data_17530 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 17530 _Entry.Title ; Solution NMR structure of the AHSA1-like protein RHE_CH02687 (1-152) from Rhizobium etli, Northeast Structural Genomics Consortium Target ReR242 ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2011-03-16 _Entry.Accession_date 2011-03-16 _Entry.Last_release_date 2011-04-11 _Entry.Original_release_date 2011-04-11 _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 3.1 _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 Yunhuang Yang . . . 17530 2 Theresa Ramelot . A. . 17530 3 John Cort . R. . 17530 4 Dongyan Wang . . . 17530 5 Colleen Ciccosanti . . . 17530 6 Haleema Janjua . . . 17530 7 Nair Rost . B. . 17530 8 Thomas Acton . B. . 17530 9 Rong Xiao . . . 17530 10 John Everett . K. . 17530 11 Gaetano Montelione . T. . 17530 12 Michael Kennedy . A. . 17530 stop_ loop_ _SG_project.SG_project_ID _SG_project.Project_name _SG_project.Full_name_of_center _SG_project.Initial_of_center _SG_project.Entry_ID 1 'PSI, Protein Structure Initiative' 'Northeast Structural Genomics Consortium' . 17530 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID 'Bacteroides Vulgatus' . 17530 'conjugate transposon protein' . 17530 NESG . 17530 'NMR structure' . 17530 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 17530 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 639 17530 '15N chemical shifts' 154 17530 '1H chemical shifts' 1017 17530 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 1 . . 2011-04-11 2011-03-16 original author . 17530 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 2LAK 'BMRB Entry Tracking System' 17530 stop_ save_ ############### # Citations # ############### save_citation_1 _Citation.Sf_category citations _Citation.Sf_framecode citation_1 _Citation.Entry_ID 17530 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID . _Citation.Full_citation . _Citation.Title 'Solution NMR structure of the AHSA1-like protein RHE_CH02687 (1-152) from Rhizobium etli, Northeast Structural Genomics Consortium Target ReR242' _Citation.Status 'in preparation' _Citation.Type journal _Citation.Journal_abbrev 'Not known' _Citation.Journal_name_full . _Citation.Journal_volume . _Citation.Journal_issue . _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first . _Citation.Page_last . _Citation.Year . _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Yunhuang Yang . . . 17530 1 2 Theresa Ramelot . A. . 17530 1 3 John Cort . R. . 17530 1 4 Dongyan Wang . . . 17530 1 5 Colleen Ciccosanti . . . 17530 1 6 Haleema Janjua . . . 17530 1 7 Nair Rost . B. . 17530 1 8 Thomas Acton . B. . 17530 1 9 Rong Xiao . . . 17530 1 10 John Everett . K. . 17530 1 11 Gaetano Montelione . T. . 17530 1 12 Michael Kennedy . A. . 17530 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 17530 _Assembly.ID 1 _Assembly.Name 'AHSA1-like protein RHE_CH02687 (1-152)' _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 'AHSA1-like protein RHE_CH02687 (1-152)' 1 $AHSA1-like_protein_RHE_CH02687_(1-152)_from_Rhizobium_etli A . yes native no no . . . 17530 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_AHSA1-like_protein_RHE_CH02687_(1-152)_from_Rhizobium_etli _Entity.Sf_category entity _Entity.Sf_framecode AHSA1-like_protein_RHE_CH02687_(1-152)_from_Rhizobium_etli _Entity.Entry_ID 17530 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name AHSA1-like_protein_RHE_CH02687_(1-152)_from_Rhizobium_etli _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 ; MEKAMPESFVVRREAHLAAP PAAVFALMTDPEKILRWMGT EAEVEPEPGGLYLVNVTGAR FARGSFREVVPVHRLAYSFG WDGSEVVPPGSSLVEIDLIE QGGGTLLRLTHSGLPSAEQC AGHEEGWAHYLGRLTEVAAG RDPGPDPFYGRRLEHHHHHH ; _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 160 _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 17575.8 _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 2LAK . "Solution Nmr Structure Of The Ahsa1-Like Protein Rhe_ch02687 (1-152) From Rhizobium Etli, Northeast Structural Genomics Consort" . . . . . 100.00 160 100.00 100.00 9.74e-110 . . . . 17530 1 2 no GB ABC91458 . "hypothetical conserved protein [Rhizobium etli CFN 42]" . . . . . 95.00 152 100.00 100.00 3.03e-103 . . . . 17530 1 3 no GB AGS22491 . "activator of Hsp90 ATPase 1 family protein [Rhizobium etli bv. mimosae str. Mim1]" . . . . . 95.00 152 100.00 100.00 3.03e-103 . . . . 17530 1 4 no REF WP_041678693 . "transcriptional regulator [Rhizobium etli]" . . . . . 92.50 148 100.00 100.00 3.11e-100 . . . . 17530 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 . 17530 1 2 . GLU . 17530 1 3 . LYS . 17530 1 4 . ALA . 17530 1 5 . MET . 17530 1 6 . PRO . 17530 1 7 . GLU . 17530 1 8 . SER . 17530 1 9 . PHE . 17530 1 10 . VAL . 17530 1 11 . VAL . 17530 1 12 . ARG . 17530 1 13 . ARG . 17530 1 14 . GLU . 17530 1 15 . ALA . 17530 1 16 . HIS . 17530 1 17 . LEU . 17530 1 18 . ALA . 17530 1 19 . ALA . 17530 1 20 . PRO . 17530 1 21 . PRO . 17530 1 22 . ALA . 17530 1 23 . ALA . 17530 1 24 . VAL . 17530 1 25 . PHE . 17530 1 26 . ALA . 17530 1 27 . LEU . 17530 1 28 . MET . 17530 1 29 . THR . 17530 1 30 . ASP . 17530 1 31 . PRO . 17530 1 32 . GLU . 17530 1 33 . LYS . 17530 1 34 . ILE . 17530 1 35 . LEU . 17530 1 36 . ARG . 17530 1 37 . TRP . 17530 1 38 . MET . 17530 1 39 . GLY . 17530 1 40 . THR . 17530 1 41 . GLU . 17530 1 42 . ALA . 17530 1 43 . GLU . 17530 1 44 . VAL . 17530 1 45 . GLU . 17530 1 46 . PRO . 17530 1 47 . GLU . 17530 1 48 . PRO . 17530 1 49 . GLY . 17530 1 50 . GLY . 17530 1 51 . LEU . 17530 1 52 . TYR . 17530 1 53 . LEU . 17530 1 54 . VAL . 17530 1 55 . ASN . 17530 1 56 . VAL . 17530 1 57 . THR . 17530 1 58 . GLY . 17530 1 59 . ALA . 17530 1 60 . ARG . 17530 1 61 . PHE . 17530 1 62 . ALA . 17530 1 63 . ARG . 17530 1 64 . GLY . 17530 1 65 . SER . 17530 1 66 . PHE . 17530 1 67 . ARG . 17530 1 68 . GLU . 17530 1 69 . VAL . 17530 1 70 . VAL . 17530 1 71 . PRO . 17530 1 72 . VAL . 17530 1 73 . HIS . 17530 1 74 . ARG . 17530 1 75 . LEU . 17530 1 76 . ALA . 17530 1 77 . TYR . 17530 1 78 . SER . 17530 1 79 . PHE . 17530 1 80 . GLY . 17530 1 81 . TRP . 17530 1 82 . ASP . 17530 1 83 . GLY . 17530 1 84 . SER . 17530 1 85 . GLU . 17530 1 86 . VAL . 17530 1 87 . VAL . 17530 1 88 . PRO . 17530 1 89 . PRO . 17530 1 90 . GLY . 17530 1 91 . SER . 17530 1 92 . SER . 17530 1 93 . LEU . 17530 1 94 . VAL . 17530 1 95 . GLU . 17530 1 96 . ILE . 17530 1 97 . ASP . 17530 1 98 . LEU . 17530 1 99 . ILE . 17530 1 100 . GLU . 17530 1 101 . GLN . 17530 1 102 . GLY . 17530 1 103 . GLY . 17530 1 104 . GLY . 17530 1 105 . THR . 17530 1 106 . LEU . 17530 1 107 . LEU . 17530 1 108 . ARG . 17530 1 109 . LEU . 17530 1 110 . THR . 17530 1 111 . HIS . 17530 1 112 . SER . 17530 1 113 . GLY . 17530 1 114 . LEU . 17530 1 115 . PRO . 17530 1 116 . SER . 17530 1 117 . ALA . 17530 1 118 . GLU . 17530 1 119 . GLN . 17530 1 120 . CYS . 17530 1 121 . ALA . 17530 1 122 . GLY . 17530 1 123 . HIS . 17530 1 124 . GLU . 17530 1 125 . GLU . 17530 1 126 . GLY . 17530 1 127 . TRP . 17530 1 128 . ALA . 17530 1 129 . HIS . 17530 1 130 . TYR . 17530 1 131 . LEU . 17530 1 132 . GLY . 17530 1 133 . ARG . 17530 1 134 . LEU . 17530 1 135 . THR . 17530 1 136 . GLU . 17530 1 137 . VAL . 17530 1 138 . ALA . 17530 1 139 . ALA . 17530 1 140 . GLY . 17530 1 141 . ARG . 17530 1 142 . ASP . 17530 1 143 . PRO . 17530 1 144 . GLY . 17530 1 145 . PRO . 17530 1 146 . ASP . 17530 1 147 . PRO . 17530 1 148 . PHE . 17530 1 149 . TYR . 17530 1 150 . GLY . 17530 1 151 . ARG . 17530 1 152 . ARG . 17530 1 153 . LEU . 17530 1 154 . GLU . 17530 1 155 . HIS . 17530 1 156 . HIS . 17530 1 157 . HIS . 17530 1 158 . HIS . 17530 1 159 . HIS . 17530 1 160 . HIS . 17530 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 17530 1 . GLU 2 2 17530 1 . LYS 3 3 17530 1 . ALA 4 4 17530 1 . MET 5 5 17530 1 . PRO 6 6 17530 1 . GLU 7 7 17530 1 . SER 8 8 17530 1 . PHE 9 9 17530 1 . VAL 10 10 17530 1 . VAL 11 11 17530 1 . ARG 12 12 17530 1 . ARG 13 13 17530 1 . GLU 14 14 17530 1 . ALA 15 15 17530 1 . HIS 16 16 17530 1 . LEU 17 17 17530 1 . ALA 18 18 17530 1 . ALA 19 19 17530 1 . PRO 20 20 17530 1 . PRO 21 21 17530 1 . ALA 22 22 17530 1 . ALA 23 23 17530 1 . VAL 24 24 17530 1 . PHE 25 25 17530 1 . ALA 26 26 17530 1 . LEU 27 27 17530 1 . MET 28 28 17530 1 . THR 29 29 17530 1 . ASP 30 30 17530 1 . PRO 31 31 17530 1 . GLU 32 32 17530 1 . LYS 33 33 17530 1 . ILE 34 34 17530 1 . LEU 35 35 17530 1 . ARG 36 36 17530 1 . TRP 37 37 17530 1 . MET 38 38 17530 1 . GLY 39 39 17530 1 . THR 40 40 17530 1 . GLU 41 41 17530 1 . ALA 42 42 17530 1 . GLU 43 43 17530 1 . VAL 44 44 17530 1 . GLU 45 45 17530 1 . PRO 46 46 17530 1 . GLU 47 47 17530 1 . PRO 48 48 17530 1 . GLY 49 49 17530 1 . GLY 50 50 17530 1 . LEU 51 51 17530 1 . TYR 52 52 17530 1 . LEU 53 53 17530 1 . VAL 54 54 17530 1 . ASN 55 55 17530 1 . VAL 56 56 17530 1 . THR 57 57 17530 1 . GLY 58 58 17530 1 . ALA 59 59 17530 1 . ARG 60 60 17530 1 . PHE 61 61 17530 1 . ALA 62 62 17530 1 . ARG 63 63 17530 1 . GLY 64 64 17530 1 . SER 65 65 17530 1 . PHE 66 66 17530 1 . ARG 67 67 17530 1 . GLU 68 68 17530 1 . VAL 69 69 17530 1 . VAL 70 70 17530 1 . PRO 71 71 17530 1 . VAL 72 72 17530 1 . HIS 73 73 17530 1 . ARG 74 74 17530 1 . LEU 75 75 17530 1 . ALA 76 76 17530 1 . TYR 77 77 17530 1 . SER 78 78 17530 1 . PHE 79 79 17530 1 . GLY 80 80 17530 1 . TRP 81 81 17530 1 . ASP 82 82 17530 1 . GLY 83 83 17530 1 . SER 84 84 17530 1 . GLU 85 85 17530 1 . VAL 86 86 17530 1 . VAL 87 87 17530 1 . PRO 88 88 17530 1 . PRO 89 89 17530 1 . GLY 90 90 17530 1 . SER 91 91 17530 1 . SER 92 92 17530 1 . LEU 93 93 17530 1 . VAL 94 94 17530 1 . GLU 95 95 17530 1 . ILE 96 96 17530 1 . ASP 97 97 17530 1 . LEU 98 98 17530 1 . ILE 99 99 17530 1 . GLU 100 100 17530 1 . GLN 101 101 17530 1 . GLY 102 102 17530 1 . GLY 103 103 17530 1 . GLY 104 104 17530 1 . THR 105 105 17530 1 . LEU 106 106 17530 1 . LEU 107 107 17530 1 . ARG 108 108 17530 1 . LEU 109 109 17530 1 . THR 110 110 17530 1 . HIS 111 111 17530 1 . SER 112 112 17530 1 . GLY 113 113 17530 1 . LEU 114 114 17530 1 . PRO 115 115 17530 1 . SER 116 116 17530 1 . ALA 117 117 17530 1 . GLU 118 118 17530 1 . GLN 119 119 17530 1 . CYS 120 120 17530 1 . ALA 121 121 17530 1 . GLY 122 122 17530 1 . HIS 123 123 17530 1 . GLU 124 124 17530 1 . GLU 125 125 17530 1 . GLY 126 126 17530 1 . TRP 127 127 17530 1 . ALA 128 128 17530 1 . HIS 129 129 17530 1 . TYR 130 130 17530 1 . LEU 131 131 17530 1 . GLY 132 132 17530 1 . ARG 133 133 17530 1 . LEU 134 134 17530 1 . THR 135 135 17530 1 . GLU 136 136 17530 1 . VAL 137 137 17530 1 . ALA 138 138 17530 1 . ALA 139 139 17530 1 . GLY 140 140 17530 1 . ARG 141 141 17530 1 . ASP 142 142 17530 1 . PRO 143 143 17530 1 . GLY 144 144 17530 1 . PRO 145 145 17530 1 . ASP 146 146 17530 1 . PRO 147 147 17530 1 . PHE 148 148 17530 1 . TYR 149 149 17530 1 . GLY 150 150 17530 1 . ARG 151 151 17530 1 . ARG 152 152 17530 1 . LEU 153 153 17530 1 . GLU 154 154 17530 1 . HIS 155 155 17530 1 . HIS 156 156 17530 1 . HIS 157 157 17530 1 . HIS 158 158 17530 1 . HIS 159 159 17530 1 . HIS 160 160 17530 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 17530 _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 $AHSA1-like_protein_RHE_CH02687_(1-152)_from_Rhizobium_etli . 29449 organism . 'Rhizobium etli' 'Rhizobium etli' . . Bacteria . Rhizobium etli . . . . . . . . . . . . . . . . RHE_CH02687 . . . . 17530 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 17530 _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 $AHSA1-like_protein_RHE_CH02687_(1-152)_from_Rhizobium_etli . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli 'BL21(DE3) pMGK' . . . . . . . . . . . . . . . 'pET 21-23C' . . . 'C-tag sequence: LEHHHHHH' . . 17530 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_NC_sample _Sample.Sf_category sample _Sample.Sf_framecode NC_sample _Sample.Entry_ID 17530 _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 'AHSA1-like protein RHE_CH02687 (1-152) from Rhizobium etli' '[U-100% 13C; U-100% 15N]' . . 1 $AHSA1-like_protein_RHE_CH02687_(1-152)_from_Rhizobium_etli . . 0.72 . . mM 0.07 . . . 17530 1 2 MES 'natural abundance' . . . . . . 20 . . mM 1 . . . 17530 1 3 'sodium chloride' 'natural abundance' . . . . . . 100 . . mM 5 . . . 17530 1 4 'calcium chloride' 'natural abundance' . . . . . . 5 . . mM 0.25 . . . 17530 1 5 'sodium azide' 'natural abundance' . . . . . . 0.02 . . mM 0.001 . . . 17530 1 6 DTT 'natural abundance' . . . . . . 10 . . mM 0.5 . . . 17530 1 stop_ save_ save_NC5_sample _Sample.Sf_category sample _Sample.Sf_framecode NC5_sample _Sample.Entry_ID 17530 _Sample.ID 2 _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 'AHSA1-like protein RHE_CH02687 (1-152) from Rhizobium etli' '[U-5% 13C; U-100% 15N]' . . 1 $AHSA1-like_protein_RHE_CH02687_(1-152)_from_Rhizobium_etli . . 0.76 . . mM 0.07 . . . 17530 2 2 MES 'natural abundance' . . . . . . 20 . . mM 1 . . . 17530 2 3 'sodium chloride' 'natural abundance' . . . . . . 100 . . mM 5 . . . 17530 2 4 'calcium chloride' 'natural abundance' . . . . . . 5 . . mM 0.25 . . . 17530 2 5 DTT 'natural abundance' . . . . . . 10 . . mM 0.5 . . . 17530 2 6 'sodium azide' 'natural abundance' . . . . . . 0.02 . . mM 0.001 . . . 17530 2 stop_ save_ save_NC_sample_in_D2O _Sample.Sf_category sample _Sample.Sf_framecode NC_sample_in_D2O _Sample.Entry_ID 17530 _Sample.ID 3 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '100% 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 'AHSA1-like protein RHE_CH02687 (1-152) from Rhizobium etli' '[U-100% 13C; U-100% 15N]' . . 1 $AHSA1-like_protein_RHE_CH02687_(1-152)_from_Rhizobium_etli . . 0.72 . . mM 0.07 . . . 17530 3 2 MES 'natural abundance' . . . . . . 20 . . mM 1 . . . 17530 3 3 'sodium chloride' 'natural abundance' . . . . . . 100 . . mM 5 . . . 17530 3 4 'calcium chloride' 'natural abundance' . . . . . . 5 . . mM 0.25 . . . 17530 3 5 'sodium azide' 'natural abundance' . . . . . . 0.02 . . % 0.001 . . . 17530 3 6 DTT 'natural abundance' . . . . . . 10 . . mM 0.5 . . . 17530 3 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 17530 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 0.2 0.02 M 17530 1 pH 6.5 0.1 pH 17530 1 pressure 1 . atm 17530 1 temperature 298 1 K 17530 1 stop_ save_ ############################ # Computer software used # ############################ save_NMRPipe _Software.Sf_category software _Software.Sf_framecode NMRPipe _Software.Entry_ID 17530 _Software.ID 1 _Software.Name NMRPipe _Software.Version 2008 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . 