 1 1 61 61 HIS H H 1 7.880 0.008 . 1 . . . . 61 HIS H . 16380 1 641 . 1 1 61 61 HIS HA H 1 4.868 0.008 . 1 . . . . 61 HIS HA . 16380 1 642 . 1 1 61 61 HIS HB2 H 1 2.694 0.008 . 2 . . . . 61 HIS HB2 . 16380 1 643 . 1 1 61 61 HIS HB3 H 1 3.270 0.008 . 2 . . . . 61 HIS HB3 . 16380 1 644 . 1 1 61 61 HIS HD2 H 1 6.873 0.008 . 1 . . . . 61 HIS HD2 . 16380 1 645 . 1 1 61 61 HIS CA C 13 53.920 0.2 . 1 . . . . 61 HIS CA . 16380 1 646 . 1 1 61 61 HIS CB C 13 33.020 0.2 . 1 . . . . 61 HIS CB . 16380 1 647 . 1 1 61 61 HIS CD2 C 13 120.370 0.2 . 1 . . . . 61 HIS CD2 . 16380 1 648 . 1 1 61 61 HIS N N 15 121.221 0.15 . 1 . . . . 61 HIS N . 16380 1 649 . 1 1 62 62 CYS H H 1 8.760 0.008 . 1 . . . . 62 CYS H . 16380 1 650 . 1 1 62 62 CYS HA H 1 4.248 0.008 . 1 . . . . 62 CYS HA . 16380 1 651 . 1 1 62 62 CYS HB2 H 1 2.564 0.008 . 2 . . . . 62 CYS HB2 . 16380 1 652 . 1 1 62 62 CYS HB3 H 1 3.328 0.008 . 2 . . . . 62 CYS HB3 . 16380 1 653 . 1 1 62 62 CYS CA C 13 61.730 0.2 . 1 . . . . 62 CYS CA . 16380 1 654 . 1 1 62 62 CYS CB C 13 26.560 0.2 . 1 . . . . 62 CYS CB . 16380 1 655 . 1 1 62 62 CYS N N 15 121.842 0.15 . 1 . . . . 62 CYS N . 16380 1 656 . 1 1 63 63 VAL H H 1 8.109 0.008 . 1 . . . . 63 VAL H . 16380 1 657 . 1 1 63 63 VAL HA H 1 4.869 0.008 . 1 . . . . 63 VAL HA . 16380 1 658 . 1 1 63 63 VAL HB H 1 1.974 0.008 . 1 . . . . 63 VAL HB . 16380 1 659 . 1 1 63 63 VAL HG11 H 1 1.123 0.008 . 2 . . . . 63 VAL QG1 . 16380 1 660 . 1 1 63 63 VAL HG12 H 1 1.123 0.008 . 2 . . . . 63 VAL QG1 . 16380 1 661 . 1 1 63 63 VAL HG13 H 1 1.123 0.008 . 2 . . . . 63 VAL QG1 . 16380 1 662 . 1 1 63 63 VAL HG21 H 1 1.229 0.008 . 2 . . . . 63 VAL QG2 . 16380 1 663 . 1 1 63 63 VAL HG22 H 1 1.229 0.008 . 2 . . . . 63 VAL QG2 . 16380 1 664 . 1 1 63 63 VAL HG23 H 1 1.229 0.008 . 2 . . . . 63 VAL QG2 . 16380 1 665 . 1 1 63 63 VAL CA C 13 62.210 0.2 . 1 . . . . 63 VAL CA . 16380 1 666 . 1 1 63 63 VAL CB C 13 34.780 0.2 . 1 . . . . 63 VAL CB . 16380 1 667 . 1 1 63 63 VAL CG1 C 13 22.336 0.2 . 2 . . . . 63 VAL CG1 . 16380 1 668 . 1 1 63 63 VAL CG2 C 13 22.267 0.2 . 2 . . . . 63 VAL CG2 . 16380 1 669 . 1 1 63 63 VAL N N 15 127.029 0.15 . 1 . . . . 63 VAL N . 16380 1 670 . 1 1 64 64 THR H H 1 8.453 0.008 . 1 . . . . 64 THR H . 16380 1 671 . 1 1 64 64 THR HA H 1 5.349 0.008 . 1 . . . . 64 THR HA . 16380 1 672 . 1 1 64 64 THR HB H 1 4.465 0.008 . 1 . . . . 64 THR HB . 16380 1 673 . 1 1 64 64 THR HG21 H 1 1.358 0.008 . 1 . . . . 64 THR QG2 . 16380 1 674 . 1 1 64 64 THR HG22 H 1 1.358 0.008 . 1 . . . . 64 THR QG2 . 16380 1 675 . 1 1 64 64 THR HG23 H 1 1.358 0.008 . 1 . . . . 64 THR QG2 . 16380 1 676 . 1 1 64 64 THR CA C 13 61.100 0.2 . 1 . . . . 64 THR CA . 16380 1 677 . 1 1 64 64 THR CB C 13 70.790 0.2 . 1 . . . . 64 THR CB . 16380 1 678 . 1 1 64 64 THR CG2 C 13 22.252 0.2 . 1 . . . . 64 THR CG2 . 16380 1 679 . 1 1 64 64 THR N N 15 116.830 0.15 . 1 . . . . 64 THR N . 16380 1 680 . 1 1 65 65 GLY H H 1 8.663 0.008 . 1 . . . . 65 GLY H . 16380 1 681 . 1 1 65 65 GLY HA2 H 1 4.085 0.008 . 2 . . . . 65 GLY HA2 . 16380 1 682 . 1 1 65 65 GLY HA3 H 1 3.480 0.008 . 2 . . . . 65 GLY HA3 . 16380 1 683 . 1 1 65 65 GLY CA C 13 46.570 0.2 . 1 . . . . 65 GLY CA . 16380 1 684 . 1 1 65 65 GLY N N 15 107.680 0.15 . 1 . . . . 65 GLY N . 16380 1 685 . 1 1 66 66 GLU H H 1 8.574 0.008 . 1 . . . . 66 GLU H . 16380 1 686 . 1 1 66 66 GLU HA H 1 5.150 0.008 . 1 . . . . 66 GLU HA . 16380 1 687 . 1 1 66 66 GLU HB2 H 1 2.337 0.008 . 2 . . . . 66 GLU HB2 . 16380 1 688 . 1 1 66 66 GLU HB3 H 1 2.397 0.008 . 2 . . . . 66 GLU HB3 . 16380 1 689 . 1 1 66 66 GLU CA C 13 54.450 0.2 . 1 . . . . 66 GLU CA . 16380 1 690 . 1 1 66 66 GLU CB C 13 37.328 0.2 . 1 . . . . 66 GLU CB . 16380 1 691 . 1 1 66 66 GLU N N 15 120.921 0.15 . 1 . . . . 66 GLU N . 16380 1 692 . 1 1 67 67 ILE H H 1 8.623 0.008 . 1 . . . . 67 ILE H . 16380 1 693 . 1 1 67 67 ILE HA H 1 5.149 0.008 . 1 . . . . 67 ILE HA . 16380 1 694 . 1 1 67 67 ILE HB H 1 1.044 0.008 . 1 . . . . 67 ILE HB . 16380 1 695 . 1 1 67 67 ILE HD11 H 1 0.702 0.008 . 1 . . . . 67 ILE QD1 . 16380 1 696 . 1 1 67 67 ILE HD12 H 1 0.702 0.008 . 1 . . . . 67 ILE QD1 . 16380 1 697 . 1 1 67 67 ILE HD13 H 1 0.702 0.008 . 1 . . . . 67 ILE QD1 . 16380 1 698 . 1 1 67 67 ILE HG12 H 1 1.537 0.008 . 2 . . . . 67 ILE HG12 . 16380 1 699 . 1 1 67 67 ILE HG13 H 1 1.027 0.008 . 2 . . . . 67 ILE HG13 . 16380 1 700 . 1 1 67 67 ILE HG21 H 1 0.817 0.008 . 1 . . . . 67 ILE QG2 . 16380 1 701 . 1 1 67 67 ILE HG22 H 1 0.817 0.008 . 1 . . . . 67 ILE QG2 . 16380 1 702 . 1 1 67 67 ILE HG23 H 1 0.817 0.008 . 1 . . . . 67 ILE QG2 . 16380 1 703 . 1 1 67 67 ILE CA C 13 60.180 0.2 . 1 . . . . 67 ILE CA . 16380 1 704 . 1 1 67 67 ILE CB C 13 40.210 0.2 . 1 . . . . 67 ILE CB . 16380 1 705 . 1 1 67 67 ILE CD1 C 13 14.735 0.2 . 1 . . . . 67 ILE CD1 . 16380 1 706 . 1 1 67 67 ILE CG1 C 13 28.425 0.2 . 1 . . . . 67 ILE CG1 . 16380 1 707 . 1 1 67 67 ILE CG2 C 13 17.906 0.2 . 1 . . . . 67 ILE CG2 . 16380 1 708 . 1 1 67 67 ILE N N 15 121.340 0.15 . 1 . . . . 67 ILE N . 16380 1 709 . 1 1 68 68 TYR H H 1 9.196 0.008 . 1 . . . . 68 TYR H . 16380 1 710 . 1 1 68 68 TYR HA H 1 5.001 0.008 . 1 . . . . 68 TYR HA . 16380 1 711 . 1 1 68 68 TYR HB2 H 1 2.557 0.008 . 2 . . . . 68 TYR HB2 . 16380 1 712 . 1 1 68 68 TYR HB3 H 1 2.439 0.008 . 2 . . . . 68 TYR HB3 . 16380 1 713 . 1 1 68 68 TYR HD1 H 1 6.768 0.008 . 3 . . . . 68 TYR QD . 16380 1 714 . 1 1 68 68 TYR HD2 H 1 6.768 0.008 . 3 . . . . 68 TYR QD . 16380 1 715 . 1 1 68 68 TYR HE1 H 1 6.983 0.008 . 3 . . . . 68 TYR QE . 16380 1 716 . 1 1 68 68 TYR HE2 H 1 6.983 0.008 . 3 . . . . 68 TYR QE . 16380 1 717 . 1 1 68 68 TYR CA C 13 56.270 0.2 . 1 . . . . 68 TYR CA . 16380 1 718 . 1 1 68 68 TYR CB C 13 41.480 0.2 . 1 . . . . 68 TYR CB . 16380 1 719 . 1 1 68 68 TYR CD1 C 13 132.098 0.2 . 3 . . . . 68 TYR CD1 . 16380 1 720 . 1 1 68 68 TYR CE1 C 13 118.458 0.2 . 3 . . . . 68 TYR CE1 . 16380 1 721 . 1 1 68 68 TYR N N 15 123.650 0.15 . 1 . . . . 68 TYR N . 16380 1 722 . 1 1 69 69 GLU H H 1 9.302 0.008 . 1 . . . . 69 GLU H . 16380 1 723 . 1 1 69 69 GLU HA H 1 5.066 0.008 . 1 . . . . 69 GLU HA . 16380 1 724 . 1 1 69 69 GLU HB2 H 1 1.929 0.008 . 2 . . . . 69 GLU HB2 . 16380 1 725 . 1 1 69 69 GLU HB3 H 1 1.849 0.008 . 2 . . . . 69 GLU HB3 . 16380 1 726 . 1 1 69 69 GLU HG2 H 1 1.926 0.008 . 2 . . . . 69 GLU HG2 . 16380 1 727 . 1 1 69 69 GLU HG3 H 1 2.038 0.008 . 2 . . . . 69 GLU HG3 . 16380 1 728 . 1 1 69 69 GLU CA C 13 55.180 0.2 . 1 . . . . 69 GLU CA . 16380 1 729 . 1 1 69 69 GLU CB C 13 31.420 0.2 . 1 . . . . 69 GLU CB . 16380 1 730 . 1 1 69 69 GLU CG C 13 35.953 0.2 . 1 . . . . 69 GLU CG . 16380 1 731 . 1 1 69 69 GLU N N 15 124.090 0.15 . 1 . . . . 69 GLU N . 16380 1 732 . 1 1 70 70 VAL H H 1 8.908 0.008 . 1 . . . . 70 VAL H . 16380 1 733 . 1 1 70 70 VAL HA H 1 5.556 0.008 . 1 . . . . 70 VAL HA . 16380 1 734 . 1 1 70 70 VAL HB H 1 2.314 0.008 . 1 . . . . 70 VAL HB . 16380 1 735 . 1 1 70 70 VAL HG11 H 1 0.858 0.008 . 2 . . . . 70 VAL QG1 . 16380 1 736 . 1 1 70 70 VAL HG12 H 1 0.858 0.008 . 2 . . . . 70 VAL QG1 . 16380 1 737 . 1 1 70 70 VAL HG13 H 1 0.858 0.008 . 2 . . . . 70 VAL QG1 . 16380 1 738 . 1 1 70 70 VAL HG21 H 1 0.724 0.008 . 2 . . . . 70 VAL QG2 . 16380 1 739 . 1 1 70 70 VAL HG22 H 1 0.724 0.008 . 2 . . . . 70 VAL QG2 . 16380 1 740 . 1 1 70 70 VAL HG23 H 1 0.724 0.008 . 2 . . . . 70 VAL QG2 . 16380 1 741 . 1 1 70 70 VAL CA C 13 57.780 0.2 . 1 . . . . 70 VAL CA . 16380 1 742 . 1 1 70 70 VAL CB C 13 35.400 0.2 . 1 . . . . 70 VAL CB . 16380 1 743 . 1 1 70 70 VAL CG1 C 13 22.114 0.2 . 2 . . . . 70 VAL CG1 . 16380 1 744 . 1 1 70 70 VAL CG2 C 13 19.284 0.2 . 2 . . . . 70 VAL CG2 . 16380 1 745 . 1 1 70 70 VAL N N 15 119.540 0.15 . 1 . . . . 70 VAL N . 16380 1 746 . 1 1 71 71 ASP H H 1 7.939 0.008 . 1 . . . . 71 ASP H . 16380 1 747 . 1 1 71 71 ASP HA H 1 4.909 0.008 . 1 . . . . 71 ASP HA . 16380 1 748 . 1 1 71 71 ASP HB2 H 1 2.708 0.008 . 2 . . . . 71 ASP HB2 . 16380 1 749 . 1 1 71 71 ASP HB3 H 1 3.266 0.008 . 2 . . . . 71 ASP HB3 . 16380 1 750 . 1 1 71 71 ASP CA C 13 51.240 0.2 . 1 . . . . 71 ASP CA . 16380 1 751 . 1 1 71 71 ASP CB C 13 42.210 0.2 . 1 . . . . 71 ASP CB . 16380 1 752 . 1 1 71 71 ASP N N 15 120.720 0.15 . 1 . . . . 71 ASP N . 16380 1 753 . 1 1 72 72 GLU H H 1 8.364 0.008 . 1 . . . . 72 GLU H . 16380 1 754 . 1 1 72 72 GLU HA H 1 3.869 0.008 . 1 . . . . 72 GLU HA . 16380 1 755 . 1 1 72 72 GLU HB2 H 1 1.984 0.008 . 2 . . . . 72 GLU HB2 . 16380 1 756 . 1 1 72 72 GLU HG2 H 1 2.294 0.008 . 2 . . . . 72 GLU HG2 . 16380 1 757 . 1 1 72 72 GLU CA C 13 59.775 0.2 . 1 . . . . 72 GLU CA . 16380 1 758 . 1 1 72 72 GLU CB C 13 29.140 0.2 . 1 . . . . 72 GLU CB . 16380 1 759 . 1 1 72 72 GLU CG C 13 36.654 0.2 . 1 . . . . 72 GLU CG . 16380 1 760 . 1 1 72 72 GLU N N 15 117.910 0.15 . 1 . . . . 72 GLU N . 16380 1 761 . 1 1 73 73 GLN H H 1 7.960 0.008 . 1 . . . . 73 GLN H . 16380 1 762 . 1 1 73 73 GLN HA H 1 3.899 0.008 . 1 . . . . 73 GLN HA . 16380 1 763 . 1 1 73 73 GLN HB2 H 1 2.082 0.008 . 2 . . . . 73 GLN HB2 . 16380 1 764 . 1 1 73 73 GLN HE21 H 1 7.363 0.008 . 2 . . . . 73 GLN HE21 . 16380 1 765 . 1 1 73 73 GLN HE22 H 1 6.656 0.008 . 2 . . . . 73 GLN HE22 . 16380 1 766 . 1 1 73 73 GLN HG2 H 1 2.396 0.008 . 2 . . . . 73 GLN HG2 . 16380 1 767 . 1 1 73 73 GLN CA C 13 59.570 0.2 . 1 . . . . 73 GLN CA . 16380 1 768 . 1 1 73 73 GLN CB C 13 27.810 0.2 . 1 . . . . 73 GLN CB . 16380 1 769 . 1 1 73 73 GLN CG C 13 33.354 0.2 . 1 . . . . 73 GLN CG . 16380 1 770 . 1 1 73 73 GLN N N 15 119.617 0.15 . 1 . . . . 73 GLN N . 16380 1 771 . 1 1 73 73 GLN NE2 N 15 111.729 0.15 . 1 . . . . 73 GLN NE2 . 16380 1 772 . 1 1 74 74 MET H H 1 8.489 0.008 . 1 . . . . 74 MET H . 16380 1 773 . 1 1 74 74 MET HA H 1 4.766 0.008 . 1 . . . . 74 MET HA . 16380 1 774 . 1 1 74 74 MET HB2 H 1 2.251 0.008 . 2 . . . . 74 MET HB2 . 16380 1 775 . 1 1 74 74 MET HB3 H 1 2.061 0.008 . 2 . . . . 74 MET HB3 . 16380 1 776 . 1 1 74 74 MET HE1 H 1 1.691 0.008 . 1 . . . . 74 MET QE . 16380 1 777 . 1 1 74 74 MET HE2 H 1 1.691 0.008 . 1 . . . . 74 MET QE . 16380 1 778 . 1 1 74 74 MET HE3 H 1 1.691 0.008 . 1 . . . . 74 MET QE . 16380 1 779 . 1 1 74 74 MET HG2 H 1 2.550 0.008 . 2 . . . . 74 MET HG2 . 16380 1 780 . 1 1 74 74 MET CA C 13 56.790 0.2 . 1 . . . . 74 MET CA . 16380 1 781 . 1 1 74 74 MET CB C 13 31.900 0.2 . 1 . . . . 74 MET CB . 16380 1 782 . 1 1 74 74 MET CE C 13 17.774 0.2 . 1 . . . . 74 MET CE . 16380 1 783 . 1 1 74 74 MET CG C 13 32.505 0.2 . 1 . . . . 74 MET CG . 16380 1 784 . 1 1 74 74 MET N N 15 121.800 0.15 . 1 . . . . 74 MET N . 16380 1 785 . 1 1 75 75 LEU H H 1 8.162 0.008 . 1 . . . . 75 LEU H . 16380 1 786 . 1 1 75 75 LEU HA H 1 3.897 0.008 . 1 . . . . 75 LEU HA . 16380 1 787 . 1 1 75 75 LEU HB2 H 1 1.438 0.008 . 2 . . . . 75 LEU HB2 . 16380 1 788 . 1 1 75 75 LEU HB3 H 1 1.542 0.008 . 2 . . . . 75 LEU HB3 . 16380 1 789 . 1 1 75 75 LEU HD11 H 1 0.492 0.008 . 2 . . . . 75 LEU QD1 . 16380 1 790 . 1 1 75 75 LEU HD12 H 1 0.492 0.008 . 2 . . . . 75 LEU QD1 . 16380 1 791 . 1 1 75 75 LEU HD13 H 1 0.492 0.008 . 2 . . . . 75 LEU QD1 . 16380 1 792 . 1 1 75 75 LEU HD21 H 1 0.546 0.008 . 2 . . . . 75 LEU QD2 . 16380 1 793 . 1 1 75 75 LEU HD22 H 1 0.546 0.008 . 2 . . . . 75 LEU QD2 . 16380 1 794 . 1 1 75 75 LEU HD23 H 1 0.546 0.008 . 2 . . . . 75 LEU QD2 . 16380 1 795 . 1 1 75 75 LEU HG H 1 0.724 0.008 . 1 . . . . 75 LEU HG . 16380 1 796 . 1 1 75 75 LEU CA C 13 58.230 0.2 . 1 . . . . 75 LEU CA . 16380 1 797 . 1 1 75 75 LEU CB C 13 42.160 0.2 . 1 . . . . 75 LEU CB . 16380 1 798 . 1 1 75 75 LEU CD1 C 13 24.936 0.2 . 2 . . . . 75 LEU CD1 . 16380 1 799 . 1 1 75 75 LEU CD2 C 13 24.517 0.2 . 2 . . . . 75 LEU CD2 . 16380 1 800 . 1 1 75 75 LEU CG C 13 19.262 0.2 . 1 . . . . 75 LEU CG . 16380 1 801 . 1 1 75 75 LEU N N 15 120.230 0.15 . 1 . . . . 75 LEU N . 16380 1 802 . 1 1 76 76 ARG H H 1 7.824 0.008 . 1 . . . . 76 ARG H . 16380 1 803 . 1 1 76 76 ARG HA H 1 3.952 0.008 . 1 . . . . 76 ARG HA . 16380 1 804 . 1 1 76 76 ARG HB2 H 1 1.912 0.008 . 2 . . . . 76 ARG HB2 . 16380 1 805 . 1 1 76 76 ARG HB3 H 1 1.885 0.008 . 2 . . . . 76 ARG HB3 . 16380 1 806 . 1 1 76 76 ARG HD2 H 1 3.156 0.008 . 2 . . . . 76 ARG HD2 . 16380 1 807 . 1 1 76 76 ARG HD3 H 1 3.188 0.008 . 2 . . . . 76 ARG HD3 . 16380 1 808 . 1 1 76 76 ARG HE H 1 7.408 0.008 . 1 . . . . 76 ARG HE . 16380 1 809 . 1 1 76 76 ARG HG2 H 1 1.626 0.008 . 2 . . . . 76 ARG HG2 . 16380 1 810 . 1 1 76 76 ARG HG3 H 1 1.767 0.008 . 2 . . . . 76 ARG HG3 . 16380 1 811 . 1 1 76 76 ARG CA C 13 59.270 0.2 . 1 . . . . 76 ARG CA . 16380 1 812 . 1 1 76 76 ARG CB C 13 29.930 0.2 . 1 . . . . 76 ARG CB . 16380 1 813 . 1 1 76 76 ARG CD C 13 43.499 0.2 . 1 . . . . 76 ARG CD . 16380 1 814 . 1 1 76 76 ARG CG C 13 27.852 0.2 . 1 . . . . 76 ARG CG . 16380 1 815 . 1 1 76 76 ARG N N 15 116.540 0.15 . 1 . . . . 76 ARG N . 16380 1 816 . 1 1 76 76 ARG NE N 15 85.111 0.15 . 1 . . . . 76 ARG NE . 16380 1 817 . 1 1 77 77 PHE H H 1 8.137 0.008 . 1 . . . . 77 PHE H . 16380 1 818 . 1 1 77 77 PHE HA H 1 4.085 0.008 . 1 . . . . 77 PHE HA . 16380 1 819 . 1 1 77 77 PHE HB2 H 1 3.265 0.008 . 2 . . . . 77 PHE HB2 . 16380 1 820 . 1 1 77 77 PHE HB3 H 1 3.310 0.008 . 2 . . . . 77 PHE HB3 . 16380 1 821 . 1 1 77 77 PHE HD1 H 1 6.919 0.008 . 3 . . . . 77 PHE QD . 16380 1 822 . 1 1 77 77 PHE HD2 H 1 6.919 0.008 . 3 . . . . 77 PHE QD . 16380 1 823 . 1 1 77 77 PHE HE1 H 1 6.598 0.008 . 3 . . . . 77 PHE QE . 16380 1 824 . 1 1 77 77 PHE HE2 H 1 6.598 0.008 . 3 . . . . 77 PHE QE . 16380 1 825 . 1 1 77 77 PHE CA C 13 61.980 0.2 . 1 . . . . 77 PHE CA . 16380 1 826 . 1 1 77 77 PHE CB C 13 38.530 0.2 . 1 . . . . 77 PHE CB . 16380 1 827 . 1 1 77 77 PHE CD1 C 13 131.757 0.2 . 3 . . . . 77 PHE CD1 . 16380 1 828 . 1 1 77 77 PHE CE1 C 13 130.268 0.2 . 3 . . . . 77 PHE CE1 . 16380 1 829 . 1 1 77 77 PHE N N 15 120.650 0.15 . 1 . . . . 77 PHE N . 16380 1 830 . 1 1 78 78 LEU H H 1 9.071 0.008 . 1 . . . . 78 LEU H . 16380 1 831 . 1 1 78 78 LEU HA H 1 3.629 0.008 . 1 . . . . 78 LEU HA . 16380 1 832 . 1 1 78 78 LEU HB2 H 1 2.147 0.008 . 2 . . . . 78 LEU HB2 . 16380 1 833 . 1 1 78 78 LEU HB3 H 1 1.179 0.008 . 2 . . . . 78 LEU HB3 . 16380 1 834 . 1 1 78 78 LEU HD11 H 1 0.665 0.008 . 2 . . . . 78 LEU QD1 . 16380 1 835 . 1 1 78 78 LEU HD12 H 1 0.665 0.008 . 2 . . . . 78 LEU QD1 . 16380 1 836 . 1 1 78 78 LEU HD13 H 1 0.665 0.008 . 2 . . . . 78 LEU QD1 . 16380 1 837 . 1 1 78 78 LEU HD21 H 1 0.477 0.008 . 2 . . . . 78 LEU QD2 . 16380 1 838 . 1 1 78 78 LEU HD22 H 1 0.477 0.008 . 2 . . . . 78 LEU QD2 . 16380 1 839 . 1 1 78 78 LEU HD23 H 1 0.477 0.008 . 2 . . . . 78 LEU QD2 . 16380 1 840 . 1 1 78 78 LEU HG H 1 1.829 0.008 . 1 . . . . 78 LEU HG . 16380 1 841 . 1 1 78 78 LEU CA C 13 57.730 0.2 . 1 . . . . 78 LEU CA . 16380 1 842 . 1 1 78 78 LEU CB C 13 41.420 0.2 . 1 . . . . 78 LEU CB . 16380 1 843 . 1 1 78 78 LEU CD1 C 13 26.627 0.2 . 2 . . . . 78 LEU CD1 . 16380 1 844 . 1 1 78 78 LEU CD2 C 13 22.293 0.2 . 2 . . . . 78 LEU CD2 . 16380 1 845 . 1 1 78 78 LEU CG C 13 26.837 0.2 . 1 . . . . 78 LEU CG . 16380 1 846 . 1 1 78 78 LEU N N 15 122.360 0.15 . 1 . . . . 78 LEU N . 16380 1 847 . 1 1 79 79 ASP H H 1 8.506 0.008 . 1 . . . . 79 ASP H . 16380 1 848 . 1 1 79 79 ASP HA H 1 4.320 0.008 . 1 . . . . 79 ASP HA . 16380 1 849 . 1 1 79 79 ASP HB2 H 1 2.845 0.008 . 2 . . . . 79 ASP HB2 . 16380 1 850 . 1 1 79 79 ASP HB3 H 1 2.577 0.008 . 2 . . . . 79 ASP HB3 . 16380 1 851 . 1 1 79 79 ASP CA C 13 57.190 0.2 . 1 . . . . 79 ASP CA . 16380 1 852 . 1 1 79 79 ASP CB C 13 39.420 0.2 . 1 . . . . 79 ASP CB . 16380 1 853 . 1 1 79 79 ASP N N 15 120.070 0.15 . 1 . . . . 79 ASP N . 16380 1 854 . 1 1 80 80 ASP H H 1 7.154 0.008 . 1 . . . . 80 ASP H . 16380 1 855 . 1 1 80 80 ASP HA H 1 4.501 0.008 . 1 . . . . 80 ASP HA . 16380 1 856 . 1 1 80 80 ASP HB2 H 1 2.596 0.008 . 2 . . . . 80 ASP HB2 . 16380 1 857 . 1 1 80 80 ASP HB3 H 1 2.515 0.008 . 2 . . . . 80 ASP HB3 . 16380 1 858 . 1 1 80 80 ASP CA C 13 56.700 0.2 . 1 . . . . 80 ASP CA . 16380 1 859 . 1 1 80 80 ASP CB C 13 40.660 0.2 . 1 . . . . 80 ASP CB . 16380 1 860 . 1 1 80 80 ASP N N 15 118.890 0.15 . 1 . . . . 80 ASP N . 16380 1 861 . 1 1 81 81 PHE H H 1 8.791 0.008 . 1 . . . . 81 PHE H . 16380 1 862 . 1 1 81 81 PHE HA H 1 3.659 0.008 . 1 . . . . 81 PHE HA . 16380 1 863 . 1 1 81 81 PHE HB2 H 1 2.280 0.008 . 2 . . . . 81 PHE HB2 . 16380 1 864 . 1 1 81 81 PHE HB3 H 1 2.580 0.008 . 2 . . . . 81 PHE HB3 . 16380 1 865 . 1 1 81 81 PHE HD1 H 1 6.841 0.008 . 3 . . . . 81 PHE QD . 16380 1 866 . 1 1 81 81 PHE HD2 H 1 6.841 0.008 . 3 . . . . 81 PHE QD . 16380 1 867 . 1 1 81 81 PHE CA C 13 61.640 0.2 . 1 . . . . 81 PHE CA . 16380 1 868 . 1 1 81 81 PHE CB C 13 40.210 0.2 . 1 . . . . 81 PHE CB . 16380 1 869 . 1 1 81 81 PHE CD1 C 13 131.487 0.2 . 3 . . . . 81 PHE CD1 . 16380 1 870 . 1 1 81 81 PHE N N 15 125.745 0.15 . 1 . . . . 81 PHE N . 16380 1 871 . 1 1 82 82 GLU H H 1 8.209 0.008 . 1 . . . . 82 GLU H . 16380 1 872 . 1 1 82 82 GLU HA H 1 3.956 0.008 . 1 . . . . 82 GLU HA . 16380 1 873 . 1 1 82 82 GLU HB2 H 1 1.683 0.008 . 2 . . . . 82 GLU HB2 . 16380 1 874 . 1 1 82 82 GLU HG3 H 1 1.304 0.008 . 2 . . . . 82 GLU HG3 . 16380 1 875 . 1 1 82 82 GLU CA C 13 55.060 0.2 . 1 . . . . 82 GLU CA . 16380 1 876 . 1 1 82 82 GLU CB C 13 28.910 0.2 . 1 . . . . 82 GLU CB . 16380 1 877 . 1 1 82 82 GLU CG C 13 29.093 0.2 . 1 . . . . 82 GLU CG . 16380 1 878 . 1 1 82 82 GLU N N 15 115.707 0.15 . 1 . . . . 82 GLU N . 16380 1 879 . 1 1 83 83 ASP H H 1 7.615 0.008 . 1 . . . . 83 ASP H . 16380 1 880 . 1 1 83 83 ASP HA H 1 4.236 0.008 . 1 . . . . 83 ASP HA . 16380 1 881 . 1 1 83 83 ASP HB2 H 1 2.256 0.008 . 