17530 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 17530 1 stop_ save_ save_VNMR _Software.Sf_category software _Software.Sf_framecode VNMR _Software.Entry_ID 17530 _Software.ID 2 _Software.Name VNMR _Software.Version 6.1C _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Varian . . 17530 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection 17530 2 stop_ save_ save_TOPSPIN _Software.Sf_category software _Software.Sf_framecode TOPSPIN _Software.Entry_ID 17530 _Software.ID 3 _Software.Name TOPSPIN _Software.Version 2.1.4 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bruker Biospin' . . 17530 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection 17530 3 stop_ save_ save_AutoStructure _Software.Sf_category software _Software.Sf_framecode AutoStructure _Software.Entry_ID 17530 _Software.ID 4 _Software.Name AutoStruct _Software.Version 2.2.1 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Huang, Tejero, Powers and Montelione' . . 17530 4 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 17530 4 stop_ save_ save_X-PLOR_NIH _Software.Sf_category software _Software.Sf_framecode X-PLOR_NIH _Software.Entry_ID 17530 _Software.ID 5 _Software.Name 'X-PLOR NIH' _Software.Version 2.25 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Schwieters, Kuszewski, Tjandra and Clore' . . 17530 5 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'structure solution' 17530 5 stop_ save_ save_CNS _Software.Sf_category software _Software.Sf_framecode CNS _Software.Entry_ID 17530 _Software.ID 6 _Software.Name CNS _Software.Version 1.2 _Software.Details 'water refinement' loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Brunger, Adams, Clore, Gros, Nilges and Read' . . 17530 6 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID refinement 17530 6 stop_ save_ save_SPARKY _Software.Sf_category software _Software.Sf_framecode SPARKY _Software.Entry_ID 17530 _Software.ID 7 _Software.Name SPARKY _Software.Version 3.113 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Goddard . . 17530 7 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 17530 7 stop_ save_ save_PSVS _Software.Sf_category software _Software.Sf_framecode PSVS _Software.Entry_ID 17530 _Software.ID 8 _Software.Name PSVS _Software.Version 1.4 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bhattacharya and Montelione' . . 17530 8 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID refinement 17530 8 stop_ save_ save_AutoAssign _Software.Sf_category software _Software.Sf_framecode AutoAssign _Software.Entry_ID 17530 _Software.ID 9 _Software.Name AutoAssign _Software.Version 2.30 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Zimmerman, Moseley, Kulikowski and Montelione' . . 17530 9 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 17530 9 stop_ save_ save_PDBSTAT _Software.Sf_category software _Software.Sf_framecode PDBSTAT _Software.Entry_ID 17530 _Software.ID 10 _Software.Name PDBStat _Software.Version 5.1 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID '(PdbStat)-Roberto Tejero and Gaetano T. Montelione' . . 17530 10 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'structure solution' 17530 10 stop_ save_ save_PINE_Server _Software.Sf_category software _Software.Sf_framecode PINE_Server _Software.Entry_ID 17530 _Software.ID 11 _Software.Name PINE _Software.Version 1.0 _Software.Details 'chemical shift autoassignment server' loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bahrami, Markley, Assadi, and Eghbalnia' . . 17530 11 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift autoassignment' 17530 11 stop_ save_ save_CYANA _Software.Sf_category software _Software.Sf_framecode CYANA _Software.Entry_ID 17530 _Software.ID 12 _Software.Name CYANA _Software.Version 2.1 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Guntert, Mumenthaler and Wuthrich' . . 17530 12 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'structure solution' 17530 12 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_850 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_850 _NMR_spectrometer.Entry_ID 17530 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model INOVA _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_spectrometer_600 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_600 _NMR_spectrometer.Entry_ID 17530 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model 'Avance III' _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 850 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 17530 _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_600 Varian INOVA . 600 . . . 17530 1 2 spectrometer_850 Bruker 'Avance III' . 850 . . . 17530 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 17530 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N HSQC' no . . . . . . . . . . 1 $NC_sample isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_850 . . . . . . . . . . . . . . . . 17530 1 2 '2D 1H-13C HSQC aliphatic' no . . . . . . . . . . 1 $NC_sample isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_850 . . . . . . . . . . . . . . . . 17530 1 3 '2D 1H-13C HSQC aromatic' no . . . . . . . . . . 1 $NC_sample isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_850 . . . . . . . . . . . . . . . . 17530 1 4 '2D 1H-15N HSQC' no . . . . . . . . . . 3 $NC_sample_in_D2O isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_600 . . . . . . . . . . . . . . . . 17530 1 5 '2D 1H-13C HSQC' no . . . . . . . . . . 3 $NC_sample_in_D2O isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_600 . . . . . . . . . . . . . . . . 17530 1 6 '2D 1H-13C HSQC-CT' no . . . . . . . . . . 2 $NC5_sample isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_600 . . . . . . . . . . . . . . . . 17530 1 7 '3D 1H-15N NOESY' no . . . . . . . . . . 2 $NC5_sample isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_850 . . . . . . . . . . . . . . . . 17530 1 8 '3D 1H-13C NOESY_aliph' no . . . . . . . . . . 1 $NC_sample isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_850 . . . . . . . . . . . . . . . . 17530 1 9 '3D HNCO' no . . . . . . . . . . 1 $NC_sample isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_600 . . . . . . . . . . . . . . . . 17530 1 10 '3D HNCACB' no . . . . . . . . . . 1 $NC_sample isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_600 . . . . . . . . . . . . . . . . 17530 1 11 '3D CBCA(CO)NH' no . . . . . . . . . . 1 $NC_sample isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_600 . . . . . . . . . . . . . . . . 17530 1 12 '3D HNCA' no . . . . . . . . . . 1 $NC_sample isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_600 . . . . . . . . . . . . . . . . 17530 1 13 '3D HN(CO)CA' no . . . . . . . . . . 1 $NC_sample isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_600 . . . . . . . . . . . . . . . . 17530 1 14 '3D HBHA(CO)NH' no . . . . . . . . . . 1 $NC_sample isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_600 . . . . . . . . . . . . . . . . 17530 1 15 '3D H(CCO)NH' no . . . . . . . . . . 1 $NC_sample isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_600 . . . . . . . . . . . . . . . . 17530 1 16 '3D C(CCO)NH' no . . . . . . . . . . 1 $NC_sample isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_600 . . . . . . . . . . . . . . . . 17530 1 17 '3D HCCH-COSY' no . . . . . . . . . . 1 $NC_sample isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_600 . . . . . . . . . . . . . . . . 17530 1 18 '3D HCCH-TOCSY' no . . . . . . . . . . 1 $NC_sample isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_600 . . . . . . . . . . . . . . . . 17530 1 19 '3D CCH-TOCSY' no . . . . . . . . . . 3 $NC_sample_in_D2O isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_600 . . . . . . . . . . . . . . . . 17530 1 20 '4D CC-NOESY' no . . . . . . . . . . 3 $NC_sample_in_D2O isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_600 . . . . . . . . . . . . . . . . 17530 1 21 '2D 1H-13C HSQC-aromatic' no . . . . . . . . . . 1 $NC_sample isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_850 . . . . . . . . . . . . . . . . 17530 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 17530 _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 0.00 . indirect 0.251449530 . . . . . . . . . 17530 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . . . . . 17530 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 . indirect 0.101329118 . . . . . . . . . 17530 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 17530 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' . . . 17530 1 2 '2D 1H-13C HSQC aliphatic' . . . 17530 1 3 '2D 1H-13C HSQC aromatic' . . . 17530 1 6 '2D 1H-13C HSQC-CT' . . . 17530 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 GLU HA H 1 4.37 0.02 . 1 . . . A 2 GLU HA . 17530 1 2 . 1 1 2 2 GLU HB2 H 1 1.93 0.02 . 2 . . . A 2 GLU HB2 . 17530 1 3 . 1 1 2 2 GLU HB3 H 1 2.07 0.02 . 2 . . . A 2 GLU HB3 . 17530 1 4 . 1 1 2 2 GLU HG2 H 1 2.29 0.02 . 2 . . . A 2 GLU HG2 . 17530 1 5 . 1 1 2 2 GLU HG3 H 1 2.29 0.02 . 2 . . . A 2 GLU HG3 . 17530 1 6 . 1 1 2 2 GLU C C 13 175.9 0.2 . 1 . . . A 2 GLU C . 17530 1 7 . 1 1 2 2 GLU CA C 13 56.5 0.2 . 1 . . . A 2 GLU CA . 17530 1 8 . 1 1 2 2 GLU CB C 13 30.5 0.2 . 1 . . . A 2 GLU CB . 17530 1 9 . 1 1 2 2 GLU CG C 13 36.1 0.2 . 1 . . . A 2 GLU CG . 17530 1 10 . 1 1 3 3 LYS H H 1 8.46 0.02 . 1 . . . A 3 LYS H . 17530 1 11 . 1 1 3 3 LYS HA H 1 4.30 0.02 . 1 . . . A 3 LYS HA . 17530 1 12 . 1 1 3 3 LYS HB2 H 1 1.75 0.02 . 2 . . . A 3 LYS HB2 . 17530 1 13 . 1 1 3 3 LYS HB3 H 1 1.83 0.02 . 2 . . . A 3 LYS HB3 . 17530 1 14 . 1 1 3 3 LYS HG2 H 1 1.45 0.02 . 2 . . . A 3 LYS HG2 . 17530 1 15 . 1 1 3 3 LYS HG3 H 1 1.45 0.02 . 2 . . . A 3 LYS HG3 . 17530 1 16 . 1 1 3 3 LYS HD2 H 1 1.46 0.02 . 2 . . . A 3 LYS HD2 . 17530 1 17 . 1 1 3 3 LYS HD3 H 1 1.7 0.02 . 2 . . . A 3 LYS HD3 . 17530 1 18 . 1 1 3 3 LYS HE2 H 1 3.03 0.02 . 2 . . . A 3 LYS HE2 . 17530 1 19 . 1 1 3 3 LYS HE3 H 1 3.03 0.02 . 2 . . . A 3 LYS HE3 . 17530 1 20 . 1 1 3 3 LYS C C 13 175.9 0.2 . 1 . . . A 3 LYS C . 17530 1 21 . 1 1 3 3 LYS CA C 13 56.3 0.2 . 1 . . . A 3 LYS CA . 17530 1 22 . 1 1 3 3 LYS CB C 13 33.3 0.2 . 1 . . . A 3 LYS CB . 17530 1 23 . 1 1 3 3 LYS CG C 13 24.8 0.2 . 1 . . . A 3 LYS CG . 17530 1 24 . 1 1 3 3 LYS CD C 13 29.3 0.2 . 1 . . . A 3 LYS CD . 17530 1 25 . 1 1 3 3 LYS CE C 13 42.2 0.2 . 1 . . . A 3 LYS CE . 17530 1 26 . 1 1 3 3 LYS N N 15 122.9 0.2 . 1 . . . A 3 LYS N . 17530 1 27 . 1 1 4 4 ALA H H 1 8.39 0.02 . 1 . . . A 4 ALA H . 17530 1 28 . 1 1 4 4 ALA HA H 1 4.32 0.02 . 1 . . . A 4 ALA HA . 17530 1 29 . 1 1 4 4 ALA HB1 H 1 1.39 0.02 . 1 . . . A 4 ALA HB1 . 17530 1 30 . 1 1 4 4 ALA HB2 H 1 1.39 0.02 . 1 . . . A 4 ALA HB2 . 17530 1 31 . 1 1 4 4 ALA HB3 H 1 1.39 0.02 . 1 . . . A 4 ALA HB3 . 17530 1 32 . 1 1 4 4 ALA C C 13 177.4 0.2 . 1 . . . A 4 ALA C . 17530 1 33 . 1 1 4 4 ALA CA C 13 52.4 0.2 . 1 . . . A 4 ALA CA . 17530 1 34 . 1 1 4 4 ALA CB C 13 19.4 0.2 . 1 . . . A 4 ALA CB . 17530 1 35 . 1 1 4 4 ALA N N 15 125.8 0.2 . 1 . . . A 4 ALA N . 17530 1 36 . 1 1 5 5 MET H H 1 8.37 0.02 . 1 . . . A 5 MET H . 17530 1 37 . 1 1 5 5 MET HA H 1 4.81 0.02 . 1 . . . A 5 MET HA . 17530 1 38 . 1 1 5 5 MET HB2 H 1 2.59 0.02 . 2 . . . A 5 MET HB2 . 17530 1 39 . 1 1 5 5 MET HB3 H 1 2.68 0.02 . 2 . . . A 5 MET HB3 . 17530 1 40 . 1 1 5 5 MET HG2 H 1 1.96 0.02 . 2 . . . A 5 MET HG2 . 17530 1 41 . 1 1 5 5 MET HG3 H 1 2.09 0.02 . 2 . . . A 5 MET HG3 . 17530 1 42 . 1 1 5 5 MET CA C 13 53.4 0.2 . 1 . . . A 5 MET CA . 17530 1 43 . 1 1 5 5 MET CB C 13 32.3 0.2 . 1 . . . A 5 MET CB . 17530 1 44 . 1 1 5 5 MET CG C 13 32.2 0.2 . 1 . . . A 5 MET CG . 17530 1 45 . 1 1 5 5 MET N N 15 121.1 0.2 . 1 . . . A 5 MET N . 17530 1 46 . 1 1 6 6 PRO HA H 1 4.4 0.02 . 1 . . . A 6 PRO HA . 17530 1 47 . 1 1 6 6 PRO HB2 H 1 2.32 0.02 . 2 . . . A 6 PRO HB2 . 17530 1 48 . 1 1 6 6 PRO HB3 H 1 1.9 0.02 . 2 . . . A 6 PRO HB3 . 17530 1 49 . 1 1 6 6 PRO HG2 H 1 2.03 0.02 . 2 . . . A 6 PRO HG2 . 17530 1 50 . 1 1 6 6 PRO HG3 H 1 2.03 0.02 . 2 . . . A 6 PRO HG3 . 17530 1 51 . 1 1 6 6 PRO HD2 H 1 3.85 0.02 . 2 . . . A 6 PRO HD2 . 17530 1 52 . 1 1 6 6 PRO HD3 H 1 3.71 0.02 . 2 . . . A 6 PRO HD3 . 17530 1 53 . 1 1 6 6 PRO C C 13 176.8 0.2 . 1 . . . A 6 PRO C . 17530 1 54 . 1 1 6 6 PRO CA C 13 63.3 0.2 . 1 . . . A 6 PRO CA . 17530 1 55 . 1 1 6 6 PRO CB C 13 32.2 0.2 . 1 . . . A 6 PRO CB . 17530 1 56 . 1 1 6 6 PRO CG C 13 27.5 0.2 . 1 . . . A 6 PRO CG . 17530 1 57 . 1 1 6 6 PRO CD C 13 50.8 0.2 . 1 . . . A 6 PRO CD . 17530 1 58 . 1 1 7 7 GLU H H 1 8.5 0.02 . 1 . . . A 7 GLU H . 17530 1 59 . 1 1 7 7 GLU HA H 1 4.2 0.02 . 1 . . . A 7 GLU HA . 17530 1 60 . 1 1 7 7 GLU HB2 H 1 1.9 0.02 . 2 . . . A 7 GLU HB2 . 17530 1 61 . 1 1 7 7 GLU HB3 H 1 1.93 0.02 . 2 . . . A 7 GLU HB3 . 17530 1 62 . 1 1 7 7 GLU HG2 H 1 2.16 0.02 . 2 . . . A 7 GLU HG2 . 17530 1 63 . 1 1 7 7 GLU HG3 H 1 2.23 0.02 . 2 . . . A 7 GLU HG3 . 17530 1 64 . 1 1 7 7 GLU C C 13 175.7 0.2 . 1 . . . A 7 GLU C . 17530 1 65 . 1 1 7 7 GLU CA C 13 56.7 0.2 . 1 . . . A 7 GLU CA . 17530 1 66 . 1 1 7 7 GLU CB C 13 30.6 0.2 . 1 . . . A 7 GLU CB . 17530 1 67 . 1 1 7 7 GLU CG C 13 36.3 0.2 . 1 . . . A 7 GLU CG . 17530 1 68 . 1 1 7 7 GLU N N 15 120.8 0.2 . 1 . . . A 7 GLU N . 17530 1 69 . 1 1 8 8 SER H H 1 7.98 0.02 . 1 . . . A 8 SER H . 17530 1 70 . 1 1 8 8 SER HA H 1 4.42 0.02 . 1 . . . A 8 SER HA . 17530 1 71 . 1 1 8 8 SER HB2 H 1 3.66 0.02 . 2 . . . A 8 SER HB2 . 17530 1 72 . 1 1 8 8 SER HB3 H 1 3.66 0.02 . 2 . . . A 8 SER HB3 . 17530 1 73 . 1 1 8 8 SER C C 13 173.3 0.2 . 1 . . . A 8 SER C . 17530 1 74 . 1 1 8 8 SER CA C 13 57.8 0.2 . 1 . . . A 8 SER CA . 17530 1 75 . 1 1 8 8 SER CB C 13 64.3 0.2 . 1 . . . A 8 SER CB . 17530 1 76 . 1 1 8 8 SER N N 15 115.3 0.2 . 1 . . . A 8 SER N . 17530 1 77 . 1 1 9 9 PHE H H 1 8.58 0.02 . 1 . . . A 9 PHE H . 17530 1 78 . 1 1 9 9 PHE HA H 1 4.78 0.02 . 1 . . . A 9 PHE HA . 17530 1 79 . 1 1 9 9 PHE HB2 H 1 2.76 0.02 . 2 . . . A 9 PHE HB2 . 17530 1 80 . 1 1 9 9 PHE HB3 H 1 3.01 0.02 . 2 . . . A 9 PHE HB3 . 17530 1 81 . 1 1 9 9 PHE HD1 H 1 7.18 0.02 . 3 . . . A 9 PHE HD1 . 17530 1 82 . 1 1 9 9 PHE HD2 H 1 7.18 0.02 . 3 . . . A 9 PHE HD2 . 17530 1 83 . 1 1 9 9 PHE HE1 H 1 7.28 0.02 . 3 . . . A 9 PHE HE1 . 17530 1 84 . 1 1 9 9 PHE HE2 H 1 7.28 0.02 . 3 . . . A 9 PHE HE2 . 17530 1 85 . 1 1 9 9 PHE HZ H 1 7.01 0.02 . 