2 . . . . 83 ASP HB2 . 16380 1 882 . 1 1 83 83 ASP HB3 H 1 3.192 0.008 . 2 . . . . 83 ASP HB3 . 16380 1 883 . 1 1 83 83 ASP CA C 13 54.370 0.2 . 1 . . . . 83 ASP CA . 16380 1 884 . 1 1 83 83 ASP CB C 13 39.400 0.2 . 1 . . . . 83 ASP CB . 16380 1 885 . 1 1 83 83 ASP N N 15 116.517 0.15 . 1 . . . . 83 ASP N . 16380 1 886 . 1 1 84 84 CYS H H 1 8.361 0.008 . 1 . . . . 84 CYS H . 16380 1 887 . 1 1 84 84 CYS HA H 1 5.522 0.008 . 1 . . . . 84 CYS HA . 16380 1 888 . 1 1 84 84 CYS HB2 H 1 2.651 0.008 . 2 . . . . 84 CYS HB2 . 16380 1 889 . 1 1 84 84 CYS HB3 H 1 3.050 0.008 . 2 . . . . 84 CYS HB3 . 16380 1 890 . 1 1 84 84 CYS CA C 13 56.617 0.2 . 1 . . . . 84 CYS CA . 16380 1 891 . 1 1 84 84 CYS CB C 13 27.651 0.2 . 1 . . . . 84 CYS CB . 16380 1 892 . 1 1 84 84 CYS N N 15 119.420 0.15 . 1 . . . . 84 CYS N . 16380 1 893 . 1 1 85 85 PRO HA H 1 5.704 0.008 . 1 . . . . 85 PRO HA . 16380 1 894 . 1 1 85 85 PRO HB2 H 1 2.408 0.008 . 2 . . . . 85 PRO HB2 . 16380 1 895 . 1 1 85 85 PRO HB3 H 1 2.173 0.008 . 2 . . . . 85 PRO HB3 . 16380 1 896 . 1 1 85 85 PRO HD2 H 1 3.479 0.008 . 2 . . . . 85 PRO HD2 . 16380 1 897 . 1 1 85 85 PRO HD3 H 1 3.519 0.008 . 2 . . . . 85 PRO HD3 . 16380 1 898 . 1 1 85 85 PRO HG2 H 1 1.968 0.008 . 2 . . . . 85 PRO HG2 . 16380 1 899 . 1 1 85 85 PRO HG3 H 1 1.658 0.008 . 2 . . . . 85 PRO HG3 . 16380 1 900 . 1 1 85 85 PRO CA C 13 64.355 0.2 . 1 . . . . 85 PRO CA . 16380 1 901 . 1 1 85 85 PRO CB C 13 33.190 0.2 . 1 . . . . 85 PRO CB . 16380 1 902 . 1 1 85 85 PRO CD C 13 49.372 0.2 . 1 . . . . 85 PRO CD . 16380 1 903 . 1 1 85 85 PRO CG C 13 24.186 0.2 . 1 . . . . 85 PRO CG . 16380 1 904 . 1 1 86 86 SER H H 1 8.389 0.008 . 1 . . . . 86 SER H . 16380 1 905 . 1 1 86 86 SER HA H 1 4.175 0.008 . 1 . . . . 86 SER HA . 16380 1 906 . 1 1 86 86 SER HB2 H 1 3.828 0.008 . 2 . . . . 86 SER HB2 . 16380 1 907 . 1 1 86 86 SER CA C 13 62.130 0.2 . 1 . . . . 86 SER CA . 16380 1 908 . 1 1 86 86 SER CB C 13 63.080 0.2 . 1 . . . . 86 SER CB . 16380 1 909 . 1 1 86 86 SER N N 15 122.195 0.15 . 1 . . . . 86 SER N . 16380 1 910 . 1 1 87 87 MET H H 1 8.576 0.008 . 1 . . . . 87 MET H . 16380 1 911 . 1 1 87 87 MET HA H 1 4.475 0.008 . 1 . . . . 87 MET HA . 16380 1 912 . 1 1 87 87 MET HB2 H 1 2.393 0.008 . 2 . . . . 87 MET HB2 . 16380 1 913 . 1 1 87 87 MET HB3 H 1 2.586 0.008 . 2 . . . . 87 MET HB3 . 16380 1 914 . 1 1 87 87 MET HE1 H 1 2.091 0.008 . 1 . . . . 87 MET QE . 16380 1 915 . 1 1 87 87 MET HE2 H 1 2.091 0.008 . 1 . . . . 87 MET QE . 16380 1 916 . 1 1 87 87 MET HE3 H 1 2.091 0.008 . 1 . . . . 87 MET QE . 16380 1 917 . 1 1 87 87 MET HG3 H 1 2.841 0.008 . 2 . . . . 87 MET HG3 . 16380 1 918 . 1 1 87 87 MET CA C 13 57.520 0.2 . 1 . . . . 87 MET CA . 16380 1 919 . 1 1 87 87 MET CB C 13 33.210 0.2 . 1 . . . . 87 MET CB . 16380 1 920 . 1 1 87 87 MET CE C 13 17.734 0.2 . 1 . . . . 87 MET CE . 16380 1 921 . 1 1 87 87 MET CG C 13 32.972 0.2 . 1 . . . . 87 MET CG . 16380 1 922 . 1 1 87 87 MET N N 15 121.299 0.15 . 1 . . . . 87 MET N . 16380 1 923 . 1 1 88 88 TYR H H 1 6.778 0.008 . 1 . . . . 88 TYR H . 16380 1 924 . 1 1 88 88 TYR HA H 1 5.023 0.008 . 1 . . . . 88 TYR HA . 16380 1 925 . 1 1 88 88 TYR HB2 H 1 2.671 0.008 . 2 . . . . 88 TYR HB2 . 16380 1 926 . 1 1 88 88 TYR HB3 H 1 3.212 0.008 . 2 . . . . 88 TYR HB3 . 16380 1 927 . 1 1 88 88 TYR HD1 H 1 7.250 0.008 . 3 . . . . 88 TYR QD . 16380 1 928 . 1 1 88 88 TYR HD2 H 1 7.250 0.008 . 3 . . . . 88 TYR QD . 16380 1 929 . 1 1 88 88 TYR HE1 H 1 6.495 0.008 . 3 . . . . 88 TYR QE . 16380 1 930 . 1 1 88 88 TYR HE2 H 1 6.495 0.008 . 3 . . . . 88 TYR QE . 16380 1 931 . 1 1 88 88 TYR CA C 13 56.300 0.2 . 1 . . . . 88 TYR CA . 16380 1 932 . 1 1 88 88 TYR CB C 13 42.530 0.2 . 1 . . . . 88 TYR CB . 16380 1 933 . 1 1 88 88 TYR CD1 C 13 133.576 0.2 . 3 . . . . 88 TYR CD1 . 16380 1 934 . 1 1 88 88 TYR CE1 C 13 117.690 0.2 . 3 . . . . 88 TYR CE1 . 16380 1 935 . 1 1 88 88 TYR N N 15 113.420 0.15 . 1 . . . . 88 TYR N . 16380 1 936 . 1 1 89 89 GLN H H 1 9.567 0.008 . 1 . . . . 89 GLN H . 16380 1 937 . 1 1 89 89 GLN HA H 1 4.857 0.008 . 1 . . . . 89 GLN HA . 16380 1 938 . 1 1 89 89 GLN HB2 H 1 1.867 0.008 . 2 . . . . 89 GLN HB2 . 16380 1 939 . 1 1 89 89 GLN HB3 H 1 2.014 0.008 . 2 . . . . 89 GLN HB3 . 16380 1 940 . 1 1 89 89 GLN HE21 H 1 7.250 0.008 . 2 . . . . 89 GLN HE21 . 16380 1 941 . 1 1 89 89 GLN HE22 H 1 6.362 0.008 . 2 . . . . 89 GLN HE22 . 16380 1 942 . 1 1 89 89 GLN HG2 H 1 2.415 0.008 . 2 . . . . 89 GLN HG2 . 16380 1 943 . 1 1 89 89 GLN HG3 H 1 2.366 0.008 . 2 . . . . 89 GLN HG3 . 16380 1 944 . 1 1 89 89 GLN CA C 13 55.870 0.2 . 1 . . . . 89 GLN CA . 16380 1 945 . 1 1 89 89 GLN CB C 13 30.430 0.2 . 1 . . . . 89 GLN CB . 16380 1 946 . 1 1 89 89 GLN CG C 13 35.078 0.2 . 1 . . . . 89 GLN CG . 16380 1 947 . 1 1 89 89 GLN N N 15 115.440 0.15 . 1 . . . . 89 GLN N . 16380 1 948 . 1 1 89 89 GLN NE2 N 15 112.016 0.15 . 1 . . . . 89 GLN NE2 . 16380 1 949 . 1 1 90 90 ARG H H 1 8.772 0.008 . 1 . . . . 90 ARG H . 16380 1 950 . 1 1 90 90 ARG HA H 1 4.499 0.008 . 1 . . . . 90 ARG HA . 16380 1 951 . 1 1 90 90 ARG HB2 H 1 1.396 0.008 . 2 . . . . 90 ARG HB2 . 16380 1 952 . 1 1 90 90 ARG HB3 H 1 1.659 0.008 . 2 . . . . 90 ARG HB3 . 16380 1 953 . 1 1 90 90 ARG HD2 H 1 2.564 0.008 . 2 . . . . 90 ARG HD2 . 16380 1 954 . 1 1 90 90 ARG HD3 H 1 2.123 0.008 . 2 . . . . 90 ARG HD3 . 16380 1 955 . 1 1 90 90 ARG HE H 1 9.717 0.008 . 1 . . . . 90 ARG HE . 16380 1 956 . 1 1 90 90 ARG HG2 H 1 0.633 0.008 . 2 . . . . 90 ARG HG2 . 16380 1 957 . 1 1 90 90 ARG HG3 H 1 1.169 0.008 . 2 . . . . 90 ARG HG3 . 16380 1 958 . 1 1 90 90 ARG CA C 13 56.620 0.2 . 1 . . . . 90 ARG CA . 16380 1 959 . 1 1 90 90 ARG CB C 13 29.020 0.2 . 1 . . . . 90 ARG CB . 16380 1 960 . 1 1 90 90 ARG CD C 13 41.536 0.2 . 1 . . . . 90 ARG CD . 16380 1 961 . 1 1 90 90 ARG CG C 13 26.454 0.2 . 1 . . . . 90 ARG CG . 16380 1 962 . 1 1 90 90 ARG N N 15 123.860 0.15 . 1 . . . . 90 ARG N . 16380 1 963 . 1 1 90 90 ARG NE N 15 81.159 0.15 . 1 . . . . 90 ARG NE . 16380 1 964 . 1 1 91 91 THR H H 1 9.217 0.008 . 1 . . . . 91 THR H . 16380 1 965 . 1 1 91 91 THR HA H 1 4.518 0.008 . 1 . . . . 91 THR HA . 16380 1 966 . 1 1 91 91 THR HB H 1 3.909 0.008 . 1 . . . . 91 THR HB . 16380 1 967 . 1 1 91 91 THR HG21 H 1 0.840 0.008 . 1 . . . . 91 THR QG2 . 16380 1 968 . 1 1 91 91 THR HG22 H 1 0.840 0.008 . 1 . . . . 91 THR QG2 . 16380 1 969 . 1 1 91 91 THR HG23 H 1 0.840 0.008 . 1 . . . . 91 THR QG2 . 16380 1 970 . 1 1 91 91 THR CA C 13 60.570 0.2 . 1 . . . . 91 THR CA . 16380 1 971 . 1 1 91 91 THR CB C 13 71.050 0.2 . 1 . . . . 91 THR CB . 16380 1 972 . 1 1 91 91 THR CG2 C 13 21.232 0.2 . 1 . . . . 91 THR CG2 . 16380 1 973 . 1 1 91 91 THR N N 15 125.064 0.15 . 1 . . . . 91 THR N . 16380 1 974 . 1 1 92 92 ALA H H 1 8.655 0.008 . 1 . . . . 92 ALA H . 16380 1 975 . 1 1 92 92 ALA HA H 1 5.041 0.008 . 1 . . . . 92 ALA HA . 16380 1 976 . 1 1 92 92 ALA HB1 H 1 1.045 0.008 . 1 . . . . 92 ALA QB . 16380 1 977 . 1 1 92 92 ALA HB2 H 1 1.045 0.008 . 1 . . . . 92 ALA QB . 16380 1 978 . 1 1 92 92 ALA HB3 H 1 1.045 0.008 . 1 . . . . 92 ALA QB . 16380 1 979 . 1 1 92 92 ALA CA C 13 51.320 0.2 . 1 . . . . 92 ALA CA . 16380 1 980 . 1 1 92 92 ALA CB C 13 19.480 0.2 . 1 . . . . 92 ALA CB . 16380 1 981 . 1 1 92 92 ALA N N 15 126.963 0.15 . 1 . . . . 92 ALA N . 16380 1 982 . 1 1 93 93 LEU H H 1 9.005 0.008 . 1 . . . . 93 LEU H . 16380 1 983 . 1 1 93 93 LEU HA H 1 4.720 0.008 . 1 . . . . 93 LEU HA . 16380 1 984 . 1 1 93 93 LEU HB2 H 1 1.448 0.008 . 2 . . . . 93 LEU HB2 . 16380 1 985 . 1 1 93 93 LEU HB3 H 1 1.600 0.008 . 2 . . . . 93 LEU HB3 . 16380 1 986 . 1 1 93 93 LEU HD11 H 1 0.831 0.008 . 2 . . . . 93 LEU QD1 . 16380 1 987 . 1 1 93 93 LEU HD12 H 1 0.831 0.008 . 2 . . . . 93 LEU QD1 . 16380 1 988 . 1 1 93 93 LEU HD13 H 1 0.831 0.008 . 2 . . . . 93 LEU QD1 . 16380 1 989 . 1 1 93 93 LEU HD21 H 1 1.119 0.008 . 2 . . . . 93 LEU QD2 . 16380 1 990 . 1 1 93 93 LEU HD22 H 1 1.119 0.008 . 2 . . . . 93 LEU QD2 . 16380 1 991 . 1 1 93 93 LEU HD23 H 1 1.119 0.008 . 2 . . . . 93 LEU QD2 . 16380 1 992 . 1 1 93 93 LEU HG H 1 0.416 0.008 . 1 . . . . 93 LEU HG . 16380 1 993 . 1 1 93 93 LEU CA C 13 53.750 0.2 . 1 . . . . 93 LEU CA . 16380 1 994 . 1 1 93 93 LEU CB C 13 45.340 0.2 . 1 . . . . 93 LEU CB . 16380 1 995 . 1 1 93 93 LEU CD1 C 13 25.119 0.2 . 2 . . . . 93 LEU CD1 . 16380 1 996 . 1 1 93 93 LEU CD2 C 13 23.348 0.2 . 2 . . . . 93 LEU CD2 . 16380 1 997 . 1 1 93 93 LEU CG C 13 24.897 0.2 . 1 . . . . 93 LEU CG . 16380 1 998 . 1 1 93 93 LEU N N 15 122.440 0.15 . 1 . . . . 93 LEU N . 16380 1 999 . 1 1 94 94 GLN H H 1 8.360 0.008 . 1 . . . . 94 GLN H . 16380 1 1000 . 1 1 94 94 GLN HA H 1 4.229 0.008 . 1 . . . . 94 GLN HA . 16380 1 1001 . 1 1 94 94 GLN HB2 H 1 1.831 0.008 . 2 . . . . 94 GLN HB2 . 16380 1 1002 . 