1 . . . A 9 PHE HZ . 17530 1 86 . 1 1 9 9 PHE C C 13 174.8 0.2 . 1 . . . A 9 PHE C . 17530 1 87 . 1 1 9 9 PHE CA C 13 57.3 0.2 . 1 . . . A 9 PHE CA . 17530 1 88 . 1 1 9 9 PHE CB C 13 39.7 0.2 . 1 . . . A 9 PHE CB . 17530 1 89 . 1 1 9 9 PHE CD1 C 13 131.5 0.2 . 3 . . . A 9 PHE CD1 . 17530 1 90 . 1 1 9 9 PHE CD2 C 13 131.5 0.2 . 3 . . . A 9 PHE CD2 . 17530 1 91 . 1 1 9 9 PHE CE1 C 13 130.2 0.2 . 3 . . . A 9 PHE CE1 . 17530 1 92 . 1 1 9 9 PHE CE2 C 13 130.2 0.2 . 3 . . . A 9 PHE CE2 . 17530 1 93 . 1 1 9 9 PHE CZ C 13 129.3 0.2 . 1 . . . A 9 PHE CZ . 17530 1 94 . 1 1 9 9 PHE N N 15 122.4 0.2 . 1 . . . A 9 PHE N . 17530 1 95 . 1 1 10 10 VAL H H 1 8.29 0.02 . 1 . . . A 10 VAL H . 17530 1 96 . 1 1 10 10 VAL HA H 1 4.80 0.02 . 1 . . . A 10 VAL HA . 17530 1 97 . 1 1 10 10 VAL HB H 1 1.89 0.02 . 1 . . . A 10 VAL HB . 17530 1 98 . 1 1 10 10 VAL HG11 H 1 0.79 0.02 . 2 . . . A 10 VAL HG11 . 17530 1 99 . 1 1 10 10 VAL HG12 H 1 0.79 0.02 . 2 . . . A 10 VAL HG12 . 17530 1 100 . 1 1 10 10 VAL HG13 H 1 0.79 0.02 . 2 . . . A 10 VAL HG13 . 17530 1 101 . 1 1 10 10 VAL HG21 H 1 0.87 0.02 . 2 . . . A 10 VAL HG21 . 17530 1 102 . 1 1 10 10 VAL HG22 H 1 0.87 0.02 . 2 . . . A 10 VAL HG22 . 17530 1 103 . 1 1 10 10 VAL HG23 H 1 0.87 0.02 . 2 . . . A 10 VAL HG23 . 17530 1 104 . 1 1 10 10 VAL C C 13 175.3 0.2 . 1 . . . A 10 VAL C . 17530 1 105 . 1 1 10 10 VAL CA C 13 61 0.2 . 1 . . . A 10 VAL CA . 17530 1 106 . 1 1 10 10 VAL CB C 13 35.7 0.2 . 1 . . . A 10 VAL CB . 17530 1 107 . 1 1 10 10 VAL CG1 C 13 21.9 0.2 . 2 . . . A 10 VAL CG1 . 17530 1 108 . 1 1 10 10 VAL CG2 C 13 22.1 0.2 . 2 . . . A 10 VAL CG2 . 17530 1 109 . 1 1 10 10 VAL N N 15 121.7 0.2 . 1 . . . A 10 VAL N . 17530 1 110 . 1 1 11 11 VAL H H 1 8.96 0.02 . 1 . . . A 11 VAL H . 17530 1 111 . 1 1 11 11 VAL HA H 1 4.22 0.02 . 1 . . . A 11 VAL HA . 17530 1 112 . 1 1 11 11 VAL HB H 1 2.21 0.02 . 1 . . . A 11 VAL HB . 17530 1 113 . 1 1 11 11 VAL HG11 H 1 0.91 0.02 . 2 . . . A 11 VAL HG11 . 17530 1 114 . 1 1 11 11 VAL HG12 H 1 0.91 0.02 . 2 . . . A 11 VAL HG12 . 17530 1 115 . 1 1 11 11 VAL HG13 H 1 0.91 0.02 . 2 . . . A 11 VAL HG13 . 17530 1 116 . 1 1 11 11 VAL HG21 H 1 1.21 0.02 . 2 . . . A 11 VAL HG21 . 17530 1 117 . 1 1 11 11 VAL HG22 H 1 1.21 0.02 . 2 . . . A 11 VAL HG22 . 17530 1 118 . 1 1 11 11 VAL HG23 H 1 1.21 0.02 . 2 . . . A 11 VAL HG23 . 17530 1 119 . 1 1 11 11 VAL C C 13 174.6 0.2 . 1 . . . A 11 VAL C . 17530 1 120 . 1 1 11 11 VAL CA C 13 61.6 0.2 . 1 . . . A 11 VAL CA . 17530 1 121 . 1 1 11 11 VAL CB C 13 34 0.2 . 1 . . . A 11 VAL CB . 17530 1 122 . 1 1 11 11 VAL CG1 C 13 21.2 0.2 . 2 . . . A 11 VAL CG1 . 17530 1 123 . 1 1 11 11 VAL CG2 C 13 23.2 0.2 . 2 . . . A 11 VAL CG2 . 17530 1 124 . 1 1 11 11 VAL N N 15 128.1 0.2 . 1 . . . A 11 VAL N . 17530 1 125 . 1 1 12 12 ARG H H 1 8.82 0.02 . 1 . . . A 12 ARG H . 17530 1 126 . 1 1 12 12 ARG HA H 1 5.38 0.02 . 1 . . . A 12 ARG HA . 17530 1 127 . 1 1 12 12 ARG HB2 H 1 1.63 0.02 . 2 . . . A 12 ARG HB2 . 17530 1 128 . 1 1 12 12 ARG HB3 H 1 1.73 0.02 . 2 . . . A 12 ARG HB3 . 17530 1 129 . 1 1 12 12 ARG HG2 H 1 1.55 0.02 . 2 . . . A 12 ARG HG2 . 17530 1 130 . 1 1 12 12 ARG HG3 H 1 1.62 0.02 . 2 . . . A 12 ARG HG3 . 17530 1 131 . 1 1 12 12 ARG HD2 H 1 3.13 0.02 . 2 . . . A 12 ARG HD2 . 17530 1 132 . 1 1 12 12 ARG HD3 H 1 3.13 0.02 . 2 . . . A 12 ARG HD3 . 17530 1 133 . 1 1 12 12 ARG HE H 1 7.26 0.02 . 1 . . . A 12 ARG HE . 17530 1 134 . 1 1 12 12 ARG C C 13 175.9 0.2 . 1 . . . A 12 ARG C . 17530 1 135 . 1 1 12 12 ARG CA C 13 54.8 0.2 . 1 . . . A 12 ARG CA . 17530 1 136 . 1 1 12 12 ARG CB C 13 32.7 0.2 . 1 . . . A 12 ARG CB . 17530 1 137 . 1 1 12 12 ARG CG C 13 28.8 0.2 . 1 . . . A 12 ARG CG . 17530 1 138 . 1 1 12 12 ARG CD C 13 43.4 0.2 . 1 . . . A 12 ARG CD . 17530 1 139 . 1 1 12 12 ARG N N 15 127 0.2 . 1 . . . A 12 ARG N . 17530 1 140 . 1 1 12 12 ARG NE N 15 85.3 0.2 . 1 . . . A 12 ARG NE . 17530 1 141 . 1 1 13 13 ARG H H 1 8.56 0.02 . 1 . . . A 13 ARG H . 17530 1 142 . 1 1 13 13 ARG HA H 1 4.75 0.02 . 1 . . . A 13 ARG HA . 17530 1 143 . 1 1 13 13 ARG HB2 H 1 1.41 0.02 . 2 . . . A 13 ARG HB2 . 17530 1 144 . 1 1 13 13 ARG HB3 H 1 1.79 0.02 . 2 . . . A 13 ARG HB3 . 17530 1 145 . 1 1 13 13 ARG HG2 H 1 1.51 0.02 . 2 . . . A 13 ARG HG2 . 17530 1 146 . 1 1 13 13 ARG HG3 H 1 1.61 0.02 . 2 . . . A 13 ARG HG3 . 17530 1 147 . 1 1 13 13 ARG HD2 H 1 3.15 0.02 . 2 . . . A 13 ARG HD2 . 17530 1 148 . 1 1 13 13 ARG HD3 H 1 3.53 0.02 . 2 . . . A 13 ARG HD3 . 17530 1 149 . 1 1 13 13 ARG HE H 1 7.73 0.02 . 1 . . . A 13 ARG HE . 17530 1 150 . 1 1 13 13 ARG C C 13 174 0.2 . 1 . . . A 13 ARG C . 17530 1 151 . 1 1 13 13 ARG CA C 13 54 0.2 . 1 . . . A 13 ARG CA . 17530 1 152 . 1 1 13 13 ARG CB C 13 35.6 0.2 . 1 . . . A 13 ARG CB . 17530 1 153 . 1 1 13 13 ARG CG C 13 27.3 0.2 . 1 . . . A 13 ARG CG . 17530 1 154 . 1 1 13 13 ARG CD C 13 42.8 0.2 . 1 . . . A 13 ARG CD . 17530 1 155 . 1 1 13 13 ARG N N 15 120.4 0.2 . 1 . . . A 13 ARG N . 17530 1 156 . 1 1 13 13 ARG NE N 15 82.0 0.2 . 1 . . . A 13 ARG NE . 17530 1 157 . 1 1 14 14 GLU H H 1 8.56 0.02 . 1 . . . A 14 GLU H . 17530 1 158 . 1 1 14 14 GLU HA H 1 5.53 0.02 . 1 . . . A 14 GLU HA . 17530 1 159 . 1 1 14 14 GLU HB2 H 1 1.87 0.02 . 2 . . . A 14 GLU HB2 . 17530 1 160 . 1 1 14 14 GLU HB3 H 1 1.87 0.02 . 2 . . . A 14 GLU HB3 . 17530 1 161 . 1 1 14 14 GLU HG2 H 1 2.14 0.02 . 2 . . . A 14 GLU HG2 . 17530 1 162 . 1 1 14 14 GLU HG3 H 1 2.21 0.02 . 2 . . . A 14 GLU HG3 . 17530 1 163 . 1 1 14 14 GLU C C 13 175.7 0.2 . 1 . . . A 14 GLU C . 17530 1 164 . 1 1 14 14 GLU CA C 13 54.3 0.2 . 1 . . . A 14 GLU CA . 17530 1 165 . 1 1 14 14 GLU CB C 13 33.8 0.2 . 1 . . . A 14 GLU CB . 17530 1 166 . 1 1 14 14 GLU CG C 13 36.9 0.2 . 1 . . . A 14 GLU CG . 17530 1 167 . 1 1 14 14 GLU N N 15 119.9 0.2 . 1 . . . A 14 GLU N . 17530 1 168 . 1 1 15 15 ALA H H 1 9.02 0.02 . 1 . . . A 15 ALA H . 17530 1 169 . 1 1 15 15 ALA HA H 1 4.7 0.02 . 1 . . . A 15 ALA HA . 17530 1 170 . 1 1 15 15 ALA HB1 H 1 1.25 0.02 . 1 . . . A 15 ALA HB1 . 17530 1 171 . 1 1 15 15 ALA HB2 H 1 1.25 0.02 . 1 . . . A 15 ALA HB2 . 17530 1 172 . 1 1 15 15 ALA HB3 H 1 1.25 0.02 . 1 . . . A 15 ALA HB3 . 17530 1 173 . 1 1 15 15 ALA C C 13 174.4 0.2 . 1 . . . A 15 ALA C . 17530 1 174 . 1 1 15 15 ALA CA C 13 51.4 0.2 . 1 . . . A 15 ALA CA . 17530 1 175 . 1 1 15 15 ALA CB C 13 22.4 0.2 . 1 . . . A 15 ALA CB . 17530 1 176 . 1 1 15 15 ALA N N 15 123.6 0.2 . 1 . . . A 15 ALA N . 17530 1 177 . 1 1 16 16 HIS H H 1 8.81 0.02 . 1 . . . A 16 HIS H . 17530 1 178 . 1 1 16 16 HIS HA H 1 5.17 0.02 . 1 . . . A 16 HIS HA . 17530 1 179 . 1 1 16 16 HIS HB2 H 1 3.04 0.02 . 2 . . . A 16 HIS HB2 . 17530 1 180 . 1 1 16 16 HIS HB3 H 1 3.1 0.02 . 2 . . . A 16 HIS HB3 . 17530 1 181 . 1 1 16 16 HIS HD2 H 1 7.09 0.02 . 1 . . . A 16 HIS HD2 . 17530 1 182 . 1 1 16 16 HIS HE1 H 1 8.16 0.02 . 1 . . . A 16 HIS HE1 . 17530 1 183 . 1 1 16 16 HIS C C 13 174.1 0.2 . 1 . . . A 16 HIS C . 17530 1 184 . 1 1 16 16 HIS CA C 13 55.7 0.2 . 1 . . . A 16 HIS CA . 17530 1 185 . 1 1 16 16 HIS CB C 13 30.3 0.2 . 1 . . . A 16 HIS CB . 17530 1 186 . 1 1 16 16 HIS CD2 C 13 120.3 0.2 . 1 . . . A 16 HIS CD2 . 17530 1 187 . 1 1 16 16 HIS CE1 C 13 137.5 0.2 . 1 . . . A 16 HIS CE1 . 17530 1 188 . 1 1 16 16 HIS N N 15 121.4 0.2 . 1 . . . A 16 HIS N . 17530 1 189 . 1 1 16 16 HIS ND1 N 15 197.9 0.2 . 1 . . . A 16 HIS ND1 . 17530 1 190 . 1 1 16 16 HIS NE2 N 15 177.7 0.2 . 1 . . . A 16 HIS NE2 . 17530 1 191 . 1 1 17 17 LEU H H 1 9.23 0.02 . 1 . . . A 17 LEU H . 17530 1 192 . 1 1 17 17 LEU HA H 1 5.07 0.02 . 1 . . . A 17 LEU HA . 17530 1 193 . 1 1 17 17 LEU HB2 H 1 1.22 0.02 . 2 . . . A 17 LEU HB2 . 17530 1 194 . 1 1 17 17 LEU HB3 H 1 1.63 0.02 . 2 . . . A 17 LEU HB3 . 17530 1 195 . 1 1 17 17 LEU HG H 1 0.69 0.02 . 1 . . . A 17 LEU HG . 17530 1 196 . 1 1 17 17 LEU HD11 H 1 0.70 0.02 . 2 . . . A 17 LEU HD11 . 17530 1 197 . 1 1 17 17 LEU HD12 H 1 0.70 0.02 . 2 . . . A 17 LEU HD12 . 17530 1 198 . 1 1 17 17 LEU HD13 H 1 0.70 0.02 . 2 . . . A 17 LEU HD13 . 17530 1 199 . 1 1 17 17 LEU HD21 H 1 0.71 0.02 . 2 . . . A 17 LEU HD21 . 17530 1 200 . 1 1 17 17 LEU HD22 H 1 0.71 0.02 . 2 . . . A 17 LEU HD22 . 17530 1 201 . 1 1 17 17 LEU HD23 H 1 0.71 0.02 . 2 . . . A 17 LEU HD23 . 17530 1 202 . 1 1 17 17 LEU C C 13 176.9 0.2 . 1 . . . A 17 LEU C . 17530 1 203 . 1 1 17 17 LEU CA C 13 53.5 0.2 . 1 . . . A 17 LEU CA . 17530 1 204 . 1 1 17 17 LEU CB C 13 44.2 0.2 . 1 . . . A 17 LEU CB . 17530 1 205 . 1 1 17 17 LEU CG C 13 27.2 0.2 . 1 . . . A 17 LEU CG . 17530 1 206 . 1 1 17 17 LEU CD1 C 13 28.0 0.2 . 2 . . . A 17 LEU CD1 . 17530 1 207 . 1 1 17 17 LEU CD2 C 13 27.1 0.2 . 2 . . . A 17 LEU CD2 . 17530 1 208 . 1 1 17 17 LEU N N 15 125.1 0.2 . 1 . . . A 17 LEU N . 17530 1 209 . 1 1 18 18 ALA H H 1 9.32 0.02 . 1 . . . A 18 ALA H . 17530 1 210 . 1 1 18 18 ALA HA H 1 4.44 0.02 . 1 . . . A 18 ALA HA . 17530 1 211 . 1 1 18 18 ALA HB1 H 1 1.38 0.02 . 1 . . . A 18 ALA HB1 . 17530 1 212 . 1 1 18 18 ALA HB2 H 1 1.38 0.02 . 1 . . . A 18 ALA HB2 . 17530 1 213 . 1 1 18 18 ALA HB3 H 1 1.38 0.02 . 1 . . . A 18 ALA HB3 . 17530 1 214 . 1 1 18 18 ALA C C 13 175.6 0.2 . 1 . . . A 18 ALA C . 17530 1 215 . 1 1 18 18 ALA CA C 13 52.1 0.2 . 1 . . . A 18 ALA CA . 17530 1 216 . 1 1 18 18 ALA CB C 13 18 0.2 . 1 . . . A 18 ALA CB . 17530 1 217 . 1 1 18 18 ALA N N 15 127.6 0.2 . 1 . . . A 18 ALA N . 17530 1 218 . 1 1 19 19 ALA H H 1 7.07 0.02 . 1 . . . A 19 ALA H . 17530 1 219 . 1 1 19 19 ALA HA H 1 4.83 0.02 . 1 . . . A 19 ALA HA . 17530 1 220 . 1 1 19 19 ALA HB1 H 1 1.31 0.02 . 1 . . . A 19 ALA HB1 . 17530 1 221 . 1 1 19 19 ALA HB2 H 1 1.31 0.02 . 1 . . . A 19 ALA HB2 . 17530 1 222 . 1 1 19 19 ALA HB3 H 1 1.31 0.02 . 1 . . . A 19 ALA HB3 . 17530 1 223 . 1 1 19 19 ALA CA C 13 49.8 0.2 . 1 . . . A 19 ALA CA . 17530 1 224 . 1 1 19 19 ALA CB C 13 20.3 0.2 . 1 . . . A 19 ALA CB . 17530 1 225 . 1 1 19 19 ALA N N 15 118.9 0.2 . 1 . . . A 19 ALA N . 17530 1 226 . 1 1 20 20 PRO HA H 1 4.50 0.02 . 1 . . . A 20 PRO HA . 17530 1 227 . 1 1 20 20 PRO HB2 H 1 2.44 0.02 . 2 . . . A 20 PRO HB2 . 17530 1 228 . 1 1 20 20 PRO HB3 H 1 2.14 0.02 . 2 . . . A 20 PRO HB3 . 17530 1 229 . 1 1 20 20 PRO HG2 H 1 1.99 0.02 . 2 . . . A 20 PRO HG2 . 17530 1 230 . 1 1 20 20 PRO HG3 H 1 1.99 0.02 . 2 . . . A 20 PRO HG3 . 17530 1 231 . 1 1 20 20 PRO HD2 H 1 3.77 0.02 . 2 . . . A 20 PRO HD2 . 17530 1 232 . 1 1 20 20 PRO HD3 H 1 3.49 0.02 . 2 . . . A 20 PRO HD3 . 17530 1 233 . 1 1 20 20 PRO CA C 13 61.7 0.2 . 1 . . . A 20 PRO CA . 17530 1 234 . 1 1 20 20 PRO CB C 13 31.0 0.2 . 1 . . . A 20 PRO CB . 17530 1 235 . 1 1 20 20 PRO CG C 13 27.5 0.2 . 1 . . . A 20 PRO CG . 17530 1 236 . 1 1 20 20 PRO CD C 13 50.1 0.2 . 1 . . . A 20 PRO CD . 17530 1 237 . 1 1 21 21 PRO HA H 1 4.06 0.02 . 1 . . . A 21 PRO HA . 17530 1 238 . 1 1 21 21 PRO HB2 H 1 2.22 0.02 . 2 . . . A 21 PRO HB2 . 17530 1 239 . 1 1 21 21 PRO HB3 H 1 2.22 0.02 . 2 . . . A 21 PRO HB3 . 17530 1 240 . 1 1 21 21 PRO HG2 H 1 1.82 0.02 . 2 . . . A 21 PRO HG2 . 17530 1 241 . 1 1 21 21 PRO HG3 H 1 2.06 0.02 . 2 . . . A 21 PRO HG3 . 17530 1 242 . 1 1 21 21 PRO HD2 H 1 3.88 0.02 . 2 . . . A 21 PRO HD2 . 17530 1 243 . 1 1 21 21 PRO HD3 H 1 3.67 0.02 . 2 . . . A 21 PRO HD3 . 17530 1 244 . 1 1 21 21 PRO C C 13 177.4 0.2 . 1 . . . A 21 PRO C . 17530 1 245 . 1 1 21 21 PRO CA C 13 67.2 0.2 . 1 . . . A 21 PRO CA . 17530 1 246 . 1 1 21 21 PRO CB C 13 32.1 0.2 . 1 . . . A 21 PRO CB . 17530 1 247 . 1 1 21 21 PRO CG C 13 27.5 0.2 . 1 . . . A 21 PRO CG . 17530 1 248 . 1 1 21 21 PRO CD C 13 50.3 0.2 . 1 . . . A 21 PRO CD . 17530 1 249 . 1 1 22 22 ALA H H 1 8.97 0.02 . 1 . . . A 22 ALA H . 17530 1 250 . 1 1 22 22 ALA HA H 1 3.9 0.02 . 1 . . . A 22 ALA HA . 17530 1 251 . 1 1 22 22 ALA HB1 H 1 1.45 0.02 . 1 . . . A 22 ALA HB1 . 17530 1 252 . 1 1 22 22 ALA HB2 H 1 1.45 0.02 . 1 . . . A 22 ALA HB2 . 17530 1 253 . 1 1 22 22 ALA HB3 H 1 1.45 0.02 . 1 . . . A 22 ALA HB3 . 17530 1 254 . 1 1 22 22 ALA C C 13 180.4 0.2 . 1 . . . A 22 ALA C . 17530 1 255 . 1 1 22 22 ALA CA C 13 55.7 0.2 . 1 . . . A 22 ALA CA . 17530 1 256 . 1 1 22 22 ALA CB C 13 18.5 0.2 . 1 . . . A 22 ALA CB . 17530 1 257 . 1 1 22 22 ALA N N 15 116.4 0.2 . 1 . . . A 22 ALA N . 17530 1 258 . 1 1 23 23 ALA H H 1 7.29 0.02 . 1 . . . A 23 ALA H . 17530 1 259 . 1 1 23 23 ALA HA H 1 4.28 0.02 . 1 . . . A 23 ALA HA . 17530 1 260 . 1 1 23 23 ALA HB1 H 1 1.57 0.02 . 1 . . . A 23 ALA HB1 . 17530 1 261 . 1 1 23 23 ALA HB2 H 1 1.57 0.02 . 1 . . . A 23 ALA HB2 . 17530 1 262 . 1 1 23 23 ALA HB3 H 1 1.57 0.02 . 1 . . . A 23 ALA HB3 . 17530 1 263 . 1 1 23 23 ALA C C 13 180.6 0.2 . 1 . . . A 23 ALA C . 17530 1 264 . 1 1 23 23 ALA CA C 13 54.3 0.2 . 1 . . . A 23 ALA CA . 17530 1 265 . 1 1 23 23 ALA CB C 13 18.8 0.2 . 1 . . . A 23 ALA CB . 17530 1 266 . 1 1 23 23 ALA N N 15 119.5 0.2 . 1 . . . A 23 ALA N . 17530 1 267 . 1 1 24 24 VAL H H 1 7.66 0.02 . 1 . . . A 24 VAL H . 17530 1 268 . 1 1 24 24 VAL HA H 1 3.38 0.02 . 1 . . . A 24 VAL HA . 17530 1 269 . 1 1 24 24 VAL HB H 1 2.05 0.02 . 1 . . . A 24 VAL HB . 17530 1 270 . 1 1 24 24 VAL HG11 H 1 0.77 0.02 . 2 . . . A 24 VAL HG11 . 17530 1 271 . 1 1 24 24 VAL HG12 H 1 0.77 0.02 . 2 . . . A 24 VAL HG12 . 17530 1 272 . 1 1 24 24 VAL HG13 H 1 0.77 0.02 . 2 . . . A 24 VAL HG13 . 17530 1 273 . 1 1 24 24 VAL HG21 H 1 0.77 0.02 . 2 . . . A 24 VAL HG21 . 17530 1 274 . 1 1 24 24 VAL HG22 H 1 0.77 0.02 . 2 . . . A 24 VAL HG22 . 17530 1 275 . 1 1 24 24 VAL HG23 H 1 0.77 0.02 . 2 . . . A 24 VAL HG23 . 17530 1 276 . 1 1 24 24 VAL C C 13 176.5 0.2 . 1 . . . A 24 VAL C . 17530 1 277 . 1 1 24 24 VAL CA C 13 66.7 0.2 . 1 . . . A 24 VAL CA . 17530 1 278 . 1 1 24 24 VAL CB C 13 31.5 0.2 . 1 . . . A 24 VAL CB . 17530 1 279 . 1 1 24 24 VAL CG1 C 13 23.4 0.2 . 2 . . . A 24 VAL CG1 . 17530 1 280 . 1 1 24 24 VAL CG2 C 13 24 0.2 . 2 . . . A 24 VAL CG2 . 17530 1 281 . 1 1 24 24 VAL N N 15 119.9 0.2 . 1 . . . A 24 VAL N . 17530 1 282 . 1 1 25 25 PHE H H 1 9.46 0.02 . 1 . . . A 25 PHE H . 17530 1 283 . 1 1 25 25 PHE HA H 1 3.62 0.02 . 1 . . . A 25 PHE HA . 17530 1 284 . 1 1 25 25 PHE HB2 H 1 3.02 0.02 . 2 . . . A 25 PHE HB2 . 17530 1 285 . 1 1 25 25 PHE HB3 H 1 3.21 0.02 . 2 . . . A 25 PHE HB3 . 17530 1 286 . 1 1 25 25 PHE HD1 H 1 7.40 0.02 . 3 . . . A 25 PHE HD1 . 17530 1 287 . 1 1 25 25 PHE HD2 H 1 7.40 0.02 . 3 . . . A 25 PHE HD2 . 17530 1 288 . 1 1 25 25 PHE HE1 H 1 6.87 0.02 . 3 . . . A 25 PHE HE1 . 17530 1 289 . 1 1 25 25 PHE HE2 H 1 6.87 0.02 . 3 . . . A 25 PHE HE2 . 17530 1 290 . 1 1 25 25 PHE HZ H 1 6.95 0.02 . 1 . . . A 25 PHE HZ . 17530 1 291 . 1 1 25 25 PHE C C 13 179.8 0.2 . 1 . . . A 25 PHE C . 17530 1 292 . 1 1 25 25 PHE CA C 13 62.9 0.2 . 1 . . . A 25 PHE CA . 17530 1 293 . 1 1 25 25 PHE CB C 13 39.6 0.2 . 1 . . . A 25 PHE CB . 17530 1 294 . 1 1 25 25 PHE CD1 C 13 133.7 0.2 . 3 . . . A 25 PHE CD1 . 17530 1 295 . 1 1 25 25 PHE CD2 C 13 133.7 0.2 . 3 . . . A 25 PHE CD2 . 17530 1 296 . 1 1 25 25 PHE CE1 C 13 130.7 0.2 . 3 . . . A 25 PHE CE1 . 17530 1 297 . 1 1 25 25 PHE CE2 C 13 130.7 0.2 . 3 . . . A 25 PHE CE2 . 17530 1 298 . 1 1 25 25 PHE CZ C 13 128.8 0.2 . 1 . . . A 25 PHE CZ . 17530 1 299 . 1 1 25 25 PHE N N 15 120.6 0.2 . 1 . . . A 25 PHE N . 17530 1 300 . 1 1 26 26 ALA H H 1 7.49 0.02 . 1 . . . A 26 ALA H . 17530 1 301 . 1 1 26 26 ALA HA H 1 4.13 0.02 . 1 . . . A 26 ALA HA . 17530 1 302 . 1 1 26 26 ALA HB1 H 1 1.63 0.02 . 1 . . . A 26 ALA HB1 . 17530 1 303 . 1 1 26 26 ALA HB2 H 1 1.63 0.02 . 1 . . . A 26 ALA HB2 . 17530 1 304 . 1 1 26 26 ALA HB3 H 1 1.63 0.02 . 1 . . . A 26 ALA HB3 . 17530 1 305 . 1 1 26 26 ALA C C 13 179.1 0.2 . 1 . . . A 26 ALA C . 17530 1 306 . 1 1 26 26 ALA CA C 13 55.6 0.2 . 1 . . . A 26 ALA CA . 17530 1 307 . 1 1 26 26 ALA CB C 13 18.3 0.2 . 1 . . . A 26 ALA CB . 17530 1 308 . 1 1 26 26 ALA N N 15 121.8 0.2 . 1 . . . A 26 ALA N . 17530 1 309 . 1 1 27 27 LEU H H 1 7.61 0.02 . 1 . . . A 27 LEU H . 17530 1 310 . 1 1 27 27 LEU HA H 1 4.11 0.02 . 1 . . . A 27 LEU HA . 17530 1 311 . 1 1 27 27 LEU HB2 H 1 1.27 0.02 . 2 . . . A 27 LEU HB2 . 17530 1 312 . 1 1 27 27 LEU HB3 H 1 2.13 0.02 . 2 . . . A 27 LEU HB3 . 17530 1 313 . 1 1 27 27 LEU HG H 1 1.89 0.02 . 1 . . . A 27 LEU HG . 17530 1 314 . 1 1 27 27 LEU HD11 H 1 0.69 0.02 . 2 . . . A 27 LEU HD11 . 17530 1 315 . 1 1 27 27 LEU HD12 H 1 0.69 0.02 . 2 . . . A 27 LEU HD12 . 17530 1 316 . 1 1 27 27 LEU HD13 H 1 0.69 0.02 . 2 . . . A 27 LEU HD13 . 17530 1 317 . 1 1 27 27 LEU HD21 H 1 1.00 0.02 . 2 . . . A 27 LEU HD21 . 17530 1 318 . 1 1 27 27 LEU HD22 H 1 1.00 0.02 . 2 . . . A 27 LEU HD22 . 17530 1 319 . 1 1 27 27 LEU HD23 H 1 1.00 0.02 . 2 . . . A 27 LEU HD23 . 17530 1 320 . 1 1 27 27 LEU C C 13 176.5 0.2 . 1 . . . A 27 LEU C . 17530 1 321 . 1 1 27 27 LEU CA C 13 57.9 0.2 . 1 . . . A 27 LEU CA . 17530 1 322 . 1 1 27 27 LEU CB C 13 42.4 0.2 . 1 . . . A 27 LEU CB . 17530 1 323 . 1 1 27 27 LEU CG C 13 27.7 0.2 . 1 . . . A 27 LEU CG . 17530 1 324 . 1 1 27 27 LEU CD1 C 13 24.9 0.2 . 2 . . . A 27 LEU CD1 . 17530 1 325 . 1 1 27 27 LEU CD2 C 13 24.6 0.2 . 2 . . . A 27 LEU CD2 . 17530 1 326 . 1 1 27 27 LEU N N 15 116.7 0.2 . 1 . . . A 27 LEU N . 17530 1 327 . 1 1 28 28 MET H H 1 7.16 0.02 . 1 . . . A 28 MET H . 17530 1 328 . 1 1 28 28 MET HA H 1 4.94 0.02 . 1 . . . A 28 MET HA . 17530 1 329 . 1 1 28 28 MET HB2 H 1 1.82 0.02 . 2 . . . A 28 MET HB2 . 17530 1 330 . 1 1 28 28 MET HB3 H 1 2.27 0.02 . 2 . . . A 28 MET HB3 . 17530 1 331 . 1 1 28 28 MET HG2 H 1 2.29 0.02 . 2 . . . A 28 MET HG2 . 17530 1 332 . 1 1 28 28 MET HG3 H 1 2.83 0.02 . 2 . . . A 28 MET HG3 . 17530 1 333 . 1 1 28 28 MET HE1 H 1 1.96 0.02 . 1 . . . A 28 MET HE1 . 17530 1 334 . 1 1 28 28 MET HE2 H 1 1.96 0.02 . 1 . . . A 28 MET HE2 . 17530 1 335 . 1 1 28 28 MET HE3 H 1 1.96 0.02 . 1 . . . A 28 MET HE3 . 17530 1 336 . 1 1 28 28 MET C C 13 176 0.2 . 1 . . . A 28 MET C . 17530 1 337 . 1 1 28 28 MET CA C 13 56.2 0.2 . 1 . . . A 28 MET CA . 17530 1 338 . 1 1 28 28 MET CB C 13 35.6 0.2 . 1 . . . A 28 MET CB . 17530 1 339 . 1 1 28 28 MET CG C 13 32.9 0.2 . 1 . . . A 28 MET CG . 17530 1 340 . 1 1 28 28 MET CE C 13 17.8 0.2 . 1 . . . A 28 MET CE . 17530 1 341 . 1 1 28 28 MET N N 15 110.5 0.2 . 1 . . . A 28 MET N . 17530 1 342 . 1 1 29 29 THR H H 1 7.20 0.02 . 1 . . . A 29 THR H . 17530 1 343 . 1 1 29 29 THR HA H 1 4.41 0.02 . 1 . . . A 29 THR HA . 17530 1 344 . 1 1 29 29 THR HB H 1 3.91 0.02 . 1 . . . A 29 THR HB . 17530 1 345 . 1 1 29 29 THR HG21 H 1 0.49 0.02 . 1 . . . A 29 THR HG21 . 17530 1 346 . 1 1 29 29 THR HG22 H 1 0.49 0.02 . 1 . . . A 29 THR HG22 . 17530 1 347 . 1 1 29 29 THR HG23 H 1 0.49 0.02 . 1 . . . A 29 THR HG23 . 17530 1 348 . 1 1 29 29 THR C C 13 172.1 0.2 . 1 . . . A 29 THR C . 17530 1 349 . 1 1 29 29 THR CA C 13 61.7 0.2 . 1 . . . A 29 THR CA . 17530 1 350 . 1 1 29 29 THR CB C 13 71.8 0.2 . 1 . . . A 29 THR CB . 17530 1 351 . 1 1 29 29 THR CG2 C 13 22.5 0.2 . 1 . . . A 29 THR CG2 . 17530 1 352 . 1 1 29 29 THR N N 15 103.8 0.2 . 1 . . . A 29 THR N . 17530 1 353 . 1 1 30 30 ASP H H 1 7.79 0.02 . 1 . . . A 30 ASP H . 17530 1 354 . 1 1 30 30 ASP HA H 1 5.19 0.02 . 1 . . . A 30 ASP HA . 17530 1 355 . 1 1 30 30 ASP HB2 H 1 2.71 0.02 . 2 . . . A 30 ASP HB2 . 17530 1 356 . 1 1 30 30 ASP HB3 H 1 3.02 0.02 . 2 . . . A 30 ASP HB3 . 17530 1 357 . 1 1 30 30 ASP CA C 13 50.9 0.2 . 1 . . . A 30 ASP CA . 17530 1 358 . 1 1 30 30 ASP CB C 13 42 0.2 . 1 . . . A 30 ASP CB . 17530 1 359 . 1 1 30 30 ASP N N 15 122 0.2 . 1 . . . A 30 ASP N . 17530 1 360 . 1 1 31 31 PRO HA H 1 3.95 0.02 . 1 . . . A 31 PRO HA . 17530 1 361 . 1 1 31 31 PRO HB2 H 1 2.16 0.02 . 2 . . . A 31 PRO HB2 . 17530 1 362 . 1 1 31 31 PRO HB3 H 1 2.16 0.02 . 2 . . . A 31 PRO HB3 . 17530 1 363 . 1 1 31 31 PRO HG2 H 1 2.35 0.02 . 2 . . . A 31 PRO HG2 . 17530 1 364 . 1 1 31 31 PRO HG3 H 1 2.35 0.02 . 2 . . . A 31 PRO HG3 . 17530 1 365 . 1 1 31 31 PRO HD2 H 1 4.14 0.02 . 2 . . . A 31 PRO HD2 . 17530 1 366 . 1 1 31 31 PRO HD3 H 1 4.04 0.02 . 2 . . . A 31 PRO HD3 . 17530 1 367 . 1 1 31 31 PRO C C 13 176.5 0.2 . 1 . . . A 31 PRO C . 17530 1 368 . 1 1 31 31 PRO CA C 13 65.9 0.2 . 1 . . . A 31 PRO CA . 17530 1 369 . 1 1 31 31 PRO CB C 13 32.6 0.2 . 1 . . . A 31 PRO CB . 17530 1 370 . 1 1 31 31 PRO CG C 13 27.8 0.2 . 1 . . . A 31 PRO CG . 17530 1 371 . 1 1 31 31 PRO CD C 13 51.2 0.2 . 1 . . . A 31 PRO CD . 17530 1 372 . 1 1 32 32 GLU H H 1 8.16 0.02 . 1 . . . A 32 GLU H . 17530 1 373 . 1 1 32 32 GLU HA H 1 4.05 0.02 . 1 . . . A 32 GLU HA . 17530 1 374 . 1 1 32 32 GLU HB2 H 1 2.05 0.02 . 2 . . . A 32 GLU HB2 . 17530 1 375 . 1 1 32 32 GLU HB3 H 1 2.05 0.02 . 2 . . . A 32 GLU HB3 . 17530 1 376 . 1 1 32 32 GLU HG2 H 1 2.23 0.02 . 2 . . . A 32 GLU HG2 . 17530 1 377 . 1 1 32 32 GLU HG3 H 1 2.39 0.02 . 2 . . . A 32 GLU HG3 . 17530 1 378 . 1 1 32 32 GLU C C 13 178.6 0.2 . 1 . . . A 32 GLU C . 17530 1 379 . 1 1 32 32 GLU CA C 13 59 0.2 . 1 . . . A 32 GLU CA . 17530 1 380 . 1 1 32 32 GLU CB C 13 29.7 0.2 . 1 . . . A 32 GLU CB . 17530 1 381 . 1 1 32 32 GLU CG C 13 36.8 0.2 . 1 . . . A 32 GLU CG . 17530 1 382 . 1 1 32 32 GLU N N 15 114.4 0.2 . 1 . . . A 32 GLU N . 17530 1 383 . 1 1 33 33 LYS H H 1 7.62 0.02 . 1 . . . A 33 LYS H . 17530 1 384 . 1 1 33 33 LYS HA H 1 4.13 0.02 . 1 . . . A 33 LYS HA . 17530 1 385 . 1 1 33 33 LYS HB2 H 1 2.07 0.02 . 2 . . . A 33 LYS HB2 . 17530 1 386 . 1 1 33 33 LYS HB3 H 1 2.28 0.02 . 2 . . . A 33 LYS HB3 . 17530 1 387 . 1 1 33 33 LYS HG2 H 1 1.27 0.02 . 2 . . . A 33 LYS HG2 . 17530 1 388 . 1 1 33 33 LYS HG3 H 1 1.55 0.02 . 2 . . . A 33 LYS HG3 . 17530 1 389 . 1 1 33 33 LYS HD2 H 1 1.62 0.02 . 2 . . . A 33 LYS HD2 . 17530 1 390 . 1 1 33 33 LYS HD3 H 1 1.62 0.02 . 2 . . . A 33 LYS HD3 . 17530 1 391 . 1 1 33 33 LYS HE2 H 1 2.97 0.02 . 2 . . . A 33 LYS HE2 . 17530 1 392 . 1 1 33 33 LYS HE3 H 1 3.06 0.02 . 2 . . . A 33 LYS HE3 . 17530 1 393 . 1 1 33 33 LYS C C 13 178.6 0.2 . 1 . . . A 33 LYS C . 17530 1 394 . 1 1 33 33 LYS CA C 13 59 0.2 . 1 . . . A 33 LYS CA . 17530 1 395 . 1 1 33 33 LYS CB C 13 34.1 0.2 . 1 . . . A 33 LYS CB . 17530 1 396 . 1 1 33 33 LYS CG C 13 26.6 0.2 . 1 . . . A 33 LYS CG . 17530 1 397 . 1 1 33 33 LYS CD C 13 29.3 0.2 . 1 . . . A 33 LYS CD . 17530 1 398 . 1 1 33 33 LYS CE C 13 42.5 0.2 . 1 . . . A 33 LYS CE . 17530 1 399 . 1 1 33 33 LYS N N 15 118.2 0.2 . 1 . . . A 33 LYS N . 17530 1 400 . 1 1 34 34 ILE H H 1 8.51 0.02 . 1 . . . A 34 ILE H . 17530 1 401 . 1 1 34 34 ILE HA H 1 3.93 0.02 . 1 . . . A 34 ILE HA . 17530 1 402 . 1 1 34 34 ILE HB H 1 1.41 0.02 . 1 . . . A 34 ILE HB . 17530 1 403 . 1 1 34 34 ILE HG12 H 1 0.93 0.02 . 2 . . . A 34 ILE HG12 . 17530 1 404 . 1 1 34 34 ILE HG13 H 1 1.61 0.02 . 2 . . . A 34 ILE HG13 . 17530 1 405 . 1 1 34 34 ILE HG21 H 1 0.41 0.02 . 1 . . . A 34 ILE HG21 . 17530 1 406 . 1 1 34 34 ILE HG22 H 1 0.41 0.02 . 1 . . . A 34 ILE HG22 . 17530 1 407 . 1 1 34 34 ILE HG23 H 1 0.41 0.02 . 1 . . . A 34 ILE HG23 . 17530 1 408 . 1 1 34 34 ILE HD11 H 1 0.48 0.02 . 1 . . . A 34 ILE HD11 . 17530 1 409 . 1 1 34 34 ILE HD12 H 1 0.48 0.02 . 1 . . . A 34 ILE HD12 . 17530 1 410 . 1 1 34 34 ILE HD13 H 1 0.48 0.02 . 1 . . . A 34 ILE HD13 . 17530 1 411 . 1 1 34 34 ILE C C 13 176.9 0.2 . 1 . . . A 34 ILE C . 17530 1 412 . 1 1 34 34 ILE CA C 13 64.9 0.2 . 1 . . . A 34 ILE CA . 17530 1 413 . 1 1 34 34 ILE CB C 13 39.4 0.2 . 1 . . . A 34 ILE CB . 17530 1 414 . 1 1 34 34 ILE CG1 C 13 29.7 0.2 . 1 . . . A 34 ILE CG1 . 17530 1 415 . 1 1 34 34 ILE CG2 C 13 16.5 0.2 . 1 . . . A 34 ILE CG2 . 17530 1 416 . 1 1 34 34 ILE CD1 C 13 14.5 0.2 . 1 . . . A 34 ILE CD1 . 17530 1 417 . 1 1 34 34 ILE N N 15 122.4 0.2 . 1 . . . A 34 ILE N . 17530 1 418 . 1 1 35 35 LEU H H 1 6.80 0.02 . 1 . . . A 35 LEU H . 17530 1 419 . 1 1 35 35 LEU HA H 1 4.3 0.02 . 1 . . . A 35 LEU HA . 17530 1 420 . 1 1 35 35 LEU HB2 H 1 1.44 0.02 . 2 . . . A 35 LEU HB2 . 17530 1 421 . 1 1 35 35 LEU HB3 H 1 1.5 0.02 . 2 . . . A 35 LEU HB3 . 17530 1 422 . 1 1 35 35 LEU HG H 1 1.83 0.02 . 1 . . . A 35 LEU HG . 17530 1 423 . 1 1 35 35 LEU HD11 H 1 0.78 0.02 . 2 . . . A 35 LEU HD11 . 17530 1 424 . 1 1 35 35 LEU HD12 H 1 0.78 0.02 . 2 . . . A 35 LEU HD12 . 17530 1 425 . 1 1 35 35 LEU HD13 H 1 0.78 0.02 . 2 . . . A 35 LEU HD13 . 17530 1 426 . 1 1 35 35 LEU HD21 H 1 0.48 0.02 . 2 . . . A 35 LEU HD21 . 17530 1 427 . 1 1 35 35 LEU HD22 H 1 0.48 0.02 . 2 . . . A 35 LEU HD22 . 17530 1 428 . 1 1 35 35 LEU HD23 H 1 0.48 0.02 . 2 . . . A 35 LEU HD23 . 17530 1 429 . 1 1 35 35 LEU C C 13 179.2 0.2 . 1 . . . A 35 LEU C . 17530 1 430 . 1 1 35 35 LEU CA C 13 55.5 0.2 . 1 . . . A 35 LEU CA . 17530 1 431 . 1 1 35 35 LEU CB C 13 41.5 0.2 . 1 . . . A 35 LEU CB . 17530 1 432 . 1 1 35 35 LEU CG C 13 26.5 0.2 . 1 . . . A 35 LEU CG . 17530 1 433 . 1 1 35 35 LEU CD1 C 13 25.5 0.2 . 2 . . . A 35 LEU CD1 . 17530 1 434 . 1 1 35 35 LEU CD2 C 13 22.5 0.2 . 2 . . . A 35 LEU CD2 . 17530 1 435 . 1 1 35 35 LEU N N 15 112.2 0.2 . 1 . . . A 35 LEU N . 17530 1 436 . 1 1 36 36 ARG H H 1 7.8 0.02 . 1 . . . A 36 ARG H . 17530 1 437 . 1 1 36 36 ARG HA H 1 4.18 0.02 . 1 . . . A 36 ARG HA . 17530 1 438 . 1 1 36 36 ARG HB2 H 1 2.12 0.02 . 2 . . . A 36 ARG HB2 . 17530 1 439 . 1 1 36 36 ARG HB3 H 1 2.23 0.02 . 2 . . . A 36 ARG HB3 . 17530 1 440 . 1 1 36 36 ARG HG2 H 1 1.85 0.02 . 2 . . . A 36 ARG HG2 . 17530 1 441 . 1 1 36 36 ARG HG3 H 1 2.12 0.02 . 2 . . . A 36 ARG HG3 . 17530 1 442 . 1 1 36 36 ARG HD2 H 1 3.26 0.02 . 2 . . . A 36 ARG HD2 . 17530 1 443 . 1 1 36 36 ARG HD3 H 1 3.26 0.02 . 2 . . . A 36 ARG HD3 . 17530 1 444 . 1 1 36 36 ARG HE H 1 7.37 0.02 . 1 . . . A 36 ARG HE . 17530 1 445 . 1 1 36 36 ARG C C 13 176.5 0.2 . 1 . . . A 36 ARG C . 17530 1 446 . 1 1 36 36 ARG CA C 13 58.2 0.2 . 1 . . . A 36 ARG CA . 17530 1 447 . 1 1 36 36 ARG CB C 13 30.6 0.2 . 1 . . . A 36 ARG CB . 17530 1 448 . 1 1 36 36 ARG CG C 13 27.6 0.2 . 1 . . . A 36 ARG CG . 17530 1 449 . 1 1 36 36 ARG CD C 13 43.5 0.2 . 1 . . . A 36 ARG CD . 17530 1 450 . 1 1 36 36 ARG N N 15 117.3 0.2 . 1 . . . A 36 ARG N . 17530 1 451 . 1 1 36 36 ARG NE N 15 83.6 0.2 . 1 . . . A 36 ARG NE . 17530 1 452 . 1 1 37 37 TRP H H 1 8.13 0.02 . 1 . . . A 37 TRP H . 17530 1 453 . 1 1 37 37 TRP HA H 1 4.99 0.02 . 1 . . . A 37 TRP HA . 17530 1 454 . 1 1 37 37 TRP HB2 H 1 2.89 0.02 . 2 . . . A 37 TRP HB2 . 17530 1 455 . 1 1 37 37 TRP HB3 H 1 3.51 0.02 . 2 . . . A 37 TRP HB3 . 17530 1 456 . 1 1 37 37 TRP HD1 H 1 7.23 0.02 . 1 . . . A 37 TRP HD1 . 17530 1 457 . 1 1 37 37 TRP HE1 H 1 10.31 0.02 . 1 . . . A 37 TRP HE1 . 17530 1 458 . 1 1 37 37 TRP HE3 H 1 7.41 0.02 . 1 . . . A 37 TRP HE3 . 17530 1 459 . 1 1 37 37 TRP HZ2 H 1 7.49 0.02 . 1 . . . A 37 TRP HZ2 . 17530 1 460 . 1 1 37 37 TRP HZ3 H 1 6.96 0.02 . 1 . . . A 37 TRP HZ3 . 17530 1 461 . 1 1 37 37 TRP HH2 H 1 7.11 0.02 . 1 . . . A 37 TRP HH2 . 17530 1 462 . 1 1 37 37 TRP C C 13 174.7 0.2 . 1 . . . A 37 TRP C . 17530 1 463 . 1 1 37 37 TRP CA C 13 56.9 0.2 . 1 . . . A 37 TRP CA . 17530 1 464 . 1 1 37 37 TRP CB C 13 30.3 0.2 . 1 . . . A 37 TRP CB . 17530 1 465 . 1 1 37 37 TRP CD1 C 13 127.7 0.2 . 1 . . . A 37 TRP CD1 . 17530 1 466 . 1 1 37 37 TRP CE3 C 13 120.3 0.2 . 1 . . . A 37 TRP CE3 . 17530 1 467 . 1 1 37 37 TRP CZ2 C 13 114.2 0.2 . 1 . . . A 37 TRP CZ2 . 17530 1 468 . 1 1 37 37 TRP CZ3 C 13 122.9 0.2 . 1 . . . A 37 TRP CZ3 . 17530 1 469 . 1 1 37 37 TRP CH2 C 13 123.9 0.2 . 1 . . . A 37 TRP CH2 . 17530 1 470 . 1 1 37 37 TRP N N 15 112.6 0.2 . 1 . . . A 37 TRP N . 17530 1 471 . 1 1 37 37 TRP NE1 N 15 132.2 0.2 . 1 . . . A 37 TRP NE1 . 17530 1 472 . 1 1 38 38 MET H H 1 8.35 0.02 . 1 . . . A 38 MET H . 17530 1 473 . 1 1 38 38 MET HA H 1 4.36 0.02 . 1 . . . A 38 MET HA . 17530 1 474 . 1 1 38 38 MET HB2 H 1 0.96 0.02 . 2 . . . A 38 MET HB2 . 17530 1 475 . 1 1 38 38 MET HB3 H 1 0.96 0.02 . 2 . . . A 38 MET HB3 . 17530 1 476 . 1 1 38 38 MET HG2 H 1 0.77 0.02 . 2 . . . A 38 MET HG2 . 17530 1 477 . 1 1 38 38 MET HG3 H 1 1.06 0.02 . 2 . . . A 38 MET HG3 . 17530 1 478 . 1 1 38 38 MET HE1 H 1 2.13 0.02 . 1 . . . A 38 MET HE1 . 17530 1 479 . 1 1 38 38 MET HE2 H 1 2.13 0.02 . 1 . . . A 38 MET HE2 . 17530 1 480 . 1 1 38 38 MET HE3 H 1 2.13 0.02 . 1 . . . A 38 MET HE3 . 17530 1 481 . 1 1 38 38 MET C C 13 172.4 0.2 . 1 . . . A 38 MET C . 17530 1 482 . 1 1 38 38 MET CA C 13 56.3 0.2 . 1 . . . A 38 MET CA . 17530 1 483 . 1 1 38 38 MET CB C 13 35.9 0.2 . 1 . . . A 38 MET CB . 17530 1 484 . 1 1 38 38 MET CG C 13 29.9 0.2 . 1 . . . A 38 MET CG . 17530 1 485 . 1 1 38 38 MET CE C 13 17.6 0.2 . 1 . . . A 38 MET CE . 17530 1 486 . 1 1 38 38 MET N N 15 123.9 0.2 . 1 . . . A 38 MET N . 17530 1 487 . 1 1 39 39 GLY H H 1 6.79 0.02 . 1 . . . A 39 GLY H . 17530 1 488 . 1 1 39 39 GLY HA2 H 1 3.72 0.02 . 2 . . . A 39 GLY HA2 . 17530 1 489 . 1 1 39 39 GLY HA3 H 1 4.59 0.02 . 2 . . . A 39 GLY HA3 . 17530 1 490 . 1 1 39 39 GLY C C 13 175.2 0.2 . 1 . . . A 39 GLY C . 17530 1 491 . 1 1 39 39 GLY CA C 13 44.3 0.2 . 1 . . . A 39 GLY CA . 17530 1 492 . 1 1 39 39 GLY N N 15 104.8 0.2 . 1 . . . A 39 GLY N . 17530 1 493 . 1 1 40 40 THR H H 1 8.38 0.02 . 1 . . . A 40 THR H . 17530 1 494 . 1 1 40 40 THR HA H 1 4.42 0.02 . 1 . . . A 40 THR HA . 17530 1 495 . 1 1 40 40 THR HB H 1 4.31 0.02 . 1 . . . A 40 THR HB . 17530 1 496 . 