1 1 94 94 GLN HE21 H 1 7.303 0.008 . 2 . . . . 94 GLN HE21 . 16380 1 1003 . 1 1 94 94 GLN HE22 H 1 6.599 0.008 . 2 . . . . 94 GLN HE22 . 16380 1 1004 . 1 1 94 94 GLN HG2 H 1 2.214 0.008 . 2 . . . . 94 GLN HG2 . 16380 1 1005 . 1 1 94 94 GLN CA C 13 56.040 0.2 . 1 . . . . 94 GLN CA . 16380 1 1006 . 1 1 94 94 GLN CB C 13 28.780 0.2 . 1 . . . . 94 GLN CB . 16380 1 1007 . 1 1 94 94 GLN CG C 13 33.296 0.2 . 1 . . . . 94 GLN CG . 16380 1 1008 . 1 1 94 94 GLN N N 15 119.357 0.15 . 1 . . . . 94 GLN N . 16380 1 1009 . 1 1 94 94 GLN NE2 N 15 109.450 0.15 . 1 . . . . 94 GLN NE2 . 16380 1 1010 . 1 1 95 95 VAL H H 1 8.612 0.008 . 1 . . . . 95 VAL H . 16380 1 1011 . 1 1 95 95 VAL HA H 1 4.013 0.008 . 1 . . . . 95 VAL HA . 16380 1 1012 . 1 1 95 95 VAL HB H 1 1.812 0.008 . 1 . . . . 95 VAL HB . 16380 1 1013 . 1 1 95 95 VAL HG11 H 1 0.301 0.008 . 2 . . . . 95 VAL QG1 . 16380 1 1014 . 1 1 95 95 VAL HG12 H 1 0.301 0.008 . 2 . . . . 95 VAL QG1 . 16380 1 1015 . 1 1 95 95 VAL HG13 H 1 0.301 0.008 . 2 . . . . 95 VAL QG1 . 16380 1 1016 . 1 1 95 95 VAL HG21 H 1 0.115 0.008 . 2 . . . . 95 VAL QG2 . 16380 1 1017 . 1 1 95 95 VAL HG22 H 1 0.115 0.008 . 2 . . . . 95 VAL QG2 . 16380 1 1018 . 1 1 95 95 VAL HG23 H 1 0.115 0.008 . 2 . . . . 95 VAL QG2 . 16380 1 1019 . 1 1 95 95 VAL CA C 13 61.440 0.2 . 1 . . . . 95 VAL CA . 16380 1 1020 . 1 1 95 95 VAL CB C 13 35.110 0.2 . 1 . . . . 95 VAL CB . 16380 1 1021 . 1 1 95 95 VAL CG1 C 13 21.270 0.2 . 2 . . . . 95 VAL CG1 . 16380 1 1022 . 1 1 95 95 VAL CG2 C 13 21.212 0.2 . 2 . . . . 95 VAL CG2 . 16380 1 1023 . 1 1 95 95 VAL N N 15 126.928 0.15 . 1 . . . . 95 VAL N . 16380 1 1024 . 1 1 96 96 GLN H H 1 9.222 0.008 . 1 . . . . 96 GLN H . 16380 1 1025 . 1 1 96 96 GLN HA H 1 4.279 0.008 . 1 . . . . 96 GLN HA . 16380 1 1026 . 1 1 96 96 GLN HB2 H 1 2.186 0.008 . 2 . . . . 96 GLN HB2 . 16380 1 1027 . 1 1 96 96 GLN HB3 H 1 1.821 0.008 . 2 . . . . 96 GLN HB3 . 16380 1 1028 . 1 1 96 96 GLN HE21 H 1 7.304 0.008 . 2 . . . . 96 GLN HE21 . 16380 1 1029 . 1 1 96 96 GLN HE22 H 1 6.625 0.008 . 2 . . . . 96 GLN HE22 . 16380 1 1030 . 1 1 96 96 GLN HG2 H 1 2.282 0.008 . 2 . . . . 96 GLN HG2 . 16380 1 1031 . 1 1 96 96 GLN HG3 H 1 1.990 0.008 . 2 . . . . 96 GLN HG3 . 16380 1 1032 . 1 1 96 96 GLN CA C 13 55.150 0.2 . 1 . . . . 96 GLN CA . 16380 1 1033 . 1 1 96 96 GLN CB C 13 29.100 0.2 . 1 . . . . 96 GLN CB . 16380 1 1034 . 1 1 96 96 GLN CG C 13 33.368 0.2 . 1 . . . . 96 GLN CG . 16380 1 1035 . 1 1 96 96 GLN N N 15 128.360 0.15 . 1 . . . . 96 GLN N . 16380 1 1036 . 1 1 96 96 GLN NE2 N 15 110.915 0.15 . 1 . . . . 96 GLN NE2 . 16380 1 1037 . 1 1 97 97 VAL H H 1 8.233 0.008 . 1 . . . . 97 VAL H . 16380 1 1038 . 1 1 97 97 VAL HA H 1 3.674 0.008 . 1 . . . . 97 VAL HA . 16380 1 1039 . 1 1 97 97 VAL HB H 1 1.929 0.008 . 1 . . . . 97 VAL HB . 16380 1 1040 . 1 1 97 97 VAL HG11 H 1 0.901 0.008 . 2 . . . . 97 VAL QG1 . 16380 1 1041 . 1 1 97 97 VAL HG12 H 1 0.901 0.008 . 2 . . . . 97 VAL QG1 . 16380 1 1042 . 1 1 97 97 VAL HG13 H 1 0.901 0.008 . 2 . . . . 97 VAL QG1 . 16380 1 1043 . 1 1 97 97 VAL HG21 H 1 0.569 0.008 . 2 . . . . 97 VAL QG2 . 16380 1 1044 . 1 1 97 97 VAL HG22 H 1 0.569 0.008 . 2 . . . . 97 VAL QG2 . 16380 1 1045 . 1 1 97 97 VAL HG23 H 1 0.569 0.008 . 2 . . . . 97 VAL QG2 . 16380 1 1046 . 1 1 97 97 VAL CA C 13 64.040 0.2 . 1 . . . . 97 VAL CA . 16380 1 1047 . 1 1 97 97 VAL CB C 13 31.920 0.2 . 1 . . . . 97 VAL CB . 16380 1 1048 . 1 1 97 97 VAL CG1 C 13 22.891 0.2 . 2 . . . . 97 VAL CG1 . 16380 1 1049 . 1 1 97 97 VAL CG2 C 13 22.051 0.2 . 2 . . . . 97 VAL CG2 . 16380 1 1050 . 1 1 97 97 VAL N N 15 128.120 0.15 . 1 . . . . 97 VAL N . 16380 1 1051 . 1 1 98 98 LEU H H 1 8.880 0.008 . 1 . . . . 98 LEU H . 16380 1 1052 . 1 1 98 98 LEU HA H 1 4.472 0.008 . 1 . . . . 98 LEU HA . 16380 1 1053 . 1 1 98 98 LEU HB2 H 1 1.505 0.008 . 2 . . . . 98 LEU HB2 . 16380 1 1054 . 1 1 98 98 LEU HB3 H 1 1.384 0.008 . 2 . . . . 98 LEU HB3 . 16380 1 1055 . 1 1 98 98 LEU HD21 H 1 0.782 0.008 . 2 . . . . 98 LEU QD2 . 16380 1 1056 . 1 1 98 98 LEU HD22 H 1 0.782 0.008 . 2 . . . . 98 LEU QD2 . 16380 1 1057 . 1 1 98 98 LEU HD23 H 1 0.782 0.008 . 2 . . . . 98 LEU QD2 . 16380 1 1058 . 1 1 98 98 LEU HG H 1 1.741 0.008 . 1 . . . . 98 LEU HG . 16380 1 1059 . 1 1 98 98 LEU CA C 13 55.641 0.2 . 1 . . . . 98 LEU CA . 16380 1 1060 . 1 1 98 98 LEU CB C 13 42.510 0.2 . 1 . . . . 98 LEU CB . 16380 1 1061 . 1 1 98 98 LEU CD2 C 13 22.136 0.2 . 2 . . . . 98 LEU CD2 . 16380 1 1062 . 1 1 98 98 LEU CG C 13 34.310 0.2 . 1 . . . . 98 LEU CG . 16380 1 1063 . 1 1 98 98 LEU N N 15 128.877 0.15 . 1 . . . . 98 LEU N . 16380 1 1064 . 1 1 99 99 GLU H H 1 7.682 0.008 . 1 . . . . 99 GLU H . 16380 1 1065 . 1 1 99 99 GLU HA H 1 4.403 0.008 . 1 . . . . 99 GLU HA . 16380 1 1066 . 1 1 99 99 GLU HB2 H 1 2.034 0.008 . 2 . . . . 99 GLU HB2 . 16380 1 1067 . 1 1 99 99 GLU HB3 H 1 1.945 0.008 . 2 . . . . 99 GLU HB3 . 16380 1 1068 . 1 1 99 99 GLU HG2 H 1 2.256 0.008 . 2 . . . . 99 GLU HG2 . 16380 1 1069 . 1 1 99 99 GLU HG3 H 1 2.163 0.008 . 2 . . . . 99 GLU HG3 . 16380 1 1070 . 1 1 99 99 GLU CA C 13 56.310 0.2 . 1 . . . . 99 GLU CA . 16380 1 1071 . 1 1 99 99 GLU CB C 13 32.790 0.2 . 1 . . . . 99 GLU CB . 16380 1 1072 . 1 1 99 99 GLU CG C 13 35.741 0.2 . 1 . . . . 99 GLU CG . 16380 1 1073 . 1 1 99 99 GLU N N 15 118.210 0.15 . 1 . . . . 99 GLU N . 16380 1 1074 . 1 1 100 100 TRP H H 1 8.883 0.008 . 1 . . . . 100 TRP H . 16380 1 1075 . 1 1 100 100 TRP HA H 1 5.205 0.008 . 1 . . . . 100 TRP HA . 16380 1 1076 . 1 1 100 100 TRP HB2 H 1 3.013 0.008 . 2 . . . . 100 TRP HB2 . 16380 1 1077 . 1 1 100 100 TRP HB3 H 1 2.849 0.008 . 2 . . . . 100 TRP HB3 . 16380 1 1078 . 1 1 100 100 TRP HD1 H 1 6.902 0.008 . 1 . . . . 100 TRP HD1 . 16380 1 1079 . 1 1 100 100 TRP HE1 H 1 9.157 0.008 . 1 . . . . 100 TRP HE1 . 16380 1 1080 . 1 1 100 100 TRP HE3 H 1 7.291 0.008 . 1 . . . . 100 TRP HE3 . 16380 1 1081 . 1 1 100 100 TRP HH2 H 1 6.428 0.008 . 1 . . . . 100 TRP HH2 . 16380 1 1082 . 1 1 100 100 TRP HZ2 H 1 7.371 0.008 . 1 . . . . 100 TRP HZ2 . 16380 1 1083 . 1 1 100 100 TRP HZ3 H 1 6.396 0.008 . 1 . . . . 100 TRP HZ3 . 16380 1 1084 . 1 1 100 100 TRP CA C 13 55.982 0.2 . 1 . . . . 100 TRP CA . 16380 1 1085 . 1 1 100 100 TRP CB C 13 32.430 0.2 . 1 . . . . 100 TRP CB . 16380 1 1086 . 1 1 100 100 TRP CD1 C 13 127.532 0.2 . 1 . . . . 100 TRP CD1 . 16380 1 1087 . 1 1 100 100 TRP CE3 C 13 120.938 0.2 . 1 . . . . 100 TRP CE3 . 16380 1 1088 . 1 1 100 100 TRP CH2 C 13 122.645 0.2 . 1 . . . . 100 TRP CH2 . 16380 1 1089 . 1 1 100 100 TRP CZ2 C 13 114.552 0.2 . 1 . . . . 100 TRP CZ2 . 16380 1 1090 . 1 1 100 100 TRP CZ3 C 13 120.483 0.2 . 1 . . . . 100 TRP CZ3 . 16380 1 1091 . 1 1 100 100 TRP N N 15 126.421 0.15 . 1 . . . . 100 TRP N . 16380 1 1092 . 1 1 100 100 TRP NE1 N 15 128.299 0.15 . 1 . . . . 100 TRP NE1 . 16380 1 1093 . 1 1 101 101 GLU H H 1 8.116 0.008 . 1 . . . . 101 GLU H . 16380 1 1094 . 1 1 101 101 GLU HA H 1 4.462 0.008 . 1 . . . . 101 GLU HA . 16380 1 1095 . 1 1 101 101 GLU HB2 H 1 1.762 0.008 . 2 . . . . 101 GLU HB2 . 16380 1 1096 . 1 1 101 101 GLU HB3 H 1 1.469 0.008 . 2 . . . . 101 GLU HB3 . 16380 1 1097 . 1 1 101 101 GLU HG3 H 1 1.970 0.008 . 2 . . . . 101 GLU HG3 . 16380 1 1098 . 1 1 101 101 GLU CA C 13 55.050 0.2 . 1 . . . . 101 GLU CA . 16380 1 1099 . 1 1 101 101 GLU CB C 13 30.950 0.2 . 1 . . . . 101 GLU CB . 16380 1 1100 . 1 1 101 101 GLU CG C 13 35.825 0.2 . 1 . . . . 101 GLU CG . 16380 1 1101 . 1 1 101 101 GLU N N 15 128.535 0.15 . 1 . . . . 101 GLU N . 16380 1 1102 . 1 1 102 102 GLY H H 1 7.614 0.008 . 1 . . . . 102 GLY H . 16380 1 1103 . 1 1 102 102 GLY HA2 H 1 3.853 0.008 . 2 . . . . 102 GLY HA2 . 16380 1 1104 . 1 1 102 102 GLY HA3 H 1 3.905 0.008 . 2 . . . . 102 GLY HA3 . 16380 1 1105 . 1 1 102 102 GLY CA C 13 44.440 0.2 . 1 . . . . 102 GLY CA . 16380 1 1106 . 1 1 102 102 GLY N N 15 108.953 0.15 . 1 . . . . 102 GLY N . 16380 1 1107 . 1 1 103 103 ASP H H 1 8.261 0.008 . 1 . . . . 103 ASP H . 16380 1 1108 . 1 1 103 103 ASP HA H 1 4.641 0.008 . 1 . . . . 103 ASP HA . 16380 1 1109 . 1 1 103 103 ASP HB2 H 1 2.630 0.008 . 2 . . . . 103 ASP HB2 . 16380 1 1110 . 1 1 103 103 ASP HB3 H 1 2.680 0.008 . 2 . . . . 103 ASP HB3 . 16380 1 1111 . 1 1 103 103 ASP CA C 13 54.530 0.2 . 1 . . . . 103 ASP CA . 16380 1 1112 . 1 1 103 103 ASP CB C 13 41.690 0.2 . 1 . . . . 103 ASP CB . 16380 1 1113 . 1 1 103 103 ASP N N 15 118.730 0.15 . 1 . . . . 103 ASP N . 16380 1 1114 . 1 1 104 104 GLY H H 1 8.526 0.008 . 1 . . . . 104 GLY H . 16380 1 1115 . 1 1 104 104 GLY HA2 H 1 3.719 0.008 . 2 . . . . 104 GLY HA2 . 16380 1 1116 . 1 1 104 104 GLY HA3 H 1 3.892 0.008 . 2 . . . . 104 GLY HA3 . 16380 1 1117 . 1 1 104 104 GLY CA C 13 45.960 0.2 . 1 . . . . 104 GLY CA . 16380 1 1118 . 1 1 104 104 GLY N N 15 109.230 0.15 . 1 . . . . 104 GLY N . 