1 1 40 40 THR HG21 H 1 1.03 0.02 . 1 . . . A 40 THR HG21 . 17530 1 497 . 1 1 40 40 THR HG22 H 1 1.03 0.02 . 1 . . . A 40 THR HG22 . 17530 1 498 . 1 1 40 40 THR HG23 H 1 1.03 0.02 . 1 . . . A 40 THR HG23 . 17530 1 499 . 1 1 40 40 THR C C 13 175.2 0.2 . 1 . . . A 40 THR C . 17530 1 500 . 1 1 40 40 THR CA C 13 61.7 0.2 . 1 . . . A 40 THR CA . 17530 1 501 . 1 1 40 40 THR CB C 13 68.8 0.2 . 1 . . . A 40 THR CB . 17530 1 502 . 1 1 40 40 THR CG2 C 13 22.3 0.2 . 1 . . . A 40 THR CG2 . 17530 1 503 . 1 1 40 40 THR N N 15 104.5 0.2 . 1 . . . A 40 THR N . 17530 1 504 . 1 1 41 41 GLU H H 1 7.03 0.02 . 1 . . . A 41 GLU H . 17530 1 505 . 1 1 41 41 GLU HA H 1 4.5 0.02 . 1 . . . A 41 GLU HA . 17530 1 506 . 1 1 41 41 GLU HB2 H 1 2.01 0.02 . 2 . . . A 41 GLU HB2 . 17530 1 507 . 1 1 41 41 GLU HB3 H 1 2.1 0.02 . 2 . . . A 41 GLU HB3 . 17530 1 508 . 1 1 41 41 GLU HG2 H 1 2.27 0.02 . 2 . . . A 41 GLU HG2 . 17530 1 509 . 1 1 41 41 GLU HG3 H 1 2.27 0.02 . 2 . . . A 41 GLU HG3 . 17530 1 510 . 1 1 41 41 GLU C C 13 174 0.2 . 1 . . . A 41 GLU C . 17530 1 511 . 1 1 41 41 GLU CA C 13 56.1 0.2 . 1 . . . A 41 GLU CA . 17530 1 512 . 1 1 41 41 GLU CB C 13 33.5 0.2 . 1 . . . A 41 GLU CB . 17530 1 513 . 1 1 41 41 GLU CG C 13 36.7 0.2 . 1 . . . A 41 GLU CG . 17530 1 514 . 1 1 41 41 GLU N N 15 120.3 0.2 . 1 . . . A 41 GLU N . 17530 1 515 . 1 1 42 42 ALA H H 1 8.94 0.02 . 1 . . . A 42 ALA H . 17530 1 516 . 1 1 42 42 ALA HA H 1 5.2 0.02 . 1 . . . A 42 ALA HA . 17530 1 517 . 1 1 42 42 ALA HB1 H 1 1.16 0.02 . 1 . . . A 42 ALA HB1 . 17530 1 518 . 1 1 42 42 ALA HB2 H 1 1.16 0.02 . 1 . . . A 42 ALA HB2 . 17530 1 519 . 1 1 42 42 ALA HB3 H 1 1.16 0.02 . 1 . . . A 42 ALA HB3 . 17530 1 520 . 1 1 42 42 ALA C C 13 174.6 0.2 . 1 . . . A 42 ALA C . 17530 1 521 . 1 1 42 42 ALA CA C 13 52.1 0.2 . 1 . . . A 42 ALA CA . 17530 1 522 . 1 1 42 42 ALA CB C 13 22.3 0.2 . 1 . . . A 42 ALA CB . 17530 1 523 . 1 1 42 42 ALA N N 15 125.2 0.2 . 1 . . . A 42 ALA N . 17530 1 524 . 1 1 43 43 GLU H H 1 9.3 0.02 . 1 . . . A 43 GLU H . 17530 1 525 . 1 1 43 43 GLU HA H 1 4.42 0.02 . 1 . . . A 43 GLU HA . 17530 1 526 . 1 1 43 43 GLU HB2 H 1 1.87 0.02 . 2 . . . A 43 GLU HB2 . 17530 1 527 . 1 1 43 43 GLU HB3 H 1 1.99 0.02 . 2 . . . A 43 GLU HB3 . 17530 1 528 . 1 1 43 43 GLU HG2 H 1 2.12 0.02 . 2 . . . A 43 GLU HG2 . 17530 1 529 . 1 1 43 43 GLU HG3 H 1 2.19 0.02 . 2 . . . A 43 GLU HG3 . 17530 1 530 . 1 1 43 43 GLU C C 13 173.4 0.2 . 1 . . . A 43 GLU C . 17530 1 531 . 1 1 43 43 GLU CA C 13 56.7 0.2 . 1 . . . A 43 GLU CA . 17530 1 532 . 1 1 43 43 GLU CB C 13 32.1 0.2 . 1 . . . A 43 GLU CB . 17530 1 533 . 1 1 43 43 GLU CG C 13 35.8 0.2 . 1 . . . A 43 GLU CG . 17530 1 534 . 1 1 43 43 GLU N N 15 124.2 0.2 . 1 . . . A 43 GLU N . 17530 1 535 . 1 1 44 44 VAL H H 1 7.69 0.02 . 1 . . . A 44 VAL H . 17530 1 536 . 1 1 44 44 VAL HA H 1 4.89 0.02 . 1 . . . A 44 VAL HA . 17530 1 537 . 1 1 44 44 VAL HB H 1 1.81 0.02 . 1 . . . A 44 VAL HB . 17530 1 538 . 1 1 44 44 VAL HG11 H 1 1.01 0.02 . 2 . . . A 44 VAL HG11 . 17530 1 539 . 1 1 44 44 VAL HG12 H 1 1.01 0.02 . 2 . . . A 44 VAL HG12 . 17530 1 540 . 1 1 44 44 VAL HG13 H 1 1.01 0.02 . 2 . . . A 44 VAL HG13 . 17530 1 541 . 1 1 44 44 VAL HG21 H 1 0.6 0.02 . 2 . . . A 44 VAL HG21 . 17530 1 542 . 1 1 44 44 VAL HG22 H 1 0.6 0.02 . 2 . . . A 44 VAL HG22 . 17530 1 543 . 1 1 44 44 VAL HG23 H 1 0.6 0.02 . 2 . . . A 44 VAL HG23 . 17530 1 544 . 1 1 44 44 VAL C C 13 174.6 0.2 . 1 . . . A 44 VAL C . 17530 1 545 . 1 1 44 44 VAL CA C 13 60.1 0.2 . 1 . . . A 44 VAL CA . 17530 1 546 . 1 1 44 44 VAL CB C 13 37.0 0.2 . 1 . . . A 44 VAL CB . 17530 1 547 . 1 1 44 44 VAL CG1 C 13 22.7 0.2 . 2 . . . A 44 VAL CG1 . 17530 1 548 . 1 1 44 44 VAL CG2 C 13 21.3 0.2 . 2 . . . A 44 VAL CG2 . 17530 1 549 . 1 1 44 44 VAL N N 15 120.2 0.2 . 1 . . . A 44 VAL N . 17530 1 550 . 1 1 45 45 GLU H H 1 9.03 0.02 . 1 . . . A 45 GLU H . 17530 1 551 . 1 1 45 45 GLU HA H 1 4.92 0.02 . 1 . . . A 45 GLU HA . 17530 1 552 . 1 1 45 45 GLU HB2 H 1 2.06 0.02 . 2 . . . A 45 GLU HB2 . 17530 1 553 . 1 1 45 45 GLU HB3 H 1 2.37 0.02 . 2 . . . A 45 GLU HB3 . 17530 1 554 . 1 1 45 45 GLU HG2 H 1 2.19 0.02 . 2 . . . A 45 GLU HG2 . 17530 1 555 . 1 1 45 45 GLU HG3 H 1 2.24 0.02 . 2 . . . A 45 GLU HG3 . 17530 1 556 . 1 1 45 45 GLU CA C 13 52.4 0.2 . 1 . . . A 45 GLU CA . 17530 1 557 . 1 1 45 45 GLU CB C 13 30.4 0.2 . 1 . . . A 45 GLU CB . 17530 1 558 . 1 1 45 45 GLU CG C 13 35.0 0.2 . 1 . . . A 45 GLU CG . 17530 1 559 . 1 1 45 45 GLU N N 15 127.2 0.2 . 1 . . . A 45 GLU N . 17530 1 560 . 1 1 46 46 PRO HA H 1 4.69 0.02 . 1 . . . A 46 PRO HA . 17530 1 561 . 1 1 46 46 PRO HB2 H 1 2.4 0.02 . 2 . . . A 46 PRO HB2 . 17530 1 562 . 1 1 46 46 PRO HB3 H 1 2.14 0.02 . 2 . . . A 46 PRO HB3 . 17530 1 563 . 1 1 46 46 PRO HG2 H 1 1.79 0.02 . 2 . . . A 46 PRO HG2 . 17530 1 564 . 1 1 46 46 PRO HG3 H 1 1.94 0.02 . 2 . . . A 46 PRO HG3 . 17530 1 565 . 1 1 46 46 PRO HD2 H 1 3.60 0.02 . 2 . . . A 46 PRO HD2 . 17530 1 566 . 1 1 46 46 PRO HD3 H 1 3.50 0.02 . 2 . . . A 46 PRO HD3 . 17530 1 567 . 1 1 46 46 PRO C C 13 175.9 0.2 . 1 . . . A 46 PRO C . 17530 1 568 . 1 1 46 46 PRO CA C 13 62.9 0.2 . 1 . . . A 46 PRO CA . 17530 1 569 . 1 1 46 46 PRO CB C 13 34.6 0.2 . 1 . . . A 46 PRO CB . 17530 1 570 . 1 1 46 46 PRO CG C 13 24.9 0.2 . 1 . . . A 46 PRO CG . 17530 1 571 . 1 1 46 46 PRO CD C 13 50.3 0.2 . 1 . . . A 46 PRO CD . 17530 1 572 . 1 1 47 47 GLU H H 1 8.65 0.02 . 1 . . . A 47 GLU H . 17530 1 573 . 1 1 47 47 GLU HA H 1 4.21 0.02 . 1 . . . A 47 GLU HA . 17530 1 574 . 1 1 47 47 GLU HB2 H 1 1.93 0.02 . 2 . . . A 47 GLU HB2 . 17530 1 575 . 1 1 47 47 GLU HB3 H 1 1.93 0.02 . 2 . . . A 47 GLU HB3 . 17530 1 576 . 1 1 47 47 GLU HG2 H 1 2.14 0.02 . 2 . . . A 47 GLU HG2 . 17530 1 577 . 1 1 47 47 GLU HG3 H 1 2.14 0.02 . 2 . . . A 47 GLU HG3 . 17530 1 578 . 1 1 47 47 GLU CA C 13 56.7 0.2 . 1 . . . A 47 GLU CA . 17530 1 579 . 1 1 47 47 GLU CB C 13 30.7 0.2 . 1 . . . A 47 GLU CB . 17530 1 580 . 1 1 47 47 GLU CG C 13 36.5 0.2 . 1 . . . A 47 GLU CG . 17530 1 581 . 1 1 47 47 GLU N N 15 121.3 0.2 . 1 . . . A 47 GLU N . 17530 1 582 . 1 1 48 48 PRO HA H 1 3.91 0.02 . 1 . . . A 48 PRO HA . 17530 1 583 . 1 1 48 48 PRO HB2 H 1 2.33 0.02 . 2 . . . A 48 PRO HB2 . 17530 1 584 . 1 1 48 48 PRO HB3 H 1 2.03 0.02 . 2 . . . A 48 PRO HB3 . 17530 1 585 . 1 1 48 48 PRO HG2 H 1 1.91 0.02 . 2 . . . A 48 PRO HG2 . 17530 1 586 . 1 1 48 48 PRO HG3 H 1 2.38 0.02 . 2 . . . A 48 PRO HG3 . 17530 1 587 . 1 1 48 48 PRO HD2 H 1 3.77 0.02 . 2 . . . A 48 PRO HD2 . 17530 1 588 . 1 1 48 48 PRO HD3 H 1 3.77 0.02 . 2 . . . A 48 PRO HD3 . 17530 1 589 . 1 1 48 48 PRO C C 13 177.4 0.2 . 1 . . . A 48 PRO C . 17530 1 590 . 1 1 48 48 PRO CA C 13 65.2 0.2 . 1 . . . A 48 PRO CA . 17530 1 591 . 1 1 48 48 PRO CB C 13 31.2 0.2 . 1 . . . A 48 PRO CB . 17530 1 592 . 1 1 48 48 PRO CG C 13 29 0.2 . 1 . . . A 48 PRO CG . 17530 1 593 . 1 1 48 48 PRO CD C 13 50.4 0.2 . 1 . . . A 48 PRO CD . 17530 1 594 . 1 1 49 49 GLY H H 1 9.17 0.02 . 1 . . . A 49 GLY H . 17530 1 595 . 1 1 49 49 GLY HA2 H 1 3.81 0.02 . 2 . . . A 49 GLY HA2 . 17530 1 596 . 1 1 49 49 GLY HA3 H 1 4.44 0.02 . 2 . . . A 49 GLY HA3 . 17530 1 597 . 1 1 49 49 GLY C C 13 174.8 0.2 . 1 . . . A 49 GLY C . 17530 1 598 . 1 1 49 49 GLY CA C 13 45.6 0.2 . 1 . . . A 49 GLY CA . 17530 1 599 . 1 1 49 49 GLY N N 15 114.8 0.2 . 1 . . . A 49 GLY N . 17530 1 600 . 1 1 50 50 GLY H H 1 9.36 0.02 . 1 . . . A 50 GLY H . 17530 1 601 . 1 1 50 50 GLY HA2 H 1 4.26 0.02 . 2 . . . A 50 GLY HA2 . 17530 1 602 . 1 1 50 50 GLY HA3 H 1 4.86 0.02 . 2 . . . A 50 GLY HA3 . 17530 1 603 . 1 1 50 50 GLY C C 13 173.2 0.2 . 1 . . . A 50 GLY C . 17530 1 604 . 1 1 50 50 GLY CA C 13 44.9 0.2 . 1 . . . A 50 GLY CA . 17530 1 605 . 1 1 50 50 GLY N N 15 111.3 0.2 . 1 . . . A 50 GLY N . 17530 1 606 . 1 1 51 51 LEU H H 1 8.63 0.02 . 1 . . . A 51 LEU H . 17530 1 607 . 1 1 51 51 LEU HA H 1 4.25 0.02 . 1 . . . A 51 LEU HA . 17530 1 608 . 1 1 51 51 LEU HB2 H 1 1.57 0.02 . 2 . . . A 51 LEU HB2 . 17530 1 609 . 1 1 51 51 LEU HB3 H 1 1.57 0.02 . 2 . . . A 51 LEU HB3 . 17530 1 610 . 1 1 51 51 LEU HG H 1 1.5 0.02 . 1 . . . A 51 LEU HG . 17530 1 611 . 1 1 51 51 LEU HD11 H 1 0.97 0.02 . 2 . . . A 51 LEU HD11 . 17530 1 612 . 1 1 51 51 LEU HD12 H 1 0.97 0.02 . 2 . . . A 51 LEU HD12 . 17530 1 613 . 1 1 51 51 LEU HD13 H 1 0.97 0.02 . 2 . . . A 51 LEU HD13 . 17530 1 614 . 1 1 51 51 LEU HD21 H 1 0.78 0.02 . 2 . . . A 51 LEU HD21 . 17530 1 615 . 1 1 51 51 LEU HD22 H 1 0.78 0.02 . 2 . . . A 51 LEU HD22 . 17530 1 616 . 1 1 51 51 LEU HD23 H 1 0.78 0.02 . 2 . . . A 51 LEU HD23 . 17530 1 617 . 1 1 51 51 LEU C C 13 174.4 0.2 . 1 . . . A 51 LEU C . 17530 1 618 . 1 1 51 51 LEU CA C 13 56.6 0.2 . 1 . . . A 51 LEU CA . 17530 1 619 . 1 1 51 51 LEU CB C 13 44.2 0.2 . 1 . . . A 51 LEU CB . 17530 1 620 . 1 1 51 51 LEU CG C 13 26.5 0.2 . 1 . . . A 51 LEU CG . 17530 1 621 . 1 1 51 51 LEU CD1 C 13 23.3 0.2 . 2 . . . A 51 LEU CD1 . 17530 1 622 . 1 1 51 51 LEU CD2 C 13 26.1 0.2 . 2 . . . A 51 LEU CD2 . 17530 1 623 . 1 1 51 51 LEU N N 15 124.5 0.2 . 1 . . . A 51 LEU N . 17530 1 624 . 1 1 52 52 TYR H H 1 7.87 0.02 . 1 . . . A 52 TYR H . 17530 1 625 . 1 1 52 52 TYR HA H 1 4.24 0.02 . 1 . . . A 52 TYR HA . 17530 1 626 . 1 1 52 52 TYR HD1 H 1 6.43 0.02 . 3 . . . A 52 TYR HD1 . 17530 1 627 . 1 1 52 52 TYR HD2 H 1 6.43 0.02 . 3 . . . A 52 TYR HD2 . 17530 1 628 . 1 1 52 52 TYR C C 13 174.8 0.2 . 1 . . . A 52 TYR C . 17530 1 629 . 1 1 52 52 TYR CA C 13 58.7 0.2 . 1 . . . A 52 TYR CA . 17530 1 630 . 1 1 52 52 TYR CB C 13 38.4 0.2 . 1 . . . A 52 TYR CB . 17530 1 631 . 1 1 52 52 TYR CD1 C 13 133.8 0.2 . 3 . . . A 52 TYR CD1 . 17530 1 632 . 1 1 52 52 TYR CD2 C 13 133.8 0.2 . 3 . . . A 52 TYR CD2 . 17530 1 633 . 1 1 52 52 TYR N N 15 124 0.2 . 1 . . . A 52 TYR N . 17530 1 634 . 1 1 53 53 LEU H H 1 7.04 0.02 . 1 . . . A 53 LEU H . 17530 1 635 . 1 1 53 53 LEU HA H 1 5.28 0.02 . 1 . . . A 53 LEU HA . 17530 1 636 . 1 1 53 53 LEU HB2 H 1 1.12 0.02 . 2 . . . A 53 LEU HB2 . 17530 1 637 . 1 1 53 53 LEU HB3 H 1 2.12 0.02 . 2 . . . A 53 LEU HB3 . 17530 1 638 . 1 1 53 53 LEU HG H 1 1.24 0.02 . 1 . . . A 53 LEU HG . 17530 1 639 . 1 1 53 53 LEU HD11 H 1 0.71 0.02 . 2 . . . A 53 LEU HD11 . 17530 1 640 . 1 1 53 53 LEU HD12 H 1 0.71 0.02 . 2 . . . A 53 LEU HD12 . 17530 1 641 . 1 1 53 53 LEU HD13 H 1 0.71 0.02 . 2 . . . A 53 LEU HD13 . 17530 1 642 . 1 1 53 53 LEU HD21 H 1 0.58 0.02 . 2 . . . A 53 LEU HD21 . 17530 1 643 . 1 1 53 53 LEU HD22 H 1 0.58 0.02 . 2 . . . A 53 LEU HD22 . 17530 1 644 . 1 1 53 53 LEU HD23 H 1 0.58 0.02 . 2 . . . A 53 LEU HD23 . 17530 1 645 . 1 1 53 53 LEU C C 13 174.9 0.2 . 1 . . . A 53 LEU C . 17530 1 646 . 1 1 53 53 LEU CA C 13 54.3 0.2 . 1 . . . A 53 LEU CA . 17530 1 647 . 1 1 53 53 LEU CB C 13 44.6 0.2 . 1 . . . A 53 LEU CB . 17530 1 648 . 1 1 53 53 LEU CG C 13 27.5 0.2 . 1 . . . A 53 LEU CG . 17530 1 649 . 1 1 53 53 LEU CD1 C 13 24.1 0.2 . 2 . . . A 53 LEU CD1 . 17530 1 650 . 1 1 53 53 LEU CD2 C 13 25.8 0.2 . 2 . . . A 53 LEU CD2 . 17530 1 651 . 1 1 54 54 VAL H H 1 8.60 0.02 . 1 . . . A 54 VAL H . 17530 1 652 . 1 1 54 54 VAL HA H 1 4.64 0.02 . 1 . . . A 54 VAL HA . 17530 1 653 . 1 1 54 54 VAL HB H 1 1.58 0.02 . 1 . . . A 54 VAL HB . 17530 1 654 . 1 1 54 54 VAL HG11 H 1 0.55 0.02 . 2 . . . A 54 VAL HG11 . 17530 1 655 . 1 1 54 54 VAL HG12 H 1 0.55 0.02 . 2 . . . A 54 VAL HG12 . 17530 1 656 . 1 1 54 54 VAL HG13 H 1 0.55 0.02 . 2 . . . A 54 VAL HG13 . 17530 1 657 . 1 1 54 54 VAL HG21 H 1 0.25 0.02 . 2 . . . A 54 VAL HG21 . 17530 1 658 . 1 1 54 54 VAL HG22 H 1 0.25 0.02 . 2 . . . A 54 VAL HG22 . 17530 1 659 . 1 1 54 54 VAL HG23 H 1 0.25 0.02 . 2 . . . A 54 VAL HG23 . 17530 1 660 . 1 1 54 54 VAL C C 13 175.1 0.2 . 1 . . . A 54 VAL C . 17530 1 661 . 1 1 54 54 VAL CA C 13 60.9 0.2 . 1 . . . A 54 VAL CA . 17530 1 662 . 1 1 54 54 VAL CB C 13 36.6 0.2 . 1 . . . A 54 VAL CB . 17530 1 663 . 1 1 54 54 VAL CG1 C 13 20.8 0.2 . 2 . . . A 54 VAL CG1 . 17530 1 664 . 1 1 54 54 VAL CG2 C 13 20.6 0.2 . 2 . . . A 54 VAL CG2 . 17530 1 665 . 1 1 54 54 VAL N N 15 123.9 0.2 . 1 . . . A 54 VAL N . 17530 1 666 . 1 1 55 55 ASN H H 1 8.42 0.02 . 1 . . . A 55 ASN H . 17530 1 667 . 1 1 55 55 ASN HA H 1 4.49 0.02 . 1 . . . A 55 ASN HA . 17530 1 668 . 1 1 55 55 ASN HB2 H 1 3.03 0.02 . 2 . . . A 55 ASN HB2 . 17530 1 669 . 1 1 55 55 ASN HB3 H 1 3.03 0.02 . 2 . . . A 55 ASN HB3 . 17530 1 670 . 1 1 55 55 ASN HD21 H 1 6.15 0.02 . 2 . . . A 55 ASN HD21 . 17530 1 671 . 1 1 55 55 ASN HD22 H 1 5.52 0.02 . 2 . . . A 55 ASN HD22 . 17530 1 672 . 1 1 55 55 ASN C C 13 175.1 0.2 . 1 . . . A 55 ASN C . 17530 1 673 . 1 1 55 55 ASN CA C 13 51.8 0.2 . 1 . . . A 55 ASN CA . 17530 1 674 . 1 1 55 55 ASN CB C 13 35.8 0.2 . 1 . . . A 55 ASN CB . 17530 1 675 . 1 1 55 55 ASN N N 15 126.5 0.2 . 1 . . . A 55 ASN N . 17530 1 676 . 1 1 55 55 ASN ND2 N 15 105.7 0.2 . 1 . . . A 55 ASN ND2 . 17530 1 677 . 1 1 56 56 VAL H H 1 7.23 0.02 . 1 . . . A 56 VAL H . 17530 1 678 . 1 1 56 56 VAL HA H 1 3.18 0.02 . 1 . . . A 56 VAL HA . 17530 1 679 . 1 1 56 56 VAL HB H 1 2.42 0.02 . 1 . . . A 56 VAL HB . 17530 1 680 . 1 1 56 56 VAL HG11 H 1 0.83 0.02 . 2 . . . A 56 VAL HG11 . 17530 1 681 . 1 1 56 56 VAL HG12 H 1 0.83 0.02 . 2 . . . A 56 VAL HG12 . 17530 1 682 . 1 1 56 56 VAL HG13 H 1 0.83 0.02 . 2 . . . A 56 VAL HG13 . 17530 1 683 . 1 1 56 56 VAL HG21 H 1 1.06 0.02 . 2 . . . A 56 VAL HG21 . 17530 1 684 . 1 1 56 56 VAL HG22 H 1 1.06 0.02 . 2 . . . A 56 VAL HG22 . 17530 1 685 . 1 1 56 56 VAL HG23 H 1 1.06 0.02 . 2 . . . A 56 VAL HG23 . 17530 1 686 . 1 1 56 56 VAL CA C 13 68.3 0.2 . 1 . . . A 56 VAL CA . 17530 1 687 . 1 1 56 56 VAL CB C 13 32.8 0.2 . 1 . . . A 56 VAL CB . 17530 1 688 . 1 1 56 56 VAL CG1 C 13 21.3 0.2 . 2 . . . A 56 VAL CG1 . 17530 1 689 . 1 1 56 56 VAL CG2 C 13 22.8 0.2 . 2 . . . A 56 VAL CG2 . 17530 1 690 . 1 1 56 56 VAL N N 15 123.9 0.2 . 1 . . . A 56 VAL N . 17530 1 691 . 1 1 57 57 THR H H 1 8.85 0.02 . 1 . . . A 57 THR H . 17530 1 692 . 1 1 57 57 THR HA H 1 4.59 0.02 . 1 . . . A 57 THR HA . 17530 1 693 . 1 1 57 57 THR HB H 1 4.89 0.02 . 1 . . . A 57 THR HB . 17530 1 694 . 1 1 57 57 THR HG21 H 1 1.35 0.02 . 1 . . . A 57 THR HG21 . 17530 1 695 . 1 1 57 57 THR HG22 H 1 1.35 0.02 . 1 . . . A 57 THR HG22 . 17530 1 696 . 1 1 57 57 THR HG23 H 1 1.35 0.02 . 1 . . . A 57 THR HG23 . 17530 1 697 . 1 1 57 57 THR C C 13 175.1 0.2 . 1 . . . A 57 THR C . 17530 1 698 . 1 1 57 57 THR CA C 13 60.6 0.2 . 1 . . . A 57 THR CA . 17530 1 699 . 1 1 57 57 THR CB C 13 71.3 0.2 . 1 . . . A 57 THR CB . 17530 1 700 . 1 1 57 57 THR CG2 C 13 22.1 0.2 . 1 . . . A 57 THR CG2 . 