16380 1 1119 . 1 1 105 105 ASP H H 1 7.806 0.008 . 1 . . . . 105 ASP H . 16380 1 1120 . 1 1 105 105 ASP HA H 1 3.381 0.008 . 1 . . . . 105 ASP HA . 16380 1 1121 . 1 1 105 105 ASP HB2 H 1 2.472 0.008 . 2 . . . . 105 ASP HB2 . 16380 1 1122 . 1 1 105 105 ASP HB3 H 1 2.388 0.008 . 2 . . . . 105 ASP HB3 . 16380 1 1123 . 1 1 105 105 ASP CA C 13 51.020 0.2 . 1 . . . . 105 ASP CA . 16380 1 1124 . 1 1 105 105 ASP CB C 13 41.406 0.2 . 1 . . . . 105 ASP CB . 16380 1 1125 . 1 1 105 105 ASP N N 15 119.739 0.15 . 1 . . . . 105 ASP N . 16380 1 1126 . 1 1 106 106 PRO HA H 1 4.065 0.008 . 1 . . . . 106 PRO HA . 16380 1 1127 . 1 1 106 106 PRO HB2 H 1 1.444 0.008 . 2 . . . . 106 PRO HB2 . 16380 1 1128 . 1 1 106 106 PRO HB3 H 1 1.191 0.008 . 2 . . . . 106 PRO HB3 . 16380 1 1129 . 1 1 106 106 PRO HD2 H 1 2.591 0.008 . 2 . . . . 106 PRO HD2 . 16380 1 1130 . 1 1 106 106 PRO HD3 H 1 1.821 0.008 . 2 . . . . 106 PRO HD3 . 16380 1 1131 . 1 1 106 106 PRO HG2 H 1 1.097 0.008 . 2 . . . . 106 PRO HG2 . 16380 1 1132 . 1 1 106 106 PRO HG3 H 1 0.366 0.008 . 2 . . . . 106 PRO HG3 . 16380 1 1133 . 1 1 106 106 PRO CA C 13 62.970 0.2 . 1 . . . . 106 PRO CA . 16380 1 1134 . 1 1 106 106 PRO CB C 13 31.660 0.2 . 1 . . . . 106 PRO CB . 16380 1 1135 . 1 1 106 106 PRO CD C 13 49.081 0.2 . 1 . . . . 106 PRO CD . 16380 1 1136 . 1 1 106 106 PRO CG C 13 25.711 0.2 . 1 . . . . 106 PRO CG . 16380 1 1137 . 1 1 107 107 GLY H H 1 7.863 0.008 . 1 . . . . 107 GLY H . 16380 1 1138 . 1 1 107 107 GLY HA2 H 1 3.401 0.008 . 2 . . . . 107 GLY HA2 . 16380 1 1139 . 1 1 107 107 GLY HA3 H 1 4.103 0.008 . 2 . . . . 107 GLY HA3 . 16380 1 1140 . 1 1 107 107 GLY CA C 13 44.170 0.2 . 1 . . . . 107 GLY CA . 16380 1 1141 . 1 1 107 107 GLY N N 15 109.610 0.15 . 1 . . . . 107 GLY N . 16380 1 1142 . 1 1 108 108 ASP H H 1 8.171 0.008 . 1 . . . . 108 ASP H . 16380 1 1143 . 1 1 108 108 ASP HA H 1 4.283 0.008 . 1 . . . . 108 ASP HA . 16380 1 1144 . 1 1 108 108 ASP HB2 H 1 2.579 0.008 . 2 . . . . 108 ASP HB2 . 16380 1 1145 . 1 1 108 108 ASP CA C 13 56.430 0.2 . 1 . . . . 108 ASP CA . 16380 1 1146 . 1 1 108 108 ASP CB C 13 41.490 0.2 . 1 . . . . 108 ASP CB . 16380 1 1147 . 1 1 108 108 ASP N N 15 119.264 0.15 . 1 . . . . 108 ASP N . 16380 1 1148 . 1 1 109 109 SER H H 1 7.560 0.008 . 1 . . . . 109 SER H . 16380 1 1149 . 1 1 109 109 SER HA H 1 5.188 0.008 . 1 . . . . 109 SER HA . 16380 1 1150 . 1 1 109 109 SER HB2 H 1 3.587 0.008 . 2 . . . . 109 SER HB2 . 16380 1 1151 . 1 1 109 109 SER HB3 H 1 3.404 0.008 . 2 . . . . 109 SER HB3 . 16380 1 1152 . 1 1 109 109 SER CA C 13 56.740 0.2 . 1 . . . . 109 SER CA . 16380 1 1153 . 1 1 109 109 SER CB C 13 65.780 0.2 . 1 . . . . 109 SER CB . 16380 1 1154 . 1 1 109 109 SER N N 15 110.810 0.15 . 1 . . . . 109 SER N . 16380 1 1155 . 1 1 110 110 VAL H H 1 8.932 0.008 . 1 . . . . 110 VAL H . 16380 1 1156 . 1 1 110 110 VAL HA H 1 4.262 0.008 . 1 . . . . 110 VAL HA . 16380 1 1157 . 1 1 110 110 VAL HB H 1 1.525 0.008 . 1 . . . . 110 VAL HB . 16380 1 1158 . 1 1 110 110 VAL HG11 H 1 0.441 0.008 . 2 . . . . 110 VAL QG1 . 16380 1 1159 . 1 1 110 110 VAL HG12 H 1 0.441 0.008 . 2 . . . . 110 VAL QG1 . 16380 1 1160 . 1 1 110 110 VAL HG13 H 1 0.441 0.008 . 2 . . . . 110 VAL QG1 . 16380 1 1161 . 1 1 110 110 VAL HG21 H 1 0.532 0.008 . 2 . . . . 110 VAL QG2 . 16380 1 1162 . 1 1 110 110 VAL HG22 H 1 0.532 0.008 . 2 . . . . 110 VAL QG2 . 16380 1 1163 . 1 1 110 110 VAL HG23 H 1 0.532 0.008 . 2 . . . . 110 VAL QG2 . 16380 1 1164 . 1 1 110 110 VAL CA C 13 59.470 0.2 . 1 . . . . 110 VAL CA . 16380 1 1165 . 1 1 110 110 VAL CB C 13 35.400 0.2 . 1 . . . . 110 VAL CB . 16380 1 1166 . 1 1 110 110 VAL CG1 C 13 20.241 0.2 . 2 . . . . 110 VAL CG1 . 16380 1 1167 . 1 1 110 110 VAL CG2 C 13 20.656 0.2 . 2 . . . . 110 VAL CG2 . 16380 1 1168 . 1 1 110 110 VAL N N 15 118.530 0.15 . 1 . . . . 110 VAL N . 16380 1 1169 . 1 1 111 111 GLN H H 1 8.468 0.008 . 1 . . . . 111 GLN H . 16380 1 1170 . 1 1 111 111 GLN HA H 1 4.422 0.008 . 1 . . . . 111 GLN HA . 16380 1 1171 . 1 1 111 111 GLN HB2 H 1 1.807 0.008 . 2 . . . . 111 GLN HB2 . 16380 1 1172 . 1 1 111 111 GLN HB3 H 1 1.841 0.008 . 2 . . . . 111 GLN HB3 . 16380 1 1173 . 1 1 111 111 GLN HE21 H 1 7.363 0.008 . 2 . . . . 111 GLN HE21 . 16380 1 1174 . 1 1 111 111 GLN HE22 H 1 6.680 0.008 . 2 . . . . 111 GLN HE22 . 16380 1 1175 . 1 1 111 111 GLN HG2 H 1 1.873 0.008 . 2 . . . . 111 GLN HG2 . 16380 1 1176 . 1 1 111 111 GLN HG3 H 1 1.904 0.008 . 2 . . . . 111 GLN HG3 . 16380 1 1177 . 1 1 111 111 GLN CA C 13 55.960 0.2 . 1 . . . . 111 GLN CA . 16380 1 1178 . 1 1 111 111 GLN CB C 13 29.470 0.2 . 1 . . . . 111 GLN CB . 16380 1 1179 . 1 1 111 111 GLN CG C 13 34.336 0.2 . 1 . . . . 111 GLN CG . 16380 1 1180 . 1 1 111 111 GLN N N 15 127.378 0.15 . 1 . . . . 111 GLN N . 16380 1 1181 . 1 1 111 111 GLN NE2 N 15 111.192 0.15 . 1 . . . . 111 GLN NE2 . 16380 1 1182 . 1 1 112 112 CYS H H 1 8.785 0.008 . 1 . . . . 112 CYS H . 16380 1 1183 . 1 1 112 112 CYS HA H 1 4.782 0.008 . 1 . . . . 112 CYS HA . 16380 1 1184 . 1 1 112 112 CYS HB2 H 1 2.348 0.008 . 2 . . . . 112 CYS HB2 . 16380 1 1185 . 1 1 112 112 CYS HB3 H 1 2.633 0.008 . 2 . . . . 112 CYS HB3 . 16380 1 1186 . 1 1 112 112 CYS CA C 13 57.100 0.2 . 1 . . . . 112 CYS CA . 16380 1 1187 . 1 1 112 112 CYS CB C 13 33.700 0.2 . 1 . . . . 112 CYS CB . 16380 1 1188 . 1 1 112 112 CYS N N 15 122.300 0.15 . 1 . . . . 112 CYS N . 16380 1 1189 . 1 1 113 113 PHE H H 1 8.838 0.008 . 1 . . . . 113 PHE H . 16380 1 1190 . 1 1 113 113 PHE HA H 1 5.154 0.008 . 1 . . . . 113 PHE HA . 16380 1 1191 . 1 1 113 113 PHE HB2 H 1 2.792 0.008 . 2 . . . . 113 PHE HB2 . 16380 1 1192 . 1 1 113 113 PHE HB3 H 1 2.567 0.008 . 2 . . . . 113 PHE HB3 . 16380 1 1193 . 1 1 113 113 PHE HD1 H 1 7.034 0.008 . 3 . . . . 113 PHE QD . 16380 1 1194 . 1 1 113 113 PHE HD2 H 1 7.034 0.008 . 3 . . . . 113 PHE QD . 16380 1 1195 . 1 1 113 113 PHE HE1 H 1 7.394 0.008 . 3 . . . . 113 PHE QE . 16380 1 1196 . 1 1 113 113 PHE HE2 H 1 7.394 0.008 . 3 . . . . 113 PHE QE . 16380 1 1197 . 1 1 113 113 PHE CA C 13 58.650 0.2 . 1 . . . . 113 PHE CA . 16380 1 1198 . 1 1 113 113 PHE CB C 13 40.210 0.2 . 1 . . . . 113 PHE CB . 16380 1 1199 . 1 1 113 113 PHE CD1 C 13 130.530 0.2 . 3 . . . . 113 PHE CD1 . 16380 1 1200 . 1 1 113 113 PHE CE1 C 13 132.554 0.2 . 3 . . . . 113 PHE CE1 . 16380 1 1201 . 1 1 113 113 PHE N N 15 118.974 0.15 . 1 . . . . 113 PHE N . 16380 1 1202 . 1 1 114 114 VAL H H 1 9.079 0.008 . 1 . . . . 114 VAL H . 16380 1 1203 . 1 1 114 114 VAL HA H 1 4.472 0.008 . 1 . . . . 114 VAL HA . 16380 1 1204 . 1 1 114 114 VAL HB H 1 1.858 0.008 . 1 . . . . 114 VAL HB . 16380 1 1205 . 1 1 114 114 VAL HG11 H 1 1.119 0.008 . 2 . . . . 114 VAL QG1 . 16380 1 1206 . 1 1 114 114 VAL HG12 H 1 1.119 0.008 . 2 . . . . 114 VAL QG1 . 16380 1 1207 . 1 1 114 114 VAL HG13 H 1 1.119 0.008 . 2 . . . . 114 VAL QG1 . 16380 1 1208 . 1 1 114 114 VAL HG21 H 1 1.065 0.008 . 2 . . . . 114 VAL QG2 . 16380 1 1209 . 1 1 114 114 VAL HG22 H 1 1.065 0.008 . 2 . . . . 114 VAL QG2 . 16380 1 1210 . 1 1 114 114 VAL HG23 H 1 1.065 0.008 . 2 . . . . 114 VAL QG2 . 16380 1 1211 . 1 1 114 114 VAL CA C 13 60.650 0.2 . 1 . . . . 114 VAL CA . 16380 1 1212 . 1 1 114 114 VAL CB C 13 35.970 0.2 . 1 . . . . 114 VAL CB . 16380 1 1213 . 1 1 114 114 VAL CG1 C 13 23.349 0.2 . 2 . . . . 114 VAL CG1 . 16380 1 1214 . 1 1 114 114 VAL CG2 C 13 22.052 0.2 . 2 . . . . 114 VAL CG2 . 16380 1 1215 . 1 1 114 114 VAL N N 15 121.660 0.15 . 1 . . . . 114 VAL N . 16380 1 1216 . 1 1 115 115 TYR H H 1 9.672 0.008 . 1 . . . . 115 TYR H . 16380 1 1217 . 1 1 115 115 TYR HA H 1 4.988 0.008 . 1 . . . . 115 TYR HA . 16380 1 1218 . 1 1 115 115 TYR HB2 H 1 2.325 0.008 . 2 . . . . 115 TYR HB2 . 16380 1 1219 . 1 1 115 115 TYR HB3 H 1 2.399 0.008 . 2 . . . . 115 TYR HB3 . 16380 1 1220 . 1 1 115 115 TYR HD1 H 1 6.807 0.008 . 3 . . . . 115 TYR QD . 16380 1 1221 . 1 1 115 115 TYR HD2 H 1 6.807 0.008 . 3 . . . . 115 TYR QD . 16380 1 1222 . 1 1 115 115 TYR HE1 H 1 6.622 0.008 . 3 . . . . 115 TYR QE . 16380 1 1223 . 1 1 115 115 TYR HE2 H 1 6.622 0.008 . 3 . . . . 115 TYR QE . 16380 1 1224 . 1 1 115 115 TYR CA C 13 59.240 0.2 . 1 . . . . 115 TYR CA . 16380 1 1225 . 1 1 115 115 TYR CB C 13 36.925 0.2 . 1 . . . . 115 TYR CB . 16380 1 1226 . 1 1 115 115 TYR CD1 C 13 132.481 0.2 . 3 . . . . 115 TYR CD1 . 16380 1 1227 . 1 1 115 115 TYR CE1 C 13 116.851 0.2 . 3 . . . . 115 TYR CE1 . 16380 1 1228 . 1 1 115 115 TYR N N 15 127.830 0.15 . 1 . . . . 115 TYR N . 16380 1 1229 . 1 1 116 116 THR H H 1 9.061 0.008 . 1 . . . . 116 THR H . 16380 1 1230 . 1 1 116 116 THR HA H 1 5.435 0.008 . 1 . . . . 116 THR HA . 16380 1 1231 . 1 1 116 116 THR HB H 1 4.293 0.008 . 1 . . . . 116 THR HB . 16380 1 1232 . 1 1 116 116 THR HG21 H 1 0.962 0.008 . 1 . . . . 116 THR QG2 . 16380 1 1233 . 