17530 1 701 . 1 1 58 58 GLY H H 1 7.32 0.02 . 1 . . . A 58 GLY H . 17530 1 702 . 1 1 58 58 GLY HA2 H 1 3.44 0.02 . 2 . . . A 58 GLY HA2 . 17530 1 703 . 1 1 58 58 GLY HA3 H 1 4.24 0.02 . 2 . . . A 58 GLY HA3 . 17530 1 704 . 1 1 58 58 GLY C C 13 175.2 0.2 . 1 . . . A 58 GLY C . 17530 1 705 . 1 1 58 58 GLY CA C 13 46.1 0.2 . 1 . . . A 58 GLY CA . 17530 1 706 . 1 1 58 58 GLY N N 15 112 0.2 . 1 . . . A 58 GLY N . 17530 1 707 . 1 1 59 59 ALA H H 1 7.43 0.02 . 1 . . . A 59 ALA H . 17530 1 708 . 1 1 59 59 ALA HA H 1 4.42 0.02 . 1 . . . A 59 ALA HA . 17530 1 709 . 1 1 59 59 ALA HB1 H 1 1.04 0.02 . 1 . . . A 59 ALA HB1 . 17530 1 710 . 1 1 59 59 ALA HB2 H 1 1.04 0.02 . 1 . . . A 59 ALA HB2 . 17530 1 711 . 1 1 59 59 ALA HB3 H 1 1.04 0.02 . 1 . . . A 59 ALA HB3 . 17530 1 712 . 1 1 59 59 ALA C C 13 177 0.2 . 1 . . . A 59 ALA C . 17530 1 713 . 1 1 59 59 ALA CA C 13 51.6 0.2 . 1 . . . A 59 ALA CA . 17530 1 714 . 1 1 59 59 ALA CB C 13 21.1 0.2 . 1 . . . A 59 ALA CB . 17530 1 715 . 1 1 59 59 ALA N N 15 120.2 0.2 . 1 . . . A 59 ALA N . 17530 1 716 . 1 1 60 60 ARG H H 1 7.70 0.02 . 1 . . . A 60 ARG H . 17530 1 717 . 1 1 60 60 ARG HA H 1 4.47 0.02 . 1 . . . A 60 ARG HA . 17530 1 718 . 1 1 60 60 ARG HB2 H 1 1.82 0.02 . 2 . . . A 60 ARG HB2 . 17530 1 719 . 1 1 60 60 ARG HB3 H 1 1.82 0.02 . 2 . . . A 60 ARG HB3 . 17530 1 720 . 1 1 60 60 ARG HG2 H 1 1.50 0.02 . 2 . . . A 60 ARG HG2 . 17530 1 721 . 1 1 60 60 ARG HG3 H 1 1.50 0.02 . 2 . . . A 60 ARG HG3 . 17530 1 722 . 1 1 60 60 ARG HD2 H 1 3.10 0.02 . 2 . . . A 60 ARG HD2 . 17530 1 723 . 1 1 60 60 ARG HD3 H 1 3.10 0.02 . 2 . . . A 60 ARG HD3 . 17530 1 724 . 1 1 60 60 ARG C C 13 174.5 0.2 . 1 . . . A 60 ARG C . 17530 1 725 . 1 1 60 60 ARG CA C 13 56.5 0.2 . 1 . . . A 60 ARG CA . 17530 1 726 . 1 1 60 60 ARG CB C 13 33 0.2 . 1 . . . A 60 ARG CB . 17530 1 727 . 1 1 60 60 ARG CD C 13 43.5 0.2 . 1 . . . A 60 ARG CD . 17530 1 728 . 1 1 60 60 ARG N N 15 117.6 0.2 . 1 . . . A 60 ARG N . 17530 1 729 . 1 1 61 61 PHE H H 1 9.16 0.02 . 1 . . . A 61 PHE H . 17530 1 730 . 1 1 61 61 PHE HA H 1 4.75 0.02 . 1 . . . A 61 PHE HA . 17530 1 731 . 1 1 61 61 PHE HB2 H 1 2.66 0.02 . 2 . . . A 61 PHE HB2 . 17530 1 732 . 1 1 61 61 PHE HB3 H 1 3.06 0.02 . 2 . . . A 61 PHE HB3 . 17530 1 733 . 1 1 61 61 PHE HD1 H 1 7.07 0.02 . 3 . . . A 61 PHE HD1 . 17530 1 734 . 1 1 61 61 PHE HD2 H 1 7.07 0.02 . 3 . . . A 61 PHE HD2 . 17530 1 735 . 1 1 61 61 PHE HE1 H 1 7.14 0.02 . 3 . . . A 61 PHE HE1 . 17530 1 736 . 1 1 61 61 PHE HE2 H 1 7.14 0.02 . 3 . . . A 61 PHE HE2 . 17530 1 737 . 1 1 61 61 PHE C C 13 174.9 0.2 . 1 . . . A 61 PHE C . 17530 1 738 . 1 1 61 61 PHE CA C 13 60 0.2 . 1 . . . A 61 PHE CA . 17530 1 739 . 1 1 61 61 PHE CB C 13 40.2 0.2 . 1 . . . A 61 PHE CB . 17530 1 740 . 1 1 61 61 PHE CD1 C 13 132 0.2 . 3 . . . A 61 PHE CD1 . 17530 1 741 . 1 1 61 61 PHE CD2 C 13 132 0.2 . 3 . . . A 61 PHE CD2 . 17530 1 742 . 1 1 61 61 PHE CE1 C 13 131.0 0.2 . 3 . . . A 61 PHE CE1 . 17530 1 743 . 1 1 61 61 PHE CE2 C 13 131.0 0.2 . 3 . . . A 61 PHE CE2 . 17530 1 744 . 1 1 61 61 PHE N N 15 124.8 0.2 . 1 . . . A 61 PHE N . 17530 1 745 . 1 1 62 62 ALA H H 1 9.01 0.02 . 1 . . . A 62 ALA H . 17530 1 746 . 1 1 62 62 ALA HA H 1 4.55 0.02 . 1 . . . A 62 ALA HA . 17530 1 747 . 1 1 62 62 ALA HB1 H 1 0.29 0.02 . 1 . . . A 62 ALA HB1 . 17530 1 748 . 1 1 62 62 ALA HB2 H 1 0.29 0.02 . 1 . . . A 62 ALA HB2 . 17530 1 749 . 1 1 62 62 ALA HB3 H 1 0.29 0.02 . 1 . . . A 62 ALA HB3 . 17530 1 750 . 1 1 62 62 ALA C C 13 175.8 0.2 . 1 . . . A 62 ALA C . 17530 1 751 . 1 1 62 62 ALA CA C 13 50.4 0.2 . 1 . . . A 62 ALA CA . 17530 1 752 . 1 1 62 62 ALA CB C 13 20.4 0.2 . 1 . . . A 62 ALA CB . 17530 1 753 . 1 1 62 62 ALA N N 15 126.5 0.2 . 1 . . . A 62 ALA N . 17530 1 754 . 1 1 63 63 ARG H H 1 8.18 0.02 . 1 . . . A 63 ARG H . 17530 1 755 . 1 1 63 63 ARG HA H 1 5.25 0.02 . 1 . . . A 63 ARG HA . 17530 1 756 . 1 1 63 63 ARG HB2 H 1 1.20 0.02 . 2 . . . A 63 ARG HB2 . 17530 1 757 . 1 1 63 63 ARG HB3 H 1 1.58 0.02 . 2 . . . A 63 ARG HB3 . 17530 1 758 . 1 1 63 63 ARG CA C 13 54.5 0.2 . 1 . . . A 63 ARG CA . 17530 1 759 . 1 1 63 63 ARG CB C 13 36.2 0.2 . 1 . . . A 63 ARG CB . 17530 1 760 . 1 1 63 63 ARG CD C 13 42.3 0.2 . 1 . . . A 63 ARG CD . 17530 1 761 . 1 1 63 63 ARG N N 15 120.8 0.2 . 1 . . . A 63 ARG N . 17530 1 762 . 1 1 64 64 GLY H H 1 8.67 0.02 . 1 . . . A 64 GLY H . 17530 1 763 . 1 1 64 64 GLY HA2 H 1 3.81 0.02 . 2 . . . A 64 GLY HA2 . 17530 1 764 . 1 1 64 64 GLY HA3 H 1 4.28 0.02 . 2 . . . A 64 GLY HA3 . 17530 1 765 . 1 1 64 64 GLY C C 13 173.2 0.2 . 1 . . . A 64 GLY C . 17530 1 766 . 1 1 64 64 GLY CA C 13 44.7 0.2 . 1 . . . A 64 GLY CA . 17530 1 767 . 1 1 65 65 SER H H 1 8.52 0.02 . 1 . . . A 65 SER H . 17530 1 768 . 1 1 65 65 SER HA H 1 5.6 0.02 . 1 . . . A 65 SER HA . 17530 1 769 . 1 1 65 65 SER HB2 H 1 3.59 0.02 . 2 . . . A 65 SER HB2 . 17530 1 770 . 1 1 65 65 SER HB3 H 1 3.7 0.02 . 2 . . . A 65 SER HB3 . 17530 1 771 . 1 1 65 65 SER C C 13 175.1 0.2 . 1 . . . A 65 SER C . 17530 1 772 . 1 1 65 65 SER CA C 13 56.3 0.2 . 1 . . . A 65 SER CA . 17530 1 773 . 1 1 65 65 SER CB C 13 66.1 0.2 . 1 . . . A 65 SER CB . 17530 1 774 . 1 1 65 65 SER N N 15 116.6 0.2 . 1 . . . A 65 SER N . 17530 1 775 . 1 1 66 66 PHE H H 1 9.66 0.02 . 1 . . . A 66 PHE H . 17530 1 776 . 1 1 66 66 PHE HA H 1 4.49 0.02 . 1 . . . A 66 PHE HA . 17530 1 777 . 1 1 66 66 PHE HB2 H 1 2.59 0.02 . 2 . . . A 66 PHE HB2 . 17530 1 778 . 1 1 66 66 PHE HB3 H 1 3.55 0.02 . 2 . . . A 66 PHE HB3 . 17530 1 779 . 1 1 66 66 PHE HD1 H 1 7.33 0.02 . 3 . . . A 66 PHE HD1 . 17530 1 780 . 1 1 66 66 PHE HD2 H 1 7.33 0.02 . 3 . . . A 66 PHE HD2 . 17530 1 781 . 1 1 66 66 PHE HE1 H 1 7.08 0.02 . 3 . . . A 66 PHE HE1 . 17530 1 782 . 1 1 66 66 PHE HE2 H 1 7.08 0.02 . 3 . . . A 66 PHE HE2 . 17530 1 783 . 1 1 66 66 PHE C C 13 177.3 0.2 . 1 . . . A 66 PHE C . 17530 1 784 . 1 1 66 66 PHE CA C 13 61 0.2 . 1 . . . A 66 PHE CA . 17530 1 785 . 1 1 66 66 PHE CB C 13 40.4 0.2 . 1 . . . A 66 PHE CB . 17530 1 786 . 1 1 66 66 PHE CD1 C 13 133.2 0.2 . 3 . . . A 66 PHE CD1 . 17530 1 787 . 1 1 66 66 PHE CD2 C 13 133.2 0.2 . 3 . . . A 66 PHE CD2 . 17530 1 788 . 1 1 66 66 PHE CE1 C 13 131.0 0.2 . 3 . . . A 66 PHE CE1 . 17530 1 789 . 1 1 66 66 PHE CE2 C 13 131.0 0.2 . 3 . . . A 66 PHE CE2 . 17530 1 790 . 1 1 66 66 PHE N N 15 122.2 0.2 . 1 . . . A 66 PHE N . 17530 1 791 . 1 1 67 67 ARG H H 1 9.84 0.02 . 1 . . . A 67 ARG H . 17530 1 792 . 1 1 67 67 ARG HA H 1 4.72 0.02 . 1 . . . A 67 ARG HA . 17530 1 793 . 1 1 67 67 ARG HB2 H 1 1.63 0.02 . 2 . . . A 67 ARG HB2 . 17530 1 794 . 1 1 67 67 ARG HB3 H 1 2.01 0.02 . 2 . . . A 67 ARG HB3 . 17530 1 795 . 1 1 67 67 ARG HG2 H 1 1.73 0.02 . 2 . . . A 67 ARG HG2 . 17530 1 796 . 1 1 67 67 ARG HG3 H 1 1.73 0.02 . 2 . . . A 67 ARG HG3 . 17530 1 797 . 1 1 67 67 ARG HD2 H 1 3.16 0.02 . 2 . . . A 67 ARG HD2 . 17530 1 798 . 1 1 67 67 ARG HD3 H 1 3.16 0.02 . 2 . . . A 67 ARG HD3 . 17530 1 799 . 1 1 67 67 ARG C C 13 176.1 0.2 . 1 . . . A 67 ARG C . 17530 1 800 . 1 1 67 67 ARG CA C 13 56.4 0.2 . 1 . . . A 67 ARG CA . 17530 1 801 . 1 1 67 67 ARG CB C 13 32.8 0.2 . 1 . . . A 67 ARG CB . 17530 1 802 . 1 1 67 67 ARG CG C 13 27.1 0.2 . 1 . . . A 67 ARG CG . 17530 1 803 . 1 1 67 67 ARG CD C 13 43.3 0.2 . 1 . . . A 67 ARG CD . 17530 1 804 . 1 1 67 67 ARG N N 15 124 0.2 . 1 . . . A 67 ARG N . 17530 1 805 . 1 1 68 68 GLU H H 1 8.32 0.02 . 1 . . . A 68 GLU H . 17530 1 806 . 1 1 68 68 GLU HA H 1 4.76 0.02 . 1 . . . A 68 GLU HA . 17530 1 807 . 1 1 68 68 GLU HB2 H 1 1.88 0.02 . 2 . . . A 68 GLU HB2 . 17530 1 808 . 1 1 68 68 GLU HB3 H 1 2.07 0.02 . 2 . . . A 68 GLU HB3 . 17530 1 809 . 1 1 68 68 GLU HG2 H 1 2.29 0.02 . 2 . . . A 68 GLU HG2 . 17530 1 810 . 1 1 68 68 GLU HG3 H 1 2.29 0.02 . 2 . . . A 68 GLU HG3 . 17530 1 811 . 1 1 68 68 GLU C C 13 175 0.2 . 1 . . . A 68 GLU C . 17530 1 812 . 1 1 68 68 GLU CA C 13 55.8 0.2 . 1 . . . A 68 GLU CA . 17530 1 813 . 1 1 68 68 GLU CB C 13 34.5 0.2 . 1 . . . A 68 GLU CB . 17530 1 814 . 1 1 68 68 GLU CG C 13 36.5 0.2 . 1 . . . A 68 GLU CG . 17530 1 815 . 1 1 68 68 GLU N N 15 116.3 0.2 . 1 . . . A 68 GLU N . 17530 1 816 . 1 1 69 69 VAL H H 1 9.08 0.02 . 1 . . . A 69 VAL H . 17530 1 817 . 1 1 69 69 VAL HA H 1 4.41 0.02 . 1 . . . A 69 VAL HA . 17530 1 818 . 1 1 69 69 VAL HB H 1 1.99 0.02 . 1 . . . A 69 VAL HB . 17530 1 819 . 1 1 69 69 VAL HG11 H 1 0.9 0.02 . 2 . . . A 69 VAL HG11 . 17530 1 820 . 1 1 69 69 VAL HG12 H 1 0.9 0.02 . 2 . . . A 69 VAL HG12 . 17530 1 821 . 1 1 69 69 VAL HG13 H 1 0.9 0.02 . 2 . . . A 69 VAL HG13 . 17530 1 822 . 1 1 69 69 VAL HG21 H 1 0.5 0.02 . 2 . . . A 69 VAL HG21 . 17530 1 823 . 1 1 69 69 VAL HG22 H 1 0.5 0.02 . 2 . . . A 69 VAL HG22 . 17530 1 824 . 1 1 69 69 VAL HG23 H 1 0.5 0.02 . 2 . . . A 69 VAL HG23 . 17530 1 825 . 1 1 69 69 VAL C C 13 173.9 0.2 . 1 . . . A 69 VAL C . 17530 1 826 . 1 1 69 69 VAL CA C 13 63 0.2 . 1 . . . A 69 VAL CA . 17530 1 827 . 1 1 69 69 VAL CB C 13 34.9 0.2 . 1 . . . A 69 VAL CB . 17530 1 828 . 1 1 69 69 VAL CG1 C 13 21.1 0.2 . 2 . . . A 69 VAL CG1 . 17530 1 829 . 1 1 69 69 VAL CG2 C 13 20.6 0.2 . 2 . . . A 69 VAL CG2 . 17530 1 830 . 1 1 69 69 VAL N N 15 123.4 0.2 . 1 . . . A 69 VAL N . 17530 1 831 . 1 1 70 70 VAL H H 1 8.97 0.02 . 1 . . . A 70 VAL H . 17530 1 832 . 1 1 70 70 VAL HA H 1 4.63 0.02 . 1 . . . A 70 VAL HA . 17530 1 833 . 1 1 70 70 VAL HB H 1 2.15 0.02 . 1 . . . A 70 VAL HB . 17530 1 834 . 1 1 70 70 VAL HG11 H 1 0.88 0.02 . 2 . . . A 70 VAL HG11 . 17530 1 835 . 1 1 70 70 VAL HG12 H 1 0.88 0.02 . 2 . . . A 70 VAL HG12 . 17530 1 836 . 1 1 70 70 VAL HG13 H 1 0.88 0.02 . 2 . . . A 70 VAL HG13 . 17530 1 837 . 1 1 70 70 VAL HG21 H 1 0.91 0.02 . 2 . . . A 70 VAL HG21 . 17530 1 838 . 1 1 70 70 VAL HG22 H 1 0.91 0.02 . 2 . . . A 70 VAL HG22 . 17530 1 839 . 1 1 70 70 VAL HG23 H 1 0.91 0.02 . 2 . . . A 70 VAL HG23 . 17530 1 840 . 1 1 70 70 VAL CA C 13 58.7 0.2 . 1 . . . A 70 VAL CA . 17530 1 841 . 1 1 70 70 VAL CB C 13 32.6 0.2 . 1 . . . A 70 VAL CB . 17530 1 842 . 1 1 70 70 VAL CG1 C 13 22.2 0.2 . 2 . . . A 70 VAL CG1 . 17530 1 843 . 1 1 70 70 VAL CG2 C 13 19.5 0.2 . 2 . . . A 70 VAL CG2 . 17530 1 844 . 1 1 70 70 VAL N N 15 127.8 0.2 . 1 . . . A 70 VAL N . 17530 1 845 . 1 1 71 71 PRO HA H 1 3.24 0.02 . 1 . . . A 71 PRO HA . 17530 1 846 . 1 1 71 71 PRO HB2 H 1 1.72 0.02 . 2 . . . A 71 PRO HB2 . 17530 1 847 . 1 1 71 71 PRO HB3 H 1 1.68 0.02 . 2 . . . A 71 PRO HB3 . 17530 1 848 . 1 1 71 71 PRO HG2 H 1 2.14 0.02 . 2 . . . A 71 PRO HG2 . 17530 1 849 . 1 1 71 71 PRO HG3 H 1 2.14 0.02 . 2 . . . A 71 PRO HG3 . 17530 1 850 . 1 1 71 71 PRO HD2 H 1 3.74 0.02 . 2 . . . A 71 PRO HD2 . 17530 1 851 . 1 1 71 71 PRO HD3 H 1 3.74 0.02 . 2 . . . A 71 PRO HD3 . 17530 1 852 . 1 1 71 71 PRO C C 13 179.5 0.2 . 1 . . . A 71 PRO C . 17530 1 853 . 1 1 71 71 PRO CA C 13 57.2 0.2 . 1 . . . A 71 PRO CA . 17530 1 854 . 1 1 71 71 PRO CB C 13 31.6 0.2 . 1 . . . A 71 PRO CB . 17530 1 855 . 1 1 71 71 PRO CG C 13 27.8 0.2 . 1 . . . A 71 PRO CG . 17530 1 856 . 1 1 71 71 PRO CD C 13 51 0.2 . 1 . . . A 71 PRO CD . 17530 1 857 . 1 1 72 72 VAL H H 1 7.31 0.02 . 1 . . . A 72 VAL H . 17530 1 858 . 1 1 72 72 VAL HA H 1 2.89 0.02 . 1 . . . A 72 VAL HA . 17530 1 859 . 1 1 72 72 VAL HB H 1 2.07 0.02 . 1 . . . A 72 VAL HB . 17530 1 860 . 1 1 72 72 VAL HG11 H 1 0.52 0.02 . 2 . . . A 72 VAL HG11 . 17530 1 861 . 1 1 72 72 VAL HG12 H 1 0.52 0.02 . 2 . . . A 72 VAL HG12 . 17530 1 862 . 1 1 72 72 VAL HG13 H 1 0.52 0.02 . 2 . . . A 72 VAL HG13 . 17530 1 863 . 1 1 72 72 VAL HG21 H 1 0.44 0.02 . 2 . . . A 72 VAL HG21 . 17530 1 864 . 1 1 72 72 VAL HG22 H 1 0.44 0.02 . 2 . . . A 72 VAL HG22 . 17530 1 865 . 1 1 72 72 VAL HG23 H 1 0.44 0.02 . 2 . . . A 72 VAL HG23 . 17530 1 866 . 1 1 72 72 VAL C C 13 172 0.2 . 1 . . . A 72 VAL C . 17530 1 867 . 1 1 72 72 VAL CA C 13 63.5 0.2 . 1 . . . A 72 VAL CA . 17530 1 868 . 1 1 72 72 VAL CB C 13 30.4 0.2 . 1 . . . A 72 VAL CB . 17530 1 869 . 1 1 72 72 VAL CG1 C 13 21.6 0.2 . 2 . . . A 72 VAL CG1 . 17530 1 870 . 1 1 72 72 VAL CG2 C 13 17.7 0.2 . 2 . . . A 72 VAL CG2 . 17530 1 871 . 1 1 72 72 VAL N N 15 118.8 0.2 . 1 . . . A 72 VAL N . 17530 1 872 . 1 1 73 73 HIS H H 1 7.79 0.02 . 1 . . . A 73 HIS H . 17530 1 873 . 1 1 73 73 HIS HA H 1 5.37 0.02 . 1 . . . A 73 HIS HA . 17530 1 874 . 1 1 73 73 HIS HB2 H 1 3.32 0.02 . 2 . . . A 73 HIS HB2 . 17530 1 875 . 1 1 73 73 HIS HB3 H 1 3.32 0.02 . 2 . . . A 73 HIS HB3 . 17530 1 876 . 1 1 73 73 HIS HD2 H 1 7.21 0.02 . 1 . . . A 73 HIS HD2 . 17530 1 877 . 1 1 73 73 HIS HE1 H 1 8.13 0.02 . 1 . . . A 73 HIS HE1 . 17530 1 878 . 1 1 73 73 HIS C C 13 175.6 0.2 . 1 . . . A 73 HIS C . 17530 1 879 . 1 1 73 73 HIS CA C 13 56.9 0.2 . 1 . . . A 73 HIS CA . 17530 1 880 . 1 1 73 73 HIS CB C 13 33.2 0.2 . 1 . . . A 73 HIS CB . 17530 1 881 . 1 1 73 73 HIS CD2 C 13 120.4 0.2 . 1 . . . A 73 HIS CD2 . 17530 1 882 . 1 1 73 73 HIS CE1 C 13 137.5 0.2 . 1 . . . A 73 HIS CE1 . 17530 1 883 . 1 1 73 73 HIS N N 15 112.1 0.2 . 1 . . . A 73 HIS N . 17530 1 884 . 1 1 73 73 HIS ND1 N 15 203.8 0.2 . 1 . . . A 73 HIS ND1 . 17530 1 885 . 1 1 73 73 HIS NE2 N 15 182.2 0.2 . 1 . . . A 73 HIS NE2 . 17530 1 886 . 1 1 74 74 ARG H H 1 8.12 0.02 . 1 . . . A 74 ARG H . 17530 1 887 . 1 1 74 74 ARG HA H 1 5.62 0.02 . 1 . . . A 74 ARG HA . 17530 1 888 . 1 1 74 74 ARG HB2 H 1 1.64 0.02 . 2 . . . A 74 ARG HB2 . 17530 1 889 . 1 1 74 74 ARG HB3 H 1 2 0.02 . 2 . . . A 74 ARG HB3 . 17530 1 890 . 1 1 74 74 ARG HG2 H 1 1.48 0.02 . 2 . . . A 74 ARG HG2 . 17530 1 891 . 1 1 74 74 ARG HG3 H 1 1.48 0.02 . 2 . . . A 74 ARG HG3 . 17530 1 892 . 1 1 74 74 ARG HD2 H 1 3.08 0.02 . 2 . . . A 74 ARG HD2 . 17530 1 893 . 1 1 74 74 ARG HD3 H 1 3.35 0.02 . 2 . . . A 74 ARG HD3 . 17530 1 894 . 1 1 74 74 ARG HE H 1 7.44 0.02 . 1 . . . A 74 ARG HE . 17530 1 895 . 1 1 74 74 ARG C C 13 173.3 0.2 . 1 . . . A 74 ARG C . 17530 1 896 . 1 1 74 74 ARG CA C 13 55.6 0.2 . 1 . . . A 74 ARG CA . 17530 1 897 . 1 1 74 74 ARG CB C 13 33.6 0.2 . 1 . . . A 74 ARG CB . 17530 1 898 . 1 1 74 74 ARG CG C 13 27.8 0.2 . 1 . . . A 74 ARG CG . 17530 1 899 . 1 1 74 74 ARG CD C 13 42.9 0.2 . 1 . . . A 74 ARG CD . 17530 1 900 . 1 1 74 74 ARG N N 15 123.8 0.2 . 1 . . . A 74 ARG N . 17530 1 901 . 1 1 74 74 ARG NE N 15 84.9 0.2 . 1 . . . A 74 ARG NE . 17530 1 902 . 1 1 75 75 LEU H H 1 9.08 0.02 . 1 . . . A 75 LEU H . 17530 1 903 . 1 1 75 75 LEU HA H 1 5.08 0.02 . 1 . . . A 75 LEU HA . 17530 1 904 . 1 1 75 75 LEU HB2 H 1 1.67 0.02 . 2 . . . A 75 LEU HB2 . 17530 1 905 . 1 1 75 75 LEU HB3 H 1 1.72 0.02 . 2 . . . A 75 LEU HB3 . 17530 1 906 . 1 1 75 75 LEU HG H 1 0.86 0.02 . 1 . . . A 75 LEU HG . 17530 1 907 . 1 1 75 75 LEU HD11 H 1 0.86 0.02 . 2 . . . A 75 LEU HD11 . 17530 1 908 . 1 1 75 75 LEU HD12 H 1 0.86 0.02 . 2 . . . A 75 LEU HD12 . 17530 1 909 . 1 1 75 75 LEU HD13 H 1 0.86 0.02 . 2 . . . A 75 LEU HD13 . 17530 1 910 . 1 1 75 75 LEU HD21 H 1 0.86 0.02 . 2 . . . A 75 LEU HD21 . 17530 1 911 . 1 1 75 75 LEU HD22 H 1 0.86 0.02 . 2 . . . A 75 LEU HD22 . 17530 1 912 . 1 1 75 75 LEU HD23 H 1 0.86 0.02 . 2 . . . A 75 LEU HD23 . 17530 1 913 . 1 1 75 75 LEU C C 13 174.3 0.2 . 1 . . . A 75 LEU C . 17530 1 914 . 1 1 75 75 LEU CA C 13 54.2 0.2 . 1 . . . A 75 LEU CA . 17530 1 915 . 1 1 75 75 LEU CB C 13 48 0.2 . 1 . . . A 75 LEU CB . 17530 1 916 . 1 1 75 75 LEU CG C 13 26.2 0.2 . 1 . . . A 75 LEU CG . 17530 1 917 . 1 1 75 75 LEU CD1 C 13 26.2 0.2 . 2 . . . A 75 LEU CD1 . 17530 1 918 . 1 1 75 75 LEU CD2 C 13 26.2 0.2 . 2 . . . A 75 LEU CD2 . 17530 1 919 . 1 1 75 75 LEU N N 15 126.7 0.2 . 1 . . . A 75 LEU N . 17530 1 920 . 1 1 76 76 ALA H H 1 9.31 0.02 . 1 . . . A 76 ALA H . 17530 1 921 . 1 1 76 76 ALA HA H 1 5.7 0.02 . 1 . . . A 76 ALA HA . 17530 1 922 . 1 1 76 76 ALA HB1 H 1 1.38 0.02 . 1 . . . A 76 ALA HB1 . 17530 1 923 . 1 1 76 76 ALA HB2 H 1 1.38 0.02 . 1 . . . A 76 ALA HB2 . 17530 1 924 . 1 1 76 76 ALA HB3 H 1 1.38 0.02 . 1 . . . A 76 ALA HB3 . 17530 1 925 . 1 1 76 76 ALA C C 13 176.9 0.2 . 1 . . . A 76 ALA C . 17530 1 926 . 1 1 76 76 ALA CA C 13 51.4 0.2 . 1 . . . A 76 ALA CA . 17530 1 927 . 1 1 76 76 ALA CB C 13 22.6 0.2 . 1 . . . A 76 ALA CB . 17530 1 928 . 1 1 76 76 ALA N N 15 122.1 0.2 . 1 . . . A 76 ALA N . 17530 1 929 . 1 1 77 77 TYR H H 1 9.21 0.02 . 1 . . . A 77 TYR H . 17530 1 930 . 1 1 77 77 TYR HA H 1 5.07 0.02 . 1 . . . A 77 TYR HA . 17530 1 931 . 1 1 77 77 TYR HB2 H 1 2.17 0.02 . 2 . . . A 77 TYR HB2 . 17530 1 932 . 1 1 77 77 TYR HB3 H 1 2.29 0.02 . 2 . . . A 77 TYR HB3 . 17530 1 933 . 1 1 77 77 TYR HD1 H 1 6.35 0.02 . 3 . . . A 77 TYR HD1 . 17530 1 934 . 1 1 77 77 TYR HD2 H 1 6.35 0.02 . 3 . . . A 77 TYR HD2 . 17530 1 935 . 1 1 77 77 TYR HE1 H 1 6.28 0.02 . 3 . . . A 77 TYR HE1 . 17530 1 936 . 1 1 77 77 TYR HE2 H 1 6.28 0.02 . 3 . . . A 77 TYR HE2 . 17530 1 937 . 1 1 77 77 TYR C C 13 173.1 0.2 . 1 . . . A 77 TYR C . 17530 1 938 . 1 1 77 77 TYR CA C 13 54.9 0.2 . 1 . . . A 77 TYR CA . 17530 1 939 . 1 1 77 77 TYR CB C 13 38.8 0.2 . 1 . . . A 77 TYR CB . 17530 1 940 . 1 1 77 77 TYR CD1 C 13 132.1 0.2 . 3 . . . A 77 TYR CD1 . 17530 1 941 . 1 1 77 77 TYR CD2 C 13 132.1 0.2 . 3 . . . A 77 TYR CD2 . 17530 1 942 . 1 1 77 77 TYR CE1 C 13 117.4 0.2 . 3 . . . A 77 TYR CE1 . 17530 1 943 . 1 1 77 77 TYR CE2 C 13 117.2 0.2 . 3 . . . A 77 TYR CE2 . 17530 1 944 . 1 1 77 77 TYR N N 15 121.9 0.2 . 1 . . . A 77 TYR N . 17530 1 945 . 1 1 78 78 SER H H 1 9.26 0.02 . 1 . . . A 78 SER H . 17530 1 946 . 1 1 78 78 SER HA H 1 5.25 0.02 . 1 . . . A 78 SER HA . 17530 1 947 . 1 1 78 78 SER HB2 H 1 3.94 0.02 . 2 . . . A 78 SER HB2 . 17530 1 948 . 1 1 78 78 SER HB3 H 1 4.32 0.02 . 2 . . . A 78 SER HB3 . 17530 1 949 . 1 1 78 78 SER C C 13 174.4 0.2 . 1 . . . A 78 SER C . 17530 1 950 . 1 1 78 78 SER CA C 13 57 0.2 . 1 . . . A 78 SER CA . 17530 1 951 . 1 1 78 78 SER CB C 13 64.9 0.2 . 1 . . . A 78 SER CB . 17530 1 952 . 1 1 78 78 SER N N 15 118.3 0.2 . 1 . . . A 78 SER N . 17530 1 953 . 1 1 79 79 PHE H H 1 8.25 0.02 . 1 . . . A 79 PHE H . 17530 1 954 . 1 1 79 79 PHE HA H 1 4.42 0.02 . 1 . . . A 79 PHE HA . 17530 1 955 . 1 1 79 79 PHE HB2 H 1 2.54 0.02 . 2 . . . A 79 PHE HB2 . 17530 1 956 . 1 1 79 79 PHE HB3 H 1 2.54 0.02 . 2 . . . A 79 PHE HB3 . 17530 1 957 . 1 1 79 79 PHE C C 13 174.9 0.2 . 1 . . . A 79 PHE C . 17530 1 958 . 1 1 79 79 PHE CA C 13 60.2 0.2 . 1 . . . A 79 PHE CA . 17530 1 959 . 1 1 79 79 PHE CB C 13 44.1 0.2 . 1 . . . A 79 PHE CB . 17530 1 960 . 1 1 79 79 PHE N N 15 115.0 0.2 . 1 . . . A 79 PHE N . 17530 1 961 . 1 1 80 80 GLY H H 1 6.90 0.02 . 1 . . . A 80 GLY H . 17530 1 962 . 1 1 80 80 GLY HA2 H 1 3.34 0.02 . 2 . . . A 80 GLY HA2 . 17530 1 963 . 1 1 80 80 GLY HA3 H 1 3.34 0.02 . 2 . . . A 80 GLY HA3 . 17530 1 964 . 1 1 80 80 GLY C C 13 169.5 0.2 . 1 . . . A 80 GLY C . 17530 1 965 . 1 1 80 80 GLY CA C 13 44.6 0.2 . 1 . . . A 80 GLY CA . 17530 1 966 . 1 1 80 80 GLY N N 15 119.5 0.2 . 1 . . . A 80 GLY N . 17530 1 967 . 1 1 81 81 TRP H H 1 9.04 0.02 . 1 . . . A 81 TRP H . 17530 1 968 . 1 1 81 81 TRP HA H 1 5.26 0.02 . 1 . . . A 81 TRP HA . 17530 1 969 . 1 1 81 81 TRP HB2 H 1 2.98 0.02 . 2 . . . A 81 TRP HB2 . 17530 1 970 . 1 1 81 81 TRP HB3 H 1 3.05 0.02 . 2 . . . A 81 TRP HB3 . 17530 1 971 . 1 1 81 81 TRP HD1 H 1 7.32 0.02 . 1 . . . A 81 TRP HD1 . 17530 1 972 . 1 1 81 81 TRP HE3 H 1 7.05 0.02 . 1 . . . A 81 TRP HE3 . 17530 1 973 . 1 1 81 81 TRP HZ2 H 1 7.51 0.02 . 1 . . . A 81 TRP HZ2 . 17530 1 974 . 1 1 81 81 TRP HZ3 H 1 6.88 0.02 . 1 . . . A 81 TRP HZ3 . 17530 1 975 . 1 1 81 81 TRP HH2 H 1 7.05 0.02 . 1 . . . A 81 TRP HH2 . 17530 1 976 . 1 1 81 81 TRP C C 13 176.3 0.2 . 1 . . . A 81 TRP C . 17530 1 977 . 1 1 81 81 TRP CA C 13 56.2 0.2 . 1 . . . A 81 TRP CA . 17530 1 978 . 1 1 81 81 TRP CB C 13 31.9 0.2 . 1 . . . A 81 TRP CB . 17530 1 979 . 1 1 81 81 TRP CD1 C 13 126.7 0.2 . 1 . . . A 81 TRP CD1 . 17530 1 980 . 1 1 81 81 TRP CE3 C 13 121.9 0.2 . 1 . . . A 81 TRP CE3 . 17530 1 981 . 1 1 81 81 TRP CZ2 C 13 114.5 0.2 . 1 . . . A 81 TRP CZ2 . 17530 1 982 . 1 1 81 81 TRP CZ3 C 13 120.8 0.2 . 1 . . . A 81 TRP CZ3 . 17530 1 983 . 1 1 81 81 TRP CH2 C 13 124.3 0.2 . 1 . . . A 81 TRP CH2 . 17530 1 984 . 1 1 81 81 TRP N N 15 120.1 0.2 . 1 . . . A 81 TRP N . 17530 1 985 . 1 1 82 82 ASP H H 1 8.86 0.02 . 1 . . . A 82 ASP H . 17530 1 986 . 1 1 82 82 ASP HA H 1 4.49 0.02 . 1 . . . A 82 ASP HA . 17530 1 987 . 1 1 82 82 ASP HB2 H 1 2.7 0.02 . 2 . . . A 82 ASP HB2 . 17530 1 988 . 1 1 82 82 ASP HB3 H 1 2.84 0.02 . 2 . . . A 82 ASP HB3 . 17530 1 989 . 1 1 82 82 ASP C C 13 178.8 0.2 . 1 . . . A 82 ASP C . 17530 1 990 . 1 1 82 82 ASP CA C 13 56.5 0.2 . 1 . . . A 82 ASP CA . 17530 1 991 . 1 1 82 82 ASP CB C 13 40.6 0.2 . 1 . . . A 82 ASP CB . 17530 1 992 . 1 1 82 82 ASP N N 15 125.1 0.2 . 1 . . . A 82 ASP N . 17530 1 993 . 1 1 83 83 GLY H H 1 9.27 0.02 . 1 . . . A 83 GLY H . 17530 1 994 . 1 1 83 83 GLY HA2 H 1 3.77 0.02 . 2 . . . A 83 GLY HA2 . 17530 1 995 . 1 1 83 83 GLY HA3 H 1 4.19 0.02 . 2 . . . A 83 GLY HA3 . 17530 1 996 . 1 1 83 83 GLY C C 13 173.9 0.2 . 1 . . . A 83 GLY C . 17530 1 997 . 1 1 83 83 GLY CA C 13 45.6 0.2 . 1 . . . A 83 GLY CA . 17530 1 998 . 1 1 83 83 GLY N N 15 112.5 0.2 . 1 . . . A 83 GLY N . 17530 1 999 . 1 1 84 84 SER H H 1 7.95 0.02 . 1 . . . A 84 SER H . 17530 1 1000 . 1 1 84 84 SER HA H 1 4.58 0.02 . 1 . . . A 84 SER HA . 17530 1 1001 . 1 1 84 84 SER HB2 H 1 3.72 0.02 . 2 . . . A 84 SER HB2 . 17530 1 1002 . 1 1 84 84 SER HB3 H 1 4.16 0.02 . 2 . . . A 84 SER HB3 . 17530 1 1003 . 1 1 84 84 SER HG H 1 5.19 0.02 . 1 . . . A 84 SER HG . 17530 1 1004 . 1 1 84 84 SER C C 13 176.5 0.2 . 1 . . . A 84 SER C . 17530 1 1005 . 1 1 84 84 SER CA C 13 57.5 0.2 . 1 . . . A 84 SER CA . 17530 1 1006 . 1 1 84 84 SER CB C 13 65.1 0.2 . 1 . . . A 84 SER CB . 17530 1 1007 . 1 1 84 84 SER N N 15 113.4 0.2 . 1 . . . A 84 SER N . 17530 1 1008 . 1 1 85 85 GLU H H 1 9.37 0.02 . 1 . . . A 85 GLU H . 17530 1 1009 . 1 1 85 85 GLU HA H 1 4.46 0.02 . 1 . . . A 85 GLU HA . 17530 1 1010 . 1 1 85 85 GLU HB2 H 1 1.96 0.02 . 2 . . . A 85 GLU HB2 . 17530 1 1011 . 1 1 85 85 GLU HB3 H 1 2.22 0.02 . 2 . . . A 85 GLU HB3 . 17530 1 1012 . 1 1 85 85 GLU HG2 H 1 2.3 0.02 . 2 . . . A 85 GLU HG2 . 17530 1 1013 . 1 1 85 85 GLU HG3 H 1 2.37 0.02 . 2 . . . A 85 GLU HG3 . 17530 1 1014 . 1 1 85 85 GLU C C 13 176.4 0.2 . 1 . . . A 85 GLU C . 17530 1 1015 . 1 1 85 85 GLU CA C 13 56.9 0.2 . 1 . . . A 85 GLU CA . 17530 1 1016 . 1 1 85 85 GLU CB C 13 30.2 0.2 . 1 . . . A 85 GLU CB . 17530 1 1017 . 1 1 85 85 GLU CG C 13 36.6 0.2 . 1 . . . A 85 GLU CG . 17530 1 1018 . 1 1 85 85 GLU N N 15 127.1 0.2 . 1 . . . A 85 GLU N . 17530 1 1019 . 1 1 86 86 VAL H H 1 7.98 0.02 . 1 . . . A 86 VAL H . 17530 1 1020 . 1 1 86 86 VAL HA H 1 4.16 0.02 . 1 . . . A 86 VAL HA . 17530 1 1021 . 1 1 86 86 VAL HB H 1 1.88 0.02 . 1 . . . A 86 VAL HB . 17530 1 1022 . 1 1 86 86 VAL HG11 H 1 1.01 0.02 . 2 . . . A 86 VAL HG11 . 17530 1 1023 . 1 1 86 86 VAL HG12 H 1 1.01 0.02 . 2 . . . A 86 VAL HG12 . 17530 1 1024 . 1 1 86 86 VAL HG13 H 1 1.01 0.02 . 2 . . . A 86 VAL HG13 . 17530 1 1025 . 1 1 86 86 VAL HG21 H 1 0.97 0.02 . 2 . . . A 86 VAL HG21 . 17530 1 1026 . 1 1 86 86 VAL HG22 H 1 0.97 0.02 . 2 . . . A 86 VAL HG22 . 17530 1 1027 . 1 1 86 86 VAL HG23 H 1 0.97 0.02 . 2 . . . A 86 VAL HG23 . 17530 1 1028 . 1 1 86 86 VAL C C 13 176 0.2 . 1 . . . A 86 VAL C . 17530 1 1029 . 1 1 86 86 VAL CA C 13 63.9 0.2 . 1 . . . A 86 VAL CA . 17530 1 1030 . 1 1 86 86 VAL CB C 13 33.7 0.2 . 1 . . . A 86 VAL CB . 17530 1 1031 . 1 1 86 86 VAL CG1 C 13 21.7 0.2 . 2 . . . A 86 VAL CG1 . 17530 1 1032 . 1 1 86 86 VAL CG2 C 13 21.4 0.2 . 2 . . . A 86 VAL CG2 . 17530 1 1033 . 1 1 86 86 VAL N N 15 119 0.2 . 1 . . . A 86 VAL N . 17530 1 1034 . 1 1 87 87 VAL H H 1 8.28 0.02 . 1 . . . A 87 VAL H . 17530 1 1035 . 1 1 87 87 VAL HA H 1 4.45 0.02 . 1 . . . A 87 VAL HA . 17530 1 1036 . 1 1 87 87 VAL HB H 1 2.57 0.02 . 1 . . . A 87 VAL HB . 17530 1 1037 . 1 1 87 87 VAL HG11 H 1 1.24 0.02 . 2 . . . A 87 VAL HG11 . 17530 1 1038 . 1 1 87 87 VAL HG12 H 1 1.24 0.02 . 2 . . . A 87 VAL HG12 . 17530 1 1039 . 1 1 87 87 VAL HG13 H 1 1.24 0.02 . 2 . . . A 87 VAL HG13 . 17530 1 1040 . 1 1 87 87 VAL HG21 H 1 1 0.02 . 2 . . . A 87 VAL HG21 . 17530 1 1041 . 1 1 87 87 VAL HG22 H 1 1 0.02 . 2 . . . A 87 VAL HG22 . 17530 1 1042 . 1 1 87 87 VAL HG23 H 1 1 0.02 . 2 . . . A 87 VAL HG23 . 17530 1 1043 . 1 1 87 87 VAL CA C 13 59.5 0.2 . 1 . . . A 87 VAL CA . 17530 1 1044 . 1 1 87 87 VAL CB C 13 32.7 0.2 . 1 . . . A 87 VAL CB . 17530 1 1045 . 1 1 87 87 VAL CG1 C 13 22.1 0.2 . 2 . . . A 87 VAL CG1 . 17530 1 1046 . 1 1 87 87 VAL CG2 C 13 21 0.2 . 2 . . . A 87 VAL CG2 . 17530 1 1047 . 1 1 87 87 VAL N N 15 119.3 0.2 . 1 . . . A 87 VAL N . 17530 1 1048 . 1 1 88 88 PRO HA H 1 5.18 0.02 . 1 . . . A 88 PRO HA . 17530 1 1049 . 1 1 88 88 PRO HB2 H 1 2.68 0.02 . 2 . . . A 88 PRO HB2 . 17530 1 1050 . 1 1 88 88 PRO HB3 H 1 1.99 0.02 . 2 . . . A 88 PRO HB3 . 17530 1 1051 . 1 1 88 88 PRO HG2 H 1 1.97 0.02 . 2 . . . A 88 PRO HG2 . 17530 1 1052 . 1 1 88 88 PRO HG3 H 1 2.08 0.02 . 2 . . . A 88 PRO HG3 . 17530 1 1053 . 1 1 88 88 PRO HD2 H 1 3.63 0.02 . 2 . . . A 88 PRO HD2 . 17530 1 1054 . 1 1 88 88 PRO HD3 H 1 3.17 0.02 . 2 . . . A 88 PRO HD3 . 17530 1 1055 . 1 1 88 88 PRO CA C 13 62.6 0.2 . 1 . . . A 88 PRO CA . 17530 1 1056 . 1 1 88 88 PRO CB C 13 30.5 0.2 . 1 . . . A 88 PRO CB . 17530 1 1057 . 1 1 88 88 PRO CG C 13 27.6 0.2 . 1 . . . A 88 PRO CG . 17530 1 1058 . 1 1 88 88 PRO CD C 13 50.2 0.2 . 1 . . . A 88 PRO CD . 17530 1 1059 . 1 1 89 89 PRO HA H 1 3.73 0.02 . 1 . . . A 89 PRO HA . 17530 1 1060 . 1 1 89 89 PRO HB2 H 1 1.90 0.02 . 2 . . . A 89 PRO HB2 . 17530 1 1061 . 1 1 89 89 PRO HB3 H 1 1.81 0.02 . 2 . . . A 89 PRO HB3 . 17530 1 1062 . 1 1 89 89 PRO HG2 H 1 1.87 0.02 . 2 . . . A 89 PRO HG2 . 17530 1 1063 . 1 1 89 89 PRO HG3 H 1 2.14 0.02 . 2 . . . A 89 PRO HG3 . 17530 1 1064 . 1 1 89 89 PRO HD2 H 1 4.31 0.02 . 2 . . . A 89 PRO HD2 . 17530 1 1065 . 1 1 89 89 PRO HD3 H 1 3.58 0.02 . 2 . . . A 89 PRO HD3 . 17530 1 1066 . 1 1 89 89 PRO C C 13 177.2 0.2 . 1 . . . A 89 PRO C . 17530 1 1067 . 1 1 89 89 PRO CA C 13 64.8 0.2 . 1 . . . A 89 PRO CA . 17530 1 1068 . 1 1 89 89 PRO CB C 13 32.5 0.2 . 1 . . . A 89 PRO CB . 17530 1 1069 . 1 1 89 89 PRO CG C 13 27.8 0.2 . 1 . . . A 89 PRO CG . 17530 1 1070 . 1 1 89 89 PRO CD C 13 51.1 0.2 . 1 . . . A 89 PRO CD . 17530 1 1071 . 1 1 90 90 GLY H H 1 7.62 0.02 . 1 . . . A 90 GLY H . 17530 1 1072 . 1 1 90 90 GLY HA2 H 1 3.99 0.02 . 2 . . . A 90 GLY HA2 . 17530 1 1073 . 1 1 90 90 GLY HA3 H 1 4.1 0.02 . 2 . . . A 90 GLY HA3 . 17530 1 1074 . 1 1 90 90 GLY C C 13 174.2 0.2 . 1 . . . A 90 GLY C . 17530 1 1075 . 1 1 90 90 GLY CA C 13 46.6 0.2 . 1 . . . A 90 GLY CA . 17530 1 1076 . 1 1 90 90 GLY N N 15 108.1 0.2 . 1 . . . A 90 GLY N . 17530 1 1077 . 1 1 91 91 SER H H 1 7.82 0.02 . 1 . . . A 91 SER H . 17530 1 1078 . 1 1 91 91 SER HA H 1 4.45 0.02 . 1 . . . A 91 SER HA . 17530 1 1079 . 1 1 91 91 SER HB2 H 1 3.79 0.02 . 2 . . . A 91 SER HB2 . 17530 1 1080 . 1 1 91 91 SER HB3 H 1 4.2 0.02 . 2 . . . A 91 SER HB3 . 17530 1 1081 . 1 1 91 91 SER HG H 1 6.06 0.02 . 1 . . . A 91 SER HG . 17530 1 1082 . 1 1 91 91 SER C C 13 173.2 0.2 . 1 . . . A 91 SER C . 17530 1 1083 . 1 1 91 91 SER CA C 13 60.9 0.2 . 1 . . . A 91 SER CA . 17530 1 1084 . 1 1 91 91 SER CB C 13 64.9 0.2 . 1 . . . A 91 SER CB . 17530 1 1085 . 1 1 91 91 SER N N 15 113.7 0.2 . 1 . . . A 91 SER N . 17530 1 1086 . 1 1 92 92 SER H H 1 8.68 0.02 . 1 . . . A 92 SER H . 17530 1 1087 . 1 1 92 92 SER HA H 1 5.21 0.02 . 1 . . . A 92 SER HA . 17530 1 1088 . 1 1 92 92 SER HB2 H 1 3.85 0.02 . 2 . . . A 92 SER HB2 . 17530 1 1089 . 1 1 92 92 SER HB3 H 1 4.64 0.02 . 2 . . . A 92 SER HB3 . 17530 1 1090 . 1 1 92 92 SER C C 13 172.3 0.2 . 1 . . . A 92 SER C . 17530 1 1091 . 1 1 92 92 SER CA C 13 57.6 0.2 . 1 . . . A 92 SER CA . 17530 1 1092 . 1 1 92 92 SER CB C 13 67.4 0.2 . 1 . . . A 92 SER CB . 17530 1 1093 . 1 1 92 92 SER N N 15 119.7 0.2 . 1 . . . A 92 SER N . 17530 1 1094 . 1 1 93 93 LEU H H 1 8.90 0.02 . 1 . . . A 93 LEU H . 17530 1 1095 . 1 1 93 93 LEU HA H 1 4.77 0.02 . 1 . . . A 93 LEU HA . 17530 1 1096 . 1 1 93 93 LEU HB2 H 1 1.13 0.02 . 2 . . . A 93 LEU HB2 . 17530 1 1097 . 1 1 93 93 LEU HB3 H 1 1.8 0.02 . 2 . . . A 93 LEU HB3 . 17530 1 1098 . 1 1 93 93 LEU HG H 1 1.18 0.02 . 1 . . . A 93 LEU HG . 17530 1 1099 . 1 1 93 93 LEU HD11 H 1 0.61 0.02 . 2 . . . A 93 LEU HD11 . 17530 1 1100 . 1 1 93 93 LEU HD12 H 1 0.61 0.02 . 2 . . . A 93 LEU HD12 . 17530 1 1101 . 1 1 93 93 LEU HD13 H 1 0.61 0.02 . 2 . . . A 93 LEU HD13 . 17530 1 1102 . 1 1 93 93 LEU HD21 H 1 0.7 0.02 . 2 . . . A 93 LEU HD21 . 17530 1 1103 . 1 1 93 93 LEU HD22 H 1 0.7 0.02 . 2 . . . A 93 LEU HD22 . 17530 1 1104 . 1 1 93 93 LEU HD23 H 1 0.7 0.02 . 2 . . . A 93 LEU HD23 . 17530 1 1105 . 1 1 93 93 LEU C C 13 173 0.2 . 1 . . . A 93 LEU C . 17530 1 1106 . 1 1 93 93 LEU CA C 13 55.2 0.2 . 1 . . . A 93 LEU CA . 17530 1 1107 . 1 1 93 93 LEU CB C 13 45.5 0.2 . 1 . . . A 93 LEU CB . 17530 1 1108 . 1 1 93 93 LEU CG C 13 27.5 0.2 . 1 . . . A 93 LEU CG . 17530 1 1109 . 1 1 93 93 LEU CD1 C 13 21.9 0.2 . 2 . . . A 93 LEU CD1 . 17530 1 1110 . 1 1 93 93 LEU CD2 C 13 25.7 0.2 . 