1 1 116 116 THR HG22 H 1 0.962 0.008 . 1 . . . . 116 THR QG2 . 16380 1 1234 . 1 1 116 116 THR HG23 H 1 0.962 0.008 . 1 . . . . 116 THR QG2 . 16380 1 1235 . 1 1 116 116 THR CA C 13 60.130 0.2 . 1 . . . . 116 THR CA . 16380 1 1236 . 1 1 116 116 THR CB C 13 71.910 0.2 . 1 . . . . 116 THR CB . 16380 1 1237 . 1 1 116 116 THR CG2 C 13 22.070 0.2 . 1 . . . . 116 THR CG2 . 16380 1 1238 . 1 1 116 116 THR N N 15 119.130 0.15 . 1 . . . . 116 THR N . 16380 1 1239 . 1 1 117 117 THR H H 1 8.707 0.008 . 1 . . . . 117 THR H . 16380 1 1240 . 1 1 117 117 THR HA H 1 5.561 0.008 . 1 . . . . 117 THR HA . 16380 1 1241 . 1 1 117 117 THR HB H 1 4.447 0.008 . 1 . . . . 117 THR HB . 16380 1 1242 . 1 1 117 117 THR HG21 H 1 1.467 0.008 . 1 . . . . 117 THR QG2 . 16380 1 1243 . 1 1 117 117 THR HG22 H 1 1.467 0.008 . 1 . . . . 117 THR QG2 . 16380 1 1244 . 1 1 117 117 THR HG23 H 1 1.467 0.008 . 1 . . . . 117 THR QG2 . 16380 1 1245 . 1 1 117 117 THR CA C 13 60.160 0.2 . 1 . . . . 117 THR CA . 16380 1 1246 . 1 1 117 117 THR CB C 13 70.170 0.2 . 1 . . . . 117 THR CB . 16380 1 1247 . 1 1 117 117 THR CG2 C 13 22.576 0.2 . 1 . . . . 117 THR CG2 . 16380 1 1248 . 1 1 117 117 THR N N 15 111.190 0.15 . 1 . . . . 117 THR N . 16380 1 1249 . 1 1 118 118 ALA H H 1 9.257 0.008 . 1 . . . . 118 ALA H . 16380 1 1250 . 1 1 118 118 ALA HA H 1 5.033 0.008 . 1 . . . . 118 ALA HA . 16380 1 1251 . 1 1 118 118 ALA HB1 H 1 1.519 0.008 . 1 . . . . 118 ALA QB . 16380 1 1252 . 1 1 118 118 ALA HB2 H 1 1.519 0.008 . 1 . . . . 118 ALA QB . 16380 1 1253 . 1 1 118 118 ALA HB3 H 1 1.519 0.008 . 1 . . . . 118 ALA QB . 16380 1 1254 . 1 1 118 118 ALA CA C 13 51.550 0.2 . 1 . . . . 118 ALA CA . 16380 1 1255 . 1 1 118 118 ALA CB C 13 20.050 0.2 . 1 . . . . 118 ALA CB . 16380 1 1256 . 1 1 118 118 ALA N N 15 132.010 0.15 . 1 . . . . 118 ALA N . 16380 1 1257 . 1 1 119 119 THR H H 1 8.628 0.008 . 1 . . . . 119 THR H . 16380 1 1258 . 1 1 119 119 THR HA H 1 4.143 0.008 . 1 . . . . 119 THR HA . 16380 1 1259 . 1 1 119 119 THR HB H 1 4.259 0.008 . 1 . . . . 119 THR HB . 16380 1 1260 . 1 1 119 119 THR HG21 H 1 0.925 0.008 . 1 . . . . 119 THR QG2 . 16380 1 1261 . 1 1 119 119 THR HG22 H 1 0.925 0.008 . 1 . . . . 119 THR QG2 . 16380 1 1262 . 1 1 119 119 THR HG23 H 1 0.925 0.008 . 1 . . . . 119 THR QG2 . 16380 1 1263 . 1 1 119 119 THR CA C 13 60.090 0.2 . 1 . . . . 119 THR CA . 16380 1 1264 . 1 1 119 119 THR CB C 13 68.056 0.2 . 1 . . . . 119 THR CB . 16380 1 1265 . 1 1 119 119 THR CG2 C 13 21.676 0.2 . 1 . . . . 119 THR CG2 . 16380 1 1266 . 1 1 119 119 THR N N 15 114.350 0.15 . 1 . . . . 119 THR N . 16380 1 1267 . 1 1 120 120 TYR H H 1 6.281 0.008 . 1 . . . . 120 TYR H . 16380 1 1268 . 1 1 120 120 TYR HA H 1 3.594 0.008 . 1 . . . . 120 TYR HA . 16380 1 1269 . 1 1 120 120 TYR HB2 H 1 2.539 0.008 . 2 . . . . 120 TYR HB2 . 16380 1 1270 . 1 1 120 120 TYR HB3 H 1 2.595 0.008 . 2 . . . . 120 TYR HB3 . 16380 1 1271 . 1 1 120 120 TYR HD1 H 1 6.804 0.008 . 3 . . . . 120 TYR QD . 16380 1 1272 . 1 1 120 120 TYR HD2 H 1 6.804 0.008 . 3 . . . . 120 TYR QD . 16380 1 1273 . 1 1 120 120 TYR CA C 13 53.530 0.2 . 1 . . . . 120 TYR CA . 16380 1 1274 . 1 1 120 120 TYR CB C 13 40.072 0.2 . 1 . . . . 120 TYR CB . 16380 1 1275 . 1 1 120 120 TYR CD1 C 13 134.234 0.2 . 3 . . . . 120 TYR CD1 . 16380 1 1276 . 1 1 120 120 TYR N N 15 117.205 0.15 . 1 . . . . 120 TYR N . 16380 1 1277 . 1 1 121 121 ALA HA H 1 5.030 0.008 . 1 . . . . 121 ALA HA . 16380 1 1278 . 1 1 121 121 ALA CA C 13 51.536 0.2 . 1 . . . . 121 ALA CA . 16380 1 1279 . 1 1 122 122 PRO HA H 1 4.059 0.008 . 1 . . . . 122 PRO HA . 16380 1 1280 . 1 1 122 122 PRO HB2 H 1 1.889 0.008 . 2 . . . . 122 PRO HB2 . 16380 1 1281 . 1 1 122 122 PRO HB3 H 1 2.303 0.008 . 2 . . . . 122 PRO HB3 . 16380 1 1282 . 1 1 122 122 PRO HD2 H 1 3.614 0.008 . 2 . . . . 122 PRO HD2 . 16380 1 1283 . 1 1 122 122 PRO HG2 H 1 1.918 0.008 . 2 . . . . 122 PRO HG2 . 16380 1 1284 . 1 1 122 122 PRO HG3 H 1 2.048 0.008 . 2 . . . . 122 PRO HG3 . 16380 1 1285 . 1 1 122 122 PRO CA C 13 65.435 0.2 . 1 . . . . 122 PRO CA . 16380 1 1286 . 1 1 122 122 PRO CB C 13 31.680 0.2 . 1 . . . . 122 PRO CB . 16380 1 1287 . 1 1 122 122 PRO CD C 13 50.046 0.2 . 1 . . . . 122 PRO CD . 16380 1 1288 . 1 1 122 122 PRO CG C 13 27.724 0.2 . 1 . . . . 122 PRO CG . 16380 1 1289 . 1 1 123 123 GLU H H 1 9.336 0.008 . 1 . . . . 123 GLU H . 16380 1 1290 . 1 1 123 123 GLU HA H 1 4.169 0.008 . 1 . . . . 123 GLU HA . 16380 1 1291 . 1 1 123 123 GLU HB2 H 1 2.173 0.008 . 2 . . . . 123 GLU HB2 . 16380 1 1292 . 1 1 123 123 GLU HG2 H 1 2.409 0.008 . 2 . . . . 123 GLU HG2 . 16380 1 1293 . 1 1 123 123 GLU HG3 H 1 2.364 0.008 . 2 . . . . 123 GLU HG3 . 16380 1 1294 . 1 1 123 123 GLU CA C 13 59.100 0.2 . 1 . . . . 123 GLU CA . 16380 1 1295 . 1 1 123 123 GLU CB C 13 27.940 0.2 . 1 . . . . 123 GLU CB . 16380 1 1296 . 1 1 123 123 GLU CG C 13 36.531 0.2 . 1 . . . . 123 GLU CG . 16380 1 1297 . 1 1 123 123 GLU N N 15 115.528 0.15 . 1 . . . . 123 GLU N . 16380 1 1298 . 1 1 124 124 TRP H H 1 8.560 0.008 . 1 . . . . 124 TRP H . 16380 1 1299 . 1 1 124 124 TRP HA H 1 4.671 0.008 . 1 . . . . 124 TRP HA . 16380 1 1300 . 1 1 124 124 TRP HB2 H 1 3.274 0.008 . 2 . . . . 124 TRP HB2 . 16380 1 1301 . 1 1 124 124 TRP HB3 H 1 3.122 0.008 . 2 . . . . 124 TRP HB3 . 16380 1 1302 . 1 1 124 124 TRP HD1 H 1 6.880 0.008 . 1 . . . . 124 TRP HD1 . 16380 1 1303 . 1 1 124 124 TRP HE1 H 1 10.086 0.008 . 1 . . . . 124 TRP HE1 . 16380 1 1304 . 1 1 124 124 TRP HE3 H 1 6.787 0.008 . 1 . . . . 124 TRP HE3 . 16380 1 1305 . 1 1 124 124 TRP HH2 H 1 6.086 0.008 . 1 . . . . 124 TRP HH2 . 16380 1 1306 . 1 1 124 124 TRP HZ2 H 1 7.161 0.008 . 1 . . . . 124 TRP HZ2 . 16380 1 1307 . 1 1 124 124 TRP HZ3 H 1 5.041 0.008 . 1 . . . . 124 TRP HZ3 . 16380 1 1308 . 1 1 124 124 TRP CA C 13 57.370 0.2 . 1 . . . . 124 TRP CA . 16380 1 1309 . 1 1 124 124 TRP CB C 13 28.310 0.2 . 1 . . . . 124 TRP CB . 16380 1 1310 . 1 1 124 124 TRP CD1 C 13 123.067 0.2 . 1 . . . . 124 TRP CD1 . 16380 1 1311 . 1 1 124 124 TRP CE3 C 13 118.867 0.2 . 1 . . . . 124 TRP CE3 . 16380 1 1312 . 1 1 124 124 TRP CH2 C 13 124.518 0.2 . 1 . . . . 124 TRP CH2 . 16380 1 1313 . 1 1 124 124 TRP CZ2 C 13 113.653 0.2 . 1 . . . . 124 TRP CZ2 . 16380 1 1314 . 1 1 124 124 TRP CZ3 C 13 120.731 0.2 . 1 . . . . 124 TRP CZ3 . 16380 1 1315 . 1 1 124 124 TRP N N 15 123.431 0.15 . 1 . . . . 124 TRP N . 16380 1 1316 . 1 1 124 124 TRP NE1 N 15 127.449 0.15 . 1 . . . . 124 TRP NE1 . 16380 1 1317 . 1 1 125 125 LEU H H 1 7.378 0.008 . 1 . . . . 125 LEU H . 16380 1 1318 . 1 1 125 125 LEU HA H 1 4.065 0.008 . 1 . . . . 125 LEU HA . 16380 1 1319 . 1 1 125 125 LEU HB2 H 1 1.391 0.008 . 2 . . . . 125 LEU HB2 . 16380 1 1320 . 1 1 125 125 LEU HB3 H 1 1.180 0.008 . 2 . . . . 125 LEU HB3 . 16380 1 1321 . 1 1 125 125 LEU HD11 H 1 0.850 0.008 . 2 . . . . 125 LEU QD1 . 16380 1 1322 . 1 1 125 125 LEU HD12 H 1 0.850 0.008 . 2 . . . . 125 LEU QD1 . 16380 1 1323 . 1 1 125 125 LEU HD13 H 1 0.850 0.008 . 2 . . . . 125 LEU QD1 . 16380 1 1324 . 1 1 125 125 LEU HD21 H 1 0.556 0.008 . 2 . . . . 125 LEU QD2 . 16380 1 1325 . 1 1 125 125 LEU HD22 H 1 0.556 0.008 . 2 . . . . 125 LEU QD2 . 16380 1 1326 . 1 1 125 125 LEU HD23 H 1 0.556 0.008 . 2 . . . . 125 LEU QD2 . 16380 1 1327 . 1 1 125 125 LEU HG H 1 1.524 0.008 . 1 . . . . 125 LEU HG . 16380 1 1328 . 1 1 125 125 LEU CA C 13 56.060 0.2 . 1 . . . . 125 LEU CA . 16380 1 1329 . 1 1 125 125 LEU CB C 13 41.220 0.2 . 1 . . . . 125 LEU CB . 16380 1 1330 . 1 1 125 125 LEU CD1 C 13 25.160 0.2 . 2 . . . . 125 LEU CD1 . 16380 1 1331 . 1 1 125 125 LEU CD2 C 13 23.573 0.2 . 2 . . . . 125 LEU CD2 . 16380 1 1332 . 1 1 125 125 LEU CG C 13 27.264 0.2 . 1 . . . . 125 LEU CG . 16380 1 1333 . 1 1 125 125 LEU N N 15 113.660 0.15 . 1 . . . . 125 LEU N . 16380 1 1334 . 1 1 126 126 PHE H H 1 7.415 0.008 . 1 . . . . 126 PHE H . 16380 1 1335 . 1 1 126 126 PHE HA H 1 4.640 0.008 . 1 . . . . 126 PHE HA . 16380 1 1336 . 1 1 126 126 PHE HB2 H 1 3.515 0.008 . 2 . . . . 126 PHE HB2 . 16380 1 1337 . 1 1 126 126 PHE HB3 H 1 2.850 0.008 . 2 . . . . 126 PHE HB3 . 16380 1 1338 . 1 1 126 126 PHE HD1 H 1 7.255 0.008 . 3 . . . . 126 PHE QD . 16380 1 1339 . 1 1 126 126 PHE HD2 H 1 7.255 0.008 . 3 . . . . 126 PHE QD . 16380 1 1340 . 1 1 126 126 PHE HE1 H 1 7.305 0.008 . 3 . . . . 126 PHE QE . 16380 1 1341 . 1 1 126 126 PHE HE2 H 1 7.305 0.008 . 3 . . . . 126 PHE QE . 16380 1 1342 . 1 1 126 126 PHE CA C 13 56.940 0.2 . 1 . . . . 126 PHE CA . 16380 1 1343 . 1 1 126 126 PHE CB C 13 38.670 0.2 . 1 . . . . 126 PHE CB . 16380 1 1344 . 1 1 126 126 PHE CD1 C 13 131.319 0.2 . 3 . . . . 126 PHE CD1 . 16380 1 1345 . 1 1 126 126 PHE CE1 C 13 131.314 0.2 . 3 . . . . 126 PHE CE1 . 16380 1 1346 . 1 1 126 126 PHE N N 15 116.360 0.15 . 1 . . . . 126 PHE N . 16380 1 1347 . 