2 . . . A 93 LEU CD2 . 17530 1 1111 . 1 1 93 93 LEU N N 15 123.1 0.2 . 1 . . . A 93 LEU N . 17530 1 1112 . 1 1 94 94 VAL H H 1 8.84 0.02 . 1 . . . A 94 VAL H . 17530 1 1113 . 1 1 94 94 VAL HA H 1 3.95 0.02 . 1 . . . A 94 VAL HA . 17530 1 1114 . 1 1 94 94 VAL HB H 1 0.50 0.02 . 1 . . . A 94 VAL HB . 17530 1 1115 . 1 1 94 94 VAL HG11 H 1 0.16 0.02 . 2 . . . A 94 VAL HG11 . 17530 1 1116 . 1 1 94 94 VAL HG12 H 1 0.16 0.02 . 2 . . . A 94 VAL HG12 . 17530 1 1117 . 1 1 94 94 VAL HG13 H 1 0.16 0.02 . 2 . . . A 94 VAL HG13 . 17530 1 1118 . 1 1 94 94 VAL HG21 H 1 -0.39 0.02 . 2 . . . A 94 VAL HG21 . 17530 1 1119 . 1 1 94 94 VAL HG22 H 1 -0.39 0.02 . 2 . . . A 94 VAL HG22 . 17530 1 1120 . 1 1 94 94 VAL HG23 H 1 -0.39 0.02 . 2 . . . A 94 VAL HG23 . 17530 1 1121 . 1 1 94 94 VAL C C 13 174.3 0.2 . 1 . . . A 94 VAL C . 17530 1 1122 . 1 1 94 94 VAL CA C 13 61.7 0.2 . 1 . . . A 94 VAL CA . 17530 1 1123 . 1 1 94 94 VAL CB C 13 31.8 0.2 . 1 . . . A 94 VAL CB . 17530 1 1124 . 1 1 94 94 VAL CG1 C 13 21.3 0.2 . 2 . . . A 94 VAL CG1 . 17530 1 1125 . 1 1 94 94 VAL CG2 C 13 19.7 0.2 . 2 . . . A 94 VAL CG2 . 17530 1 1126 . 1 1 94 94 VAL N N 15 129 0.2 . 1 . . . A 94 VAL N . 17530 1 1127 . 1 1 95 95 GLU H H 1 8.77 0.02 . 1 . . . A 95 GLU H . 17530 1 1128 . 1 1 95 95 GLU HA H 1 4.64 0.02 . 1 . . . A 95 GLU HA . 17530 1 1129 . 1 1 95 95 GLU HB2 H 1 1.97 0.02 . 2 . . . A 95 GLU HB2 . 17530 1 1130 . 1 1 95 95 GLU HB3 H 1 1.97 0.02 . 2 . . . A 95 GLU HB3 . 17530 1 1131 . 1 1 95 95 GLU HG2 H 1 1.97 0.02 . 2 . . . A 95 GLU HG2 . 17530 1 1132 . 1 1 95 95 GLU HG3 H 1 1.97 0.02 . 2 . . . A 95 GLU HG3 . 17530 1 1133 . 1 1 95 95 GLU C C 13 174.7 0.2 . 1 . . . A 95 GLU C . 17530 1 1134 . 1 1 95 95 GLU CA C 13 55.0 0.2 . 1 . . . A 95 GLU CA . 17530 1 1135 . 1 1 95 95 GLU CB C 13 34.6 0.2 . 1 . . . A 95 GLU CB . 17530 1 1136 . 1 1 95 95 GLU CG C 13 37.6 0.2 . 1 . . . A 95 GLU CG . 17530 1 1137 . 1 1 95 95 GLU N N 15 124 0.2 . 1 . . . A 95 GLU N . 17530 1 1138 . 1 1 96 96 ILE H H 1 9.30 0.02 . 1 . . . A 96 ILE H . 17530 1 1139 . 1 1 96 96 ILE HA H 1 4.84 0.02 . 1 . . . A 96 ILE HA . 17530 1 1140 . 1 1 96 96 ILE HB H 1 1.77 0.02 . 1 . . . A 96 ILE HB . 17530 1 1141 . 1 1 96 96 ILE HG12 H 1 0.72 0.02 . 2 . . . A 96 ILE HG12 . 17530 1 1142 . 1 1 96 96 ILE HG13 H 1 1.29 0.02 . 2 . . . A 96 ILE HG13 . 17530 1 1143 . 1 1 96 96 ILE HG21 H 1 0.66 0.02 . 1 . . . A 96 ILE HG21 . 17530 1 1144 . 1 1 96 96 ILE HG22 H 1 0.66 0.02 . 1 . . . A 96 ILE HG22 . 17530 1 1145 . 1 1 96 96 ILE HG23 H 1 0.66 0.02 . 1 . . . A 96 ILE HG23 . 17530 1 1146 . 1 1 96 96 ILE HD11 H 1 0.75 0.02 . 1 . . . A 96 ILE HD11 . 17530 1 1147 . 1 1 96 96 ILE HD12 H 1 0.75 0.02 . 1 . . . A 96 ILE HD12 . 17530 1 1148 . 1 1 96 96 ILE HD13 H 1 0.75 0.02 . 1 . . . A 96 ILE HD13 . 17530 1 1149 . 1 1 96 96 ILE C C 13 173.8 0.2 . 1 . . . A 96 ILE C . 17530 1 1150 . 1 1 96 96 ILE CA C 13 59.9 0.2 . 1 . . . A 96 ILE CA . 17530 1 1151 . 1 1 96 96 ILE CB C 13 41.3 0.2 . 1 . . . A 96 ILE CB . 17530 1 1152 . 1 1 96 96 ILE CG1 C 13 28 0.2 . 1 . . . A 96 ILE CG1 . 17530 1 1153 . 1 1 96 96 ILE CG2 C 13 17.9 0.2 . 1 . . . A 96 ILE CG2 . 17530 1 1154 . 1 1 96 96 ILE CD1 C 13 13.9 0.2 . 1 . . . A 96 ILE CD1 . 17530 1 1155 . 1 1 96 96 ILE N N 15 123.8 0.2 . 1 . . . A 96 ILE N . 17530 1 1156 . 1 1 97 97 ASP H H 1 8.73 0.02 . 1 . . . A 97 ASP H . 17530 1 1157 . 1 1 97 97 ASP HA H 1 5.62 0.02 . 1 . . . A 97 ASP HA . 17530 1 1158 . 1 1 97 97 ASP HB2 H 1 2.46 0.02 . 2 . . . A 97 ASP HB2 . 17530 1 1159 . 1 1 97 97 ASP HB3 H 1 2.66 0.02 . 2 . . . A 97 ASP HB3 . 17530 1 1160 . 1 1 97 97 ASP C C 13 174.8 0.2 . 1 . . . A 97 ASP C . 17530 1 1161 . 1 1 97 97 ASP CA C 13 53.1 0.2 . 1 . . . A 97 ASP CA . 17530 1 1162 . 1 1 97 97 ASP CB C 13 44.8 0.2 . 1 . . . A 97 ASP CB . 17530 1 1163 . 1 1 97 97 ASP N N 15 125.4 0.2 . 1 . . . A 97 ASP N . 17530 1 1164 . 1 1 98 98 LEU H H 1 8.84 0.02 . 1 . . . A 98 LEU H . 17530 1 1165 . 1 1 98 98 LEU HA H 1 5.07 0.02 . 1 . . . A 98 LEU HA . 17530 1 1166 . 1 1 98 98 LEU HB2 H 1 1.17 0.02 . 2 . . . A 98 LEU HB2 . 17530 1 1167 . 1 1 98 98 LEU HB3 H 1 2.37 0.02 . 2 . . . A 98 LEU HB3 . 17530 1 1168 . 1 1 98 98 LEU HG H 1 1.51 0.02 . 1 . . . A 98 LEU HG . 17530 1 1169 . 1 1 98 98 LEU HD11 H 1 1.00 0.02 . 2 . . . A 98 LEU HD11 . 17530 1 1170 . 1 1 98 98 LEU HD12 H 1 1.00 0.02 . 2 . . . A 98 LEU HD12 . 17530 1 1171 . 1 1 98 98 LEU HD13 H 1 1.00 0.02 . 2 . . . A 98 LEU HD13 . 17530 1 1172 . 1 1 98 98 LEU HD21 H 1 0.77 0.02 . 2 . . . A 98 LEU HD21 . 17530 1 1173 . 1 1 98 98 LEU HD22 H 1 0.77 0.02 . 2 . . . A 98 LEU HD22 . 17530 1 1174 . 1 1 98 98 LEU HD23 H 1 0.77 0.02 . 2 . . . A 98 LEU HD23 . 17530 1 1175 . 1 1 98 98 LEU C C 13 175.7 0.2 . 1 . . . A 98 LEU C . 17530 1 1176 . 1 1 98 98 LEU CA C 13 53.7 0.2 . 1 . . . A 98 LEU CA . 17530 1 1177 . 1 1 98 98 LEU CB C 13 42.9 0.2 . 1 . . . A 98 LEU CB . 17530 1 1178 . 1 1 98 98 LEU CG C 13 27.3 0.2 . 1 . . . A 98 LEU CG . 17530 1 1179 . 1 1 98 98 LEU CD1 C 13 25.7 0.2 . 2 . . . A 98 LEU CD1 . 17530 1 1180 . 1 1 98 98 LEU CD2 C 13 25.2 0.2 . 2 . . . A 98 LEU CD2 . 17530 1 1181 . 1 1 98 98 LEU N N 15 120.9 0.2 . 1 . . . A 98 LEU N . 17530 1 1182 . 1 1 99 99 ILE H H 1 9.04 0.02 . 1 . . . A 99 ILE H . 17530 1 1183 . 1 1 99 99 ILE HA H 1 4.35 0.02 . 1 . . . A 99 ILE HA . 17530 1 1184 . 1 1 99 99 ILE HB H 1 1.95 0.02 . 1 . . . A 99 ILE HB . 17530 1 1185 . 1 1 99 99 ILE HG12 H 1 1.21 0.02 . 2 . . . A 99 ILE HG12 . 17530 1 1186 . 1 1 99 99 ILE HG13 H 1 1.43 0.02 . 2 . . . A 99 ILE HG13 . 17530 1 1187 . 1 1 99 99 ILE HG21 H 1 0.97 0.02 . 1 . . . A 99 ILE HG21 . 17530 1 1188 . 1 1 99 99 ILE HG22 H 1 0.97 0.02 . 1 . . . A 99 ILE HG22 . 17530 1 1189 . 1 1 99 99 ILE HG23 H 1 0.97 0.02 . 1 . . . A 99 ILE HG23 . 17530 1 1190 . 1 1 99 99 ILE HD11 H 1 0.84 0.02 . 1 . . . A 99 ILE HD11 . 17530 1 1191 . 1 1 99 99 ILE HD12 H 1 0.84 0.02 . 1 . . . A 99 ILE HD12 . 17530 1 1192 . 1 1 99 99 ILE HD13 H 1 0.84 0.02 . 1 . . . A 99 ILE HD13 . 17530 1 1193 . 1 1 99 99 ILE C C 13 175.4 0.2 . 1 . . . A 99 ILE C . 17530 1 1194 . 1 1 99 99 ILE CA C 13 60.1 0.2 . 1 . . . A 99 ILE CA . 17530 1 1195 . 1 1 99 99 ILE CB C 13 41.6 0.2 . 1 . . . A 99 ILE CB . 17530 1 1196 . 1 1 99 99 ILE CG1 C 13 28.3 0.2 . 1 . . . A 99 ILE CG1 . 17530 1 1197 . 1 1 99 99 ILE CG2 C 13 17.9 0.2 . 1 . . . A 99 ILE CG2 . 17530 1 1198 . 1 1 99 99 ILE CD1 C 13 14 0.2 . 1 . . . A 99 ILE CD1 . 17530 1 1199 . 1 1 99 99 ILE N N 15 124.5 0.2 . 1 . . . A 99 ILE N . 17530 1 1200 . 1 1 100 100 GLU H H 1 9.02 0.02 . 1 . . . A 100 GLU H . 17530 1 1201 . 1 1 100 100 GLU HA H 1 4.25 0.02 . 1 . . . A 100 GLU HA . 17530 1 1202 . 1 1 100 100 GLU HB2 H 1 2.06 0.02 . 2 . . . A 100 GLU HB2 . 17530 1 1203 . 1 1 100 100 GLU HB3 H 1 2.1 0.02 . 2 . . . A 100 GLU HB3 . 17530 1 1204 . 1 1 100 100 GLU HG2 H 1 2.39 0.02 . 2 . . . A 100 GLU HG2 . 17530 1 1205 . 1 1 100 100 GLU HG3 H 1 2.39 0.02 . 2 . . . A 100 GLU HG3 . 17530 1 1206 . 1 1 100 100 GLU C C 13 176.1 0.2 . 1 . . . A 100 GLU C . 17530 1 1207 . 1 1 100 100 GLU CA C 13 58.3 0.2 . 1 . . . A 100 GLU CA . 17530 1 1208 . 1 1 100 100 GLU CB C 13 29.8 0.2 . 1 . . . A 100 GLU CB . 17530 1 1209 . 1 1 100 100 GLU CG C 13 36.9 0.2 . 1 . . . A 100 GLU CG . 17530 1 1210 . 1 1 100 100 GLU N N 15 128.2 0.2 . 1 . . . A 100 GLU N . 17530 1 1211 . 1 1 101 101 GLN H H 1 8.00 0.02 . 1 . . . A 101 GLN H . 17530 1 1212 . 1 1 101 101 GLN HA H 1 4.53 0.02 . 1 . . . A 101 GLN HA . 17530 1 1213 . 1 1 101 101 GLN HB2 H 1 1.82 0.02 . 2 . . . A 101 GLN HB2 . 17530 1 1214 . 1 1 101 101 GLN HB3 H 1 1.93 0.02 . 2 . . . A 101 GLN HB3 . 17530 1 1215 . 1 1 101 101 GLN HG2 H 1 2.17 0.02 . 2 . . . A 101 GLN HG2 . 17530 1 1216 . 1 1 101 101 GLN HG3 H 1 2.27 0.02 . 2 . . . A 101 GLN HG3 . 17530 1 1217 . 1 1 101 101 GLN HE21 H 1 6.9 0.02 . 2 . . . A 101 GLN HE21 . 17530 1 1218 . 1 1 101 101 GLN HE22 H 1 7.52 0.02 . 2 . . . A 101 GLN HE22 . 17530 1 1219 . 1 1 101 101 GLN C C 13 176.1 0.2 . 1 . . . A 101 GLN C . 17530 1 1220 . 1 1 101 101 GLN CA C 13 55.8 0.2 . 1 . . . A 101 GLN CA . 17530 1 1221 . 1 1 101 101 GLN CB C 13 31.5 0.2 . 1 . . . A 101 GLN CB . 17530 1 1222 . 1 1 101 101 GLN CG C 13 34.3 0.2 . 1 . . . A 101 GLN CG . 17530 1 1223 . 1 1 101 101 GLN N N 15 124.9 0.2 . 1 . . . A 101 GLN N . 17530 1 1224 . 1 1 101 101 GLN NE2 N 15 112 0.2 . 1 . . . A 101 GLN NE2 . 17530 1 1225 . 1 1 102 102 GLY H H 1 9.31 0.02 . 1 . . . A 102 GLY H . 17530 1 1226 . 1 1 102 102 GLY HA2 H 1 3.89 0.02 . 2 . . . A 102 GLY HA2 . 17530 1 1227 . 1 1 102 102 GLY HA3 H 1 3.89 0.02 . 2 . . . A 102 GLY HA3 . 17530 1 1228 . 1 1 102 102 GLY C C 13 175.4 0.2 . 1 . . . A 102 GLY C . 17530 1 1229 . 1 1 102 102 GLY CA C 13 47.4 0.2 . 1 . . . A 102 GLY CA . 17530 1 1230 . 1 1 102 102 GLY N N 15 118.2 0.2 . 1 . . . A 102 GLY N . 17530 1 1231 . 1 1 103 103 GLY H H 1 8.91 0.02 . 1 . . . A 103 GLY H . 17530 1 1232 . 1 1 103 103 GLY HA2 H 1 3.96 0.02 . 2 . . . A 103 GLY HA2 . 17530 1 1233 . 1 1 103 103 GLY HA3 H 1 4.07 0.02 . 2 . . . A 103 GLY HA3 . 17530 1 1234 . 1 1 103 103 GLY C C 13 173.8 0.2 . 1 . . . A 103 GLY C . 17530 1 1235 . 1 1 103 103 GLY CA C 13 45.4 0.2 . 1 . . . A 103 GLY CA . 17530 1 1236 . 1 1 103 103 GLY N N 15 111.7 0.2 . 1 . . . A 103 GLY N . 17530 1 1237 . 1 1 104 104 GLY H H 1 7.82 0.02 . 1 . . . A 104 GLY H . 17530 1 1238 . 1 1 104 104 GLY HA2 H 1 3.83 0.02 . 2 . . . A 104 GLY HA2 . 17530 1 1239 . 1 1 104 104 GLY HA3 H 1 4.21 0.02 . 2 . . . A 104 GLY HA3 . 17530 1 1240 . 1 1 104 104 GLY C C 13 174.1 0.2 . 1 . . . A 104 GLY C . 17530 1 1241 . 1 1 104 104 GLY CA C 13 44.5 0.2 . 1 . . . A 104 GLY CA . 17530 1 1242 . 1 1 104 104 GLY N N 15 109.5 0.2 . 1 . . . A 104 GLY N . 17530 1 1243 . 1 1 105 105 THR H H 1 8.76 0.02 . 1 . . . A 105 THR H . 17530 1 1244 . 1 1 105 105 THR HA H 1 4.89 0.02 . 1 . . . A 105 THR HA . 17530 1 1245 . 1 1 105 105 THR HB H 1 3.70 0.02 . 1 . . . A 105 THR HB . 17530 1 1246 . 1 1 105 105 THR HG1 H 1 6.07 0.02 . 1 . . . A 105 THR HG1 . 17530 1 1247 . 1 1 105 105 THR HG21 H 1 0.97 0.02 . 1 . . . A 105 THR HG21 . 17530 1 1248 . 1 1 105 105 THR HG22 H 1 0.97 0.02 . 1 . . . A 105 THR HG22 . 17530 1 1249 . 1 1 105 105 THR HG23 H 1 0.97 0.02 . 1 . . . A 105 THR HG23 . 17530 1 1250 . 1 1 105 105 THR C C 13 172.7 0.2 . 1 . . . A 105 THR C . 17530 1 1251 . 1 1 105 105 THR CA C 13 63.1 0.2 . 1 . . . A 105 THR CA . 17530 1 1252 . 1 1 105 105 THR CB C 13 72.8 0.2 . 1 . . . A 105 THR CB . 17530 1 1253 . 1 1 105 105 THR CG2 C 13 23.1 0.2 . 1 . . . A 105 THR CG2 . 17530 1 1254 . 1 1 105 105 THR N N 15 121.1 0.2 . 1 . . . A 105 THR N . 17530 1 1255 . 1 1 106 106 LEU H H 1 9.65 0.02 . 1 . . . A 106 LEU H . 17530 1 1256 . 1 1 106 106 LEU HA H 1 4.76 0.02 . 1 . . . A 106 LEU HA . 17530 1 1257 . 1 1 106 106 LEU HB2 H 1 1.22 0.02 . 2 . . . A 106 LEU HB2 . 17530 1 1258 . 1 1 106 106 LEU HB3 H 1 1.79 0.02 . 2 . . . A 106 LEU HB3 . 17530 1 1259 . 1 1 106 106 LEU HG H 1 1.22 0.02 . 1 . . . A 106 LEU HG . 17530 1 1260 . 1 1 106 106 LEU HD11 H 1 0.62 0.02 . 2 . . . A 106 LEU HD11 . 17530 1 1261 . 1 1 106 106 LEU HD12 H 1 0.62 0.02 . 2 . . . A 106 LEU HD12 . 17530 1 1262 . 1 1 106 106 LEU HD13 H 1 0.62 0.02 . 2 . . . A 106 LEU HD13 . 17530 1 1263 . 1 1 106 106 LEU HD21 H 1 0.76 0.02 . 2 . . . A 106 LEU HD21 . 17530 1 1264 . 1 1 106 106 LEU HD22 H 1 0.76 0.02 . 2 . . . A 106 LEU HD22 . 17530 1 1265 . 1 1 106 106 LEU HD23 H 1 0.76 0.02 . 2 . . . A 106 LEU HD23 . 17530 1 1266 . 1 1 106 106 LEU C C 13 173.2 0.2 . 1 . . . A 106 LEU C . 17530 1 1267 . 1 1 106 106 LEU CA C 13 54.2 0.2 . 1 . . . A 106 LEU CA . 17530 1 1268 . 1 1 106 106 LEU CB C 13 42.7 0.2 . 1 . . . A 106 LEU CB . 17530 1 1269 . 1 1 106 106 LEU CG C 13 27.5 0.2 . 1 . . . A 106 LEU CG . 17530 1 1270 . 1 1 106 106 LEU CD1 C 13 22.9 0.2 . 2 . . . A 106 LEU CD1 . 17530 1 1271 . 1 1 106 106 LEU CD2 C 13 25.5 0.2 . 2 . . . A 106 LEU CD2 . 17530 1 1272 . 1 1 106 106 LEU N N 15 129.7 0.2 . 1 . . . A 106 LEU N . 17530 1 1273 . 1 1 107 107 LEU H H 1 9.12 0.02 . 1 . . . A 107 LEU H . 17530 1 1274 . 1 1 107 107 LEU HA H 1 4.94 0.02 . 1 . . . A 107 LEU HA . 17530 1 1275 . 1 1 107 107 LEU HB2 H 1 1.24 0.02 . 2 . . . A 107 LEU HB2 . 17530 1 1276 . 1 1 107 107 LEU HB3 H 1 1.54 0.02 . 2 . . . A 107 LEU HB3 . 17530 1 1277 . 1 1 107 107 LEU HG H 1 1.37 0.02 . 1 . . . A 107 LEU HG . 17530 1 1278 . 1 1 107 107 LEU HD11 H 1 0.59 0.02 . 2 . . . A 107 LEU HD11 . 17530 1 1279 . 1 1 107 107 LEU HD12 H 1 0.59 0.02 . 2 . . . A 107 LEU HD12 . 17530 1 1280 . 1 1 107 107 LEU HD13 H 1 0.59 0.02 . 2 . . . A 107 LEU HD13 . 17530 1 1281 . 1 1 107 107 LEU HD21 H 1 0.53 0.02 . 2 . . . A 107 LEU HD21 . 17530 1 1282 . 1 1 107 107 LEU HD22 H 1 0.53 0.02 . 2 . . . A 107 LEU HD22 . 17530 1 1283 . 1 1 107 107 LEU HD23 H 1 0.53 0.02 . 2 . . . A 107 LEU HD23 . 17530 1 1284 . 1 1 107 107 LEU C C 13 174.9 0.2 . 1 . . . A 107 LEU C . 17530 1 1285 . 1 1 107 107 LEU CA C 13 54.1 0.2 . 1 . . . A 107 LEU CA . 17530 1 1286 . 1 1 107 107 LEU CB C 13 45.1 0.2 . 1 . . . A 107 LEU CB . 17530 1 1287 . 1 1 107 107 LEU CG C 13 27.9 0.2 . 1 . . . A 107 LEU CG . 17530 1 1288 . 1 1 107 107 LEU CD1 C 13 28.9 0.2 . 2 . . . A 107 LEU CD1 . 17530 1 1289 . 1 1 107 107 LEU CD2 C 13 25.4 0.2 . 2 . . . A 107 LEU CD2 . 17530 1 1290 . 1 1 107 107 LEU N N 15 131.7 0.2 . 1 . . . A 107 LEU N . 17530 1 1291 . 1 1 108 108 ARG H H 1 9.13 0.02 . 1 . . . A 108 ARG H . 17530 1 1292 . 1 1 108 108 ARG HA H 1 4.8 0.02 . 1 . . . A 108 ARG HA . 17530 1 1293 . 1 1 108 108 ARG HB2 H 1 1.7 0.02 . 2 . . . A 108 ARG HB2 . 17530 1 1294 . 1 1 108 108 ARG HB3 H 1 1.87 0.02 . 2 . . . A 108 ARG HB3 . 17530 1 1295 . 1 1 108 108 ARG HG2 H 1 1.52 0.02 . 2 . . . A 108 ARG HG2 . 17530 1 1296 . 1 1 108 108 ARG HG3 H 1 1.52 0.02 . 2 . . . A 108 ARG HG3 . 17530 1 1297 . 1 1 108 108 ARG HD2 H 1 3.13 0.02 . 2 . . . A 108 ARG HD2 . 17530 1 1298 . 1 1 108 108 ARG HD3 H 1 3.13 0.02 . 2 . . . A 108 ARG HD3 . 17530 1 1299 . 1 1 108 108 ARG HE H 1 7.33 0.02 . 1 . . . A 108 ARG HE . 17530 1 1300 . 1 1 108 108 ARG C C 13 173.4 0.2 . 1 . . . A 108 ARG C . 17530 1 1301 . 1 1 108 108 ARG CA C 13 56 0.2 . 1 . . . A 108 ARG CA . 17530 1 1302 . 1 1 108 108 ARG CB C 13 32.5 0.2 . 1 . . . A 108 ARG CB . 17530 1 1303 . 1 1 108 108 ARG CG C 13 28.2 0.2 . 1 . . . A 108 ARG CG . 17530 1 1304 . 1 1 108 108 ARG CD C 13 43.7 0.2 . 1 . . . A 108 ARG CD . 17530 1 1305 . 1 1 108 108 ARG N N 15 125.6 0.2 . 1 . . . A 108 ARG N . 17530 1 1306 . 1 1 108 108 ARG NE N 15 84.9 0.2 . 1 . . . A 108 ARG NE . 17530 1 1307 . 1 1 109 109 LEU H H 1 8.