1 1 127 127 LEU H H 1 7.168 0.008 . 1 . . . . 127 LEU H . 16380 1 1348 . 1 1 127 127 LEU HA H 1 4.529 0.008 . 1 . . . . 127 LEU HA . 16380 1 1349 . 1 1 127 127 LEU HB2 H 1 1.645 0.008 . 2 . . . . 127 LEU HB2 . 16380 1 1350 . 1 1 127 127 LEU HB3 H 1 1.992 0.008 . 2 . . . . 127 LEU HB3 . 16380 1 1351 . 1 1 127 127 LEU HD11 H 1 0.881 0.008 . 2 . . . . 127 LEU QD1 . 16380 1 1352 . 1 1 127 127 LEU HD12 H 1 0.881 0.008 . 2 . . . . 127 LEU QD1 . 16380 1 1353 . 1 1 127 127 LEU HD13 H 1 0.881 0.008 . 2 . . . . 127 LEU QD1 . 16380 1 1354 . 1 1 127 127 LEU HD21 H 1 1.027 0.008 . 2 . . . . 127 LEU QD2 . 16380 1 1355 . 1 1 127 127 LEU HD22 H 1 1.027 0.008 . 2 . . . . 127 LEU QD2 . 16380 1 1356 . 1 1 127 127 LEU HD23 H 1 1.027 0.008 . 2 . . . . 127 LEU QD2 . 16380 1 1357 . 1 1 127 127 LEU HG H 1 1.871 0.008 . 1 . . . . 127 LEU HG . 16380 1 1358 . 1 1 127 127 LEU CA C 13 53.580 0.2 . 1 . . . . 127 LEU CA . 16380 1 1359 . 1 1 127 127 LEU CB C 13 40.832 0.2 . 1 . . . . 127 LEU CB . 16380 1 1360 . 1 1 127 127 LEU CD1 C 13 26.056 0.2 . 2 . . . . 127 LEU CD1 . 16380 1 1361 . 1 1 127 127 LEU CD2 C 13 21.934 0.2 . 2 . . . . 127 LEU CD2 . 16380 1 1362 . 1 1 127 127 LEU CG C 13 27.448 0.2 . 1 . . . . 127 LEU CG . 16380 1 1363 . 1 1 127 127 LEU N N 15 122.990 0.15 . 1 . . . . 127 LEU N . 16380 1 1364 . 1 1 128 128 PRO HA H 1 3.986 0.008 . 1 . . . . 128 PRO HA . 16380 1 1365 . 1 1 128 128 PRO HB2 H 1 2.111 0.008 . 2 . . . . 128 PRO HB2 . 16380 1 1366 . 1 1 128 128 PRO HB3 H 1 1.561 0.008 . 2 . . . . 128 PRO HB3 . 16380 1 1367 . 1 1 128 128 PRO HD2 H 1 3.804 0.008 . 2 . . . . 128 PRO HD2 . 16380 1 1368 . 1 1 128 128 PRO HD3 H 1 3.628 0.008 . 2 . . . . 128 PRO HD3 . 16380 1 1369 . 1 1 128 128 PRO HG2 H 1 1.951 0.008 . 2 . . . . 128 PRO HG2 . 16380 1 1370 . 1 1 128 128 PRO HG3 H 1 2.138 0.008 . 2 . . . . 128 PRO HG3 . 16380 1 1371 . 1 1 128 128 PRO CA C 13 63.140 0.2 . 1 . . . . 128 PRO CA . 16380 1 1372 . 1 1 128 128 PRO CB C 13 31.993 0.2 . 1 . . . . 128 PRO CB . 16380 1 1373 . 1 1 128 128 PRO CD C 13 49.794 0.2 . 1 . . . . 128 PRO CD . 16380 1 1374 . 1 1 128 128 PRO CG C 13 28.174 0.2 . 1 . . . . 128 PRO CG . 16380 1 1375 . 1 1 129 129 TYR H H 1 8.070 0.008 . 1 . . . . 129 TYR H . 16380 1 1376 . 1 1 129 129 TYR HA H 1 5.529 0.008 . 1 . . . . 129 TYR HA . 16380 1 1377 . 1 1 129 129 TYR HB2 H 1 3.629 0.008 . 2 . . . . 129 TYR HB2 . 16380 1 1378 . 1 1 129 129 TYR HB3 H 1 3.012 0.008 . 2 . . . . 129 TYR HB3 . 16380 1 1379 . 1 1 129 129 TYR HD1 H 1 6.845 0.008 . 3 . . . . 129 TYR QD . 16380 1 1380 . 1 1 129 129 TYR HD2 H 1 6.845 0.008 . 3 . . . . 129 TYR QD . 16380 1 1381 . 1 1 129 129 TYR HE1 H 1 6.647 0.008 . 3 . . . . 129 TYR QE . 16380 1 1382 . 1 1 129 129 TYR HE2 H 1 6.647 0.008 . 3 . . . . 129 TYR QE . 16380 1 1383 . 1 1 129 129 TYR CA C 13 52.486 0.2 . 1 . . . . 129 TYR CA . 16380 1 1384 . 1 1 129 129 TYR CB C 13 36.760 0.2 . 1 . . . . 129 TYR CB . 16380 1 1385 . 1 1 129 129 TYR CD1 C 13 131.724 0.2 . 3 . . . . 129 TYR CD1 . 16380 1 1386 . 1 1 129 129 TYR CE1 C 13 118.946 0.2 . 3 . . . . 129 TYR CE1 . 16380 1 1387 . 1 1 129 129 TYR N N 15 120.100 0.15 . 1 . . . . 129 TYR N . 16380 1 1388 . 1 1 130 130 HIS H H 1 9.193 0.008 . 1 . . . . 130 HIS H . 16380 1 1389 . 1 1 130 130 HIS HA H 1 4.733 0.008 . 1 . . . . 130 HIS HA . 16380 1 1390 . 1 1 130 130 HIS HB2 H 1 2.706 0.008 . 2 . . . . 130 HIS HB2 . 16380 1 1391 . 1 1 130 130 HIS HB3 H 1 3.374 0.008 . 2 . . . . 130 HIS HB3 . 16380 1 1392 . 1 1 130 130 HIS HD2 H 1 7.563 0.008 . 1 . . . . 130 HIS HD2 . 16380 1 1393 . 1 1 130 130 HIS CA C 13 55.920 0.2 . 1 . . . . 130 HIS CA . 16380 1 1394 . 1 1 130 130 HIS CB C 13 32.908 0.2 . 1 . . . . 130 HIS CB . 16380 1 1395 . 1 1 130 130 HIS CD2 C 13 120.441 0.2 . 1 . . . . 130 HIS CD2 . 16380 1 1396 . 1 1 130 130 HIS N N 15 121.985 0.15 . 1 . . . . 130 HIS N . 16380 1 1397 . 1 1 131 131 GLU H H 1 9.093 0.008 . 1 . . . . 131 GLU H . 16380 1 1398 . 1 1 131 131 GLU HA H 1 4.277 0.008 . 1 . . . . 131 GLU HA . 16380 1 1399 . 1 1 131 131 GLU HB2 H 1 2.011 0.008 . 2 . . . . 131 GLU HB2 . 16380 1 1400 . 1 1 131 131 GLU HB3 H 1 1.852 0.008 . 2 . . . . 131 GLU HB3 . 16380 1 1401 . 1 1 131 131 GLU HG2 H 1 2.102 0.008 . 2 . . . . 131 GLU HG2 . 16380 1 1402 . 1 1 131 131 GLU CA C 13 58.110 0.2 . 1 . . . . 131 GLU CA . 16380 1 1403 . 1 1 131 131 GLU CB C 13 30.700 0.2 . 1 . . . . 131 GLU CB . 16380 1 1404 . 1 1 131 131 GLU CG C 13 36.762 0.2 . 1 . . . . 131 GLU CG . 16380 1 1405 . 1 1 131 131 GLU N N 15 122.150 0.15 . 1 . . . . 131 GLU N . 16380 1 1406 . 1 1 132 132 SER H H 1 7.621 0.008 . 1 . . . . 132 SER H . 16380 1 1407 . 1 1 132 132 SER HA H 1 4.686 0.008 . 1 . . . . 132 SER HA . 16380 1 1408 . 1 1 132 132 SER HB2 H 1 3.844 0.008 . 2 . . . . 132 SER HB2 . 16380 1 1409 . 1 1 132 132 SER HB3 H 1 3.652 0.008 . 2 . . . . 132 SER HB3 . 16380 1 1410 . 1 1 132 132 SER CA C 13 56.340 0.2 . 1 . . . . 132 SER CA . 16380 1 1411 . 1 1 132 132 SER CB C 13 65.050 0.2 . 1 . . . . 132 SER CB . 16380 1 1412 . 1 1 132 132 SER N N 15 108.030 0.15 . 1 . . . . 132 SER N . 16380 1 1413 . 1 1 133 133 TYR H H 1 8.667 0.008 . 1 . . . . 133 TYR H . 16380 1 1414 . 1 1 133 133 TYR HA H 1 4.564 0.008 . 1 . . . . 133 TYR HA . 16380 1 1415 . 1 1 133 133 TYR HB2 H 1 2.736 0.008 . 2 . . . . 133 TYR HB2 . 16380 1 1416 . 1 1 133 133 TYR HB3 H 1 3.308 0.008 . 2 . . . . 133 TYR HB3 . 16380 1 1417 . 1 1 133 133 TYR HD1 H 1 6.529 0.008 . 3 . . . . 133 TYR QD . 16380 1 1418 . 1 1 133 133 TYR HD2 H 1 6.529 0.008 . 3 . . . . 133 TYR QD . 16380 1 1419 . 1 1 133 133 TYR CA C 13 57.910 0.2 . 1 . . . . 133 TYR CA . 16380 1 1420 . 1 1 133 133 TYR CB C 13 40.720 0.2 . 1 . . . . 133 TYR CB . 16380 1 1421 . 1 1 133 133 TYR CD1 C 13 132.026 0.2 . 3 . . . . 133 TYR CD1 . 16380 1 1422 . 1 1 133 133 TYR N N 15 121.977 0.15 . 1 . . . . 133 TYR N . 16380 1 1423 . 1 1 134 134 ASP H H 1 7.303 0.008 . 1 . . . . 134 ASP H . 16380 1 1424 . 1 1 134 134 ASP HA H 1 3.944 0.008 . 1 . . . . 134 ASP HA . 16380 1 1425 . 1 1 134 134 ASP HB2 H 1 2.314 0.008 . 2 . . . . 134 ASP HB2 . 16380 1 1426 . 1 1 134 134 ASP HB3 H 1 2.406 0.008 . 2 . . . . 134 ASP HB3 . 16380 1 1427 . 1 1 134 134 ASP CA C 13 52.540 0.2 . 1 . . . . 134 ASP CA . 16380 1 1428 . 1 1 134 134 ASP CB C 13 42.900 0.2 . 1 . . . . 134 ASP CB . 16380 1 1429 . 1 1 134 134 ASP N N 15 127.820 0.15 . 1 . . . . 134 ASP N . 16380 1 1430 . 1 1 135 135 SER H H 1 9.392 0.008 . 1 . . . . 135 SER H . 16380 1 1431 . 1 1 135 135 SER HA H 1 3.945 0.008 . 1 . . . . 135 SER HA . 16380 1 1432 . 1 1 135 135 SER HB2 H 1 3.971 0.008 . 2 . . . . 135 SER HB2 . 16380 1 1433 . 1 1 135 135 SER HB3 H 1 4.370 0.008 . 2 . . . . 135 SER HB3 . 16380 1 1434 . 1 1 135 135 SER CA C 13 61.770 0.2 . 1 . . . . 135 SER CA . 16380 1 1435 . 1 1 135 135 SER CB C 13 63.561 0.2 . 1 . . . . 135 SER CB . 16380 1 1436 . 1 1 135 135 SER N N 15 127.670 0.15 . 1 . . . . 135 SER N . 16380 1 1437 . 1 1 136 136 GLU H H 1 7.546 0.008 . 1 . . . . 136 GLU H . 16380 1 1438 . 1 1 136 136 GLU HA H 1 4.233 0.008 . 1 . . . . 136 GLU HA . 16380 1 1439 . 1 1 136 136 GLU HB2 H 1 2.299 0.008 . 2 . . . . 136 GLU HB2 . 16380 1 1440 . 1 1 136 136 GLU HB3 H 1 1.602 0.008 . 2 . . . . 136 GLU HB3 . 16380 1 1441 . 1 1 136 136 GLU HG2 H 1 2.289 0.008 . 2 . . . . 136 GLU HG2 . 16380 1 1442 . 1 1 136 136 GLU HG3 H 1 2.076 0.008 . 2 . . . . 136 GLU HG3 . 16380 1 1443 . 1 1 136 136 GLU CA C 13 54.796 0.2 . 1 . . . . 136 GLU CA . 16380 1 1444 . 1 1 136 136 GLU CB C 13 28.420 0.2 . 1 . . . . 136 GLU CB . 16380 1 1445 . 1 1 136 136 GLU CG C 13 35.955 0.2 . 1 . . . . 136 GLU CG . 16380 1 1446 . 1 1 136 136 GLU N N 15 113.107 0.15 . 1 . . . . 136 GLU N . 16380 1 1447 . 1 1 137 137 GLY H H 1 7.241 0.008 . 1 . . . . 137 GLY H . 16380 1 1448 . 1 1 137 137 GLY HA2 H 1 3.994 0.008 . 2 . . . . 137 GLY HA2 . 16380 1 1449 . 1 1 137 137 GLY HA3 H 1 3.503 0.008 . 2 . . . . 137 GLY HA3 . 16380 1 1450 . 1 1 137 137 GLY CA C 13 44.880 0.2 . 1 . . . . 137 GLY CA . 16380 1 1451 . 1 1 137 137 GLY N N 15 104.690 0.15 . 1 . . . . 137 GLY N . 16380 1 1452 . 1 1 138 138 PRO HA H 1 4.211 0.008 . 1 . . . . 138 PRO HA . 16380 1 1453 . 1 1 138 138 PRO HB2 H 1 2.183 0.008 . 2 . . . . 138 PRO HB2 . 16380 1 1454 . 1 1 138 138 PRO HB3 H 1 1.974 0.008 . 2 . . . . 138 PRO HB3 . 16380 1 1455 . 1 1 138 138 PRO HD2 H 1 3.525 0.008 . 2 . . . . 138 PRO HD2 . 16380 1 1456 . 1 1 138 138 PRO HD3 H 1 3.580 0.008 . 2 . . . . 138 PRO HD3 . 16380 1 1457 . 1 1 138 138 PRO HG2 H 1 1.975 0.008 . 2 . . . . 138 PRO HG2 . 16380 1 1458 . 1 1 138 138 PRO HG3 H 1 1.924 0.008 . 2 . . . . 138 PRO HG3 . 16380 1 1459 . 1 1 138 138 PRO CA C 13 64.830 0.2 . 1 . . . . 138 PRO CA . 16380 1 1460 . 1 1 138 138 PRO CB C 13 31.180 0.2 . 1 . . . . 138 PRO CB . 16380 1 1461 . 1 1 138 138 PRO CD C 13 50.390 0.2 . 1 . . . . 138 PRO CD . 16380 1 1462 . 1 1 138 138 PRO CG C 13 27.145 0.2 . 1 . . . . 138 PRO CG . 16380 1 1463 . 1 1 139 139 HIS H H 1 6.414 0.008 . 1 . . . . 139 HIS H . 16380 1 1464 . 1 1 139 139 HIS HA H 1 4.299 0.008 . 1 . . . . 139 HIS HA . 16380 1 1465 . 1 1 139 139 HIS HB2 H 1 3.167 0.008 . 2 . . . . 139 HIS HB2 . 16380 1 1466 . 1 1 139 139 HIS HD2 H 1 7.124 0.008 . 1 . . . . 139 HIS HD2 . 16380 1 1467 . 1 1 139 139 HIS CA C 13 55.080 0.2 . 1 . . . . 139 HIS CA . 16380 1 1468 . 1 1 139 139 HIS CB C 13 30.260 0.2 . 1 . . . . 139 HIS CB . 16380 1 1469 . 1 1 139 139 HIS CD2 C 13 118.287 0.2 . 1 . . . . 139 HIS CD2 . 16380 1 1470 . 1 1 139 139 HIS N N 15 116.498 0.15 . 1 . . . . 139 HIS N . 16380 1 1471 . 1 1 140 140 GLY H H 1 7.082 0.008 . 1 . . . . 140 GLY H . 16380 1 1472 . 1 1 140 140 GLY HA2 H 1 3.919 0.008 . 2 . . . . 140 GLY HA2 . 16380 1 1473 . 1 1 140 140 GLY HA3 H 1 3.721 0.008 . 2 . . . . 140 GLY HA3 . 16380 1 1474 . 1 1 140 140 GLY CA C 13 46.590 0.2 . 1 . . . . 140 GLY CA . 16380 1 1475 . 1 1 140 140 GLY N N 15 108.485 0.15 . 1 . . . . 140 GLY N . 16380 1 1476 . 1 1 141 141 LEU HA H 1 4.451 0.008 . 1 . . . . 141 LEU HA . 16380 1 1477 . 1 1 141 141 LEU HB2 H 1 2.049 0.008 . 2 . . . . 141 LEU HB2 . 16380 1 1478 . 1 1 141 141 LEU HB3 H 1 0.765 0.008 . 2 . . . . 141 LEU HB3 . 16380 1 1479 . 1 1 141 141 LEU HD11 H 1 0.779 0.008 . 2 . . . . 141 LEU QD1 . 16380 1 1480 . 1 1 141 141 LEU HD12 H 1 0.779 0.008 . 2 . . . . 141 LEU QD1 . 16380 1 1481 . 1 1 141 141 LEU HD13 H 1 0.779 0.008 . 2 . . . . 141 LEU QD1 . 16380 1 1482 . 1 1 141 141 LEU HG H 1 1.615 0.008 . 1 . . . . 141 LEU HG . 16380 1 1483 . 1 1 141 141 LEU CA C 13 53.024 0.2 . 1 . . . . 141 LEU CA . 16380 1 1484 . 1 1 141 141 LEU CB C 13 39.500 0.2 . 1 . . . . 141 LEU CB . 16380 1 1485 . 1 1 141 141 LEU CD1 C 13 26.528 0.2 . 2 . . . . 141 LEU CD1 . 16380 1 1486 . 1 1 141 141 LEU CG C 13 25.690 0.2 . 1 . . . . 141 LEU CG . 16380 1 1487 . 1 1 142 142 ARG H H 1 7.472 0.008 . 1 . . . . 142 ARG H . 16380 1 1488 . 1 1 142 142 ARG HA H 1 4.724 0.008 . 1 . . . . 142 ARG HA . 16380 1 1489 . 1 1 142 142 ARG HB2 H 1 1.605 0.008 . 2 . . . . 142 ARG HB2 . 16380 1 1490 . 1 1 142 142 ARG HD2 H 1 3.141 0.008 . 2 . . . . 142 ARG HD2 . 16380 1 1491 . 1 1 142 142 ARG HE H 1 7.900 0.008 . 1 . . . . 142 ARG HE . 16380 1 1492 . 1 1 142 142 ARG HG2 H 1 1.540 0.008 . 2 . . . . 142 ARG HG2 . 16380 1 1493 . 1 1 142 142 ARG CA C 13 55.940 0.2 . 1 . . . . 142 ARG CA . 16380 1 1494 . 1 1 142 142 ARG CB C 13 31.070 0.2 . 1 . . . . 142 ARG CB . 16380 1 1495 . 1 1 142 142 ARG CD C 13 43.520 0.2 . 1 . . . . 142 ARG CD . 16380 1 1496 . 1 1 142 142 ARG CG C 13 27.661 0.2 . 1 . . . . 142 ARG CG . 16380 1 1497 . 1 1 142 142 ARG N N 15 121.987 0.15 . 1 . . . . 142 ARG N . 16380 1 1498 . 1 1 142 142 ARG NE N 15 86.566 0.15 . 1 . . . . 142 ARG NE . 16380 1 1499 . 1 1 143 143 TYR H H 1 8.487 0.008 . 1 . . . . 143 TYR H . 16380 1 1500 . 1 1 143 143 TYR HA H 1 4.474 0.008 . 1 . . . . 143 TYR HA . 16380 1 1501 . 1 1 143 143 TYR HB2 H 1 3.382 0.008 . 2 . . . . 143 TYR HB2 . 16380 1 1502 . 1 1 143 143 TYR HB3 H 1 2.761 0.008 . 2 . . . . 143 TYR HB3 . 16380 1 1503 . 1 1 143 143 TYR HD1 H 1 6.992 0.008 . 3 . . . . 143 TYR QD . 16380 1 1504 . 1 1 143 143 TYR HD2 H 1 6.992 0.008 . 3 . . . . 143 TYR QD . 16380 1 1505 . 1 1 143 143 TYR HE1 H 1 6.722 0.008 . 3 . . . . 143 TYR QE . 16380 1 1506 . 1 1 143 143 TYR HE2 H 1 6.722 0.008 . 3 . . . . 143 TYR QE . 16380 1 1507 . 1 1 143 143 TYR CA C 13 59.015 0.2 . 1 . . . . 143 TYR CA . 16380 1 1508 . 1 1 143 143 TYR CB C 13 38.720 0.2 . 1 . . . . 143 TYR CB . 16380 1 1509 . 1 1 143 143 TYR CD1 C 13 133.126 0.2 . 3 . . . . 143 TYR CD1 . 16380 1 1510 . 1 1 143 143 TYR CE1 C 13 117.859 0.2 . 3 . . . . 143 TYR CE1 . 16380 1 1511 . 1 1 143 143 TYR N N 15 127.896 0.15 . 1 . . . . 143 TYR N . 16380 1 1512 . 1 1 144 144 ASN H H 1 7.805 0.008 . 1 . . . . 144 ASN H . 16380 1 1513 . 1 1 144 144 ASN HA H 1 4.892 0.008 . 1 . . . . 144 ASN HA . 16380 1 1514 . 1 1 144 144 ASN HB2 H 1 2.651 0.008 . 2 . . . . 144 ASN HB2 . 16380 1 1515 . 1 1 144 144 ASN HB3 H 1 2.361 0.008 . 2 . . . . 144 ASN HB3 . 16380 1 1516 . 1 1 144 144 ASN HD21 H 1 7.441 0.008 . 2 . . . . 144 ASN HD21 . 16380 1 1517 . 1 1 144 144 ASN HD22 H 1 6.720 0.008 . 2 . . . . 144 ASN HD22 . 16380 1 1518 . 1 1 144 144 ASN CA C 13 50.120 0.2 . 1 . . . . 144 ASN CA . 16380 1 1519 . 1 1 144 144 ASN CB C 13 39.360 0.2 . 1 . . . . 144 ASN CB . 16380 1 1520 . 1 1 144 144 ASN N N 15 125.629 0.15 . 1 . . . . 144 ASN N . 16380 1 1521 . 1 1 144 144 ASN ND2 N 15 111.468 0.15 . 1 . . . . 144 ASN ND2 . 16380 1 1522 . 1 1 145 145 PRO HA H 1 3.975 0.008 . 1 . . . . 145 PRO HA . 16380 1 1523 . 1 1 145 145 PRO HB2 H 1 1.881 0.008 . 2 . . . . 145 PRO HB2 . 16380 1 1524 . 1 1 145 145 PRO HB3 H 1 2.136 0.008 . 2 . . . . 145 PRO HB3 . 16380 1 1525 . 1 1 145 145 PRO HD2 H 1 3.580 0.008 . 2 . . . . 145 PRO HD2 . 16380 1 1526 . 1 1 145 145 PRO HD3 H 1 3.271 0.008 . 2 . . . . 145 PRO HD3 . 16380 1 1527 . 1 1 145 145 PRO HG2 H 1 1.878 0.008 . 2 . . . . 145 PRO HG2 . 16380 1 1528 . 1 1 145 145 PRO CA C 13 63.140 0.2 . 1 . . . . 145 PRO CA . 16380 1 1529 . 1 1 145 145 PRO CB C 13 32.386 0.2 . 1 . . . . 145 PRO CB . 16380 1 1530 . 1 1 145 145 PRO CD C 13 50.438 0.2 . 1 . . . . 145 PRO CD . 16380 1 1531 . 1 1 145 145 PRO CG C 13 27.000 0.2 . 1 . . . . 145 PRO CG . 16380 1 1532 . 1 1 146 146 ARG H H 1 8.055 0.008 . 1 . . . . 146 ARG H . 16380 1 1533 . 1 1 146 146 ARG HA H 1 3.918 0.008 . 1 . . . . 146 ARG HA . 16380 1 1534 . 1 1 146 146 ARG HB2 H 1 1.574 0.008 . 2 . . . . 146 ARG HB2 . 16380 1 1535 . 1 1 146 146 ARG HB3 H 1 1.665 0.008 . 2 . . . . 146 ARG HB3 . 16380 1 1536 . 1 1 146 146 ARG HD2 H 1 3.025 0.008 . 2 . . . . 146 ARG HD2 . 16380 1 1537 . 1 1 146 146 ARG HD3 H 1 3.001 0.008 . 2 . . . . 146 ARG HD3 . 16380 1 1538 . 1 1 146 146 ARG HE H 1 6.942 0.008 . 1 . . . . 146 ARG HE . 16380 1 1539 . 1 1 146 146 ARG HG2 H 1 1.383 0.008 . 2 . . . . 146 ARG HG2 . 16380 1 1540 . 1 1 146 146 ARG HG3 H 1 1.477 0.008 . 2 . . . . 146 ARG HG3 . 16380 1 1541 . 1 1 146 146 ARG CA C 13 56.740 0.2 . 1 . . . . 146 ARG CA . 16380 1 1542 . 1 1 146 146 ARG CB C 13 30.430 0.2 . 1 . . . . 146 ARG CB . 16380 1 1543 . 1 1 146 146 ARG CD C 13 43.459 0.2 . 1 . . . . 146 ARG CD . 16380 1 1544 . 1 1 146 146 ARG CG C 13 27.162 0.2 . 1 . . . . 146 ARG CG . 16380 1 1545 . 1 1 146 146 ARG N N 15 120.069 0.15 . 1 . . . . 146 ARG N . 16380 1 1546 . 1 1 146 146 ARG NE N 15 84.986 0.15 . 1 . . . . 146 ARG NE . 16380 1 1547 . 1 1 147 147 GLU H H 1 8.440 0.008 . 1 . . . . 147 GLU H . 16380 1 1548 . 1 1 147 147 GLU HA H 1 4.167 0.008 . 1 . . . . 147 GLU HA . 16380 1 1549 . 1 1 147 147 GLU HB2 H 1 1.856 0.008 . 2 . . . . 147 GLU HB2 . 16380 1 1550 . 1 1 147 147 GLU HB3 H 1 1.953 0.008 . 2 . . . . 147 GLU HB3 . 16380 1 1551 . 1 1 147 147 GLU HG3 H 1 2.178 0.008 . 2 . . . . 147 GLU HG3 . 16380 1 1552 . 1 1 147 147 GLU CA C 13 56.710 0.2 . 1 . . . . 147 GLU CA . 16380 1 1553 . 1 1 147 147 GLU CB C 13 30.150 0.2 . 1 . . . . 147 GLU CB . 16380 1 1554 . 1 1 147 147 GLU CG C 13 36.190 0.2 . 1 . . . . 147 GLU CG . 16380 1 1555 . 1 1 147 147 GLU N N 15 120.760 0.15 . 1 . . . . 147 GLU N . 16380 1 1556 . 1 1 148 148 ASN H H 1 8.363 0.008 . 1 . . . . 148 ASN H . 16380 1 1557 . 1 1 148 148 ASN HA H 1 4.652 0.008 . 1 . . . . 148 ASN HA . 16380 1 1558 . 1 1 148 148 ASN HB2 H 1 2.779 0.008 . 2 . . . . 148 ASN HB2 . 16380 1 1559 . 1 1 148 148 ASN HB3 H 1 2.634 0.008 . 2 . . . . 148 ASN HB3 . 16380 1 1560 . 1 1 148 148 ASN HD21 H 1 7.556 0.008 . 2 . . . . 148 ASN HD21 . 16380 1 1561 . 1 1 148 148 ASN HD22 H 1 6.816 0.008 . 2 . . . . 148 ASN HD22 . 16380 1 1562 . 1 1 148 148 ASN CA C 13 53.240 0.2 . 1 . . . . 148 ASN CA . 16380 1 1563 . 1 1 148 148 ASN CB C 13 38.840 0.2 . 1 . . . . 148 ASN CB . 16380 1 1564 . 1 1 148 148 ASN N N 15 120.210 0.15 . 1 . . . . 148 ASN N . 16380 1 1565 . 1 1 148 148 ASN ND2 N 15 112.833 0.15 . 1 . . . . 148 ASN ND2 . 16380 1 1566 . 1 1 149 149 ARG H H 1 7.755 0.008 . 1 . . . . 149 ARG H . 16380 1 1567 . 1 1 149 149 ARG HA H 1 4.088 0.008 . 1 . . . . 149 ARG HA . 16380 1 1568 . 1 1 149 149 ARG HB2 H 1 1.753 0.008 . 2 . . . . 149 ARG HB2 . 16380 1 1569 . 1 1 149 149 ARG HB3 H 1 1.606 0.008 . 2 . . . . 149 ARG HB3 . 16380 1 1570 . 1 1 149 149 ARG HD2 H 1 2.997 0.008 . 2 . . . . 149 ARG HD2 . 16380 1 1571 . 1 1 149 149 ARG HD3 H 1 2.662 0.008 . 2 . . . . 149 ARG HD3 . 16380 1 1572 . 1 1 149 149 ARG CA C 13 57.440 0.2 . 1 . . . . 149 ARG CA . 16380 1 1573 . 1 1 149 149 ARG CB C 13 31.554 0.2 . 1 . . . . 149 ARG CB . 16380 1 1574 . 1 1 149 149 ARG CD C 13 43.542 0.2 . 1 . . . . 149 ARG CD . 16380 1 1575 . 1 1 149 149 ARG N N 15 126.220 0.15 . 1 . . . . 149 ARG N . 16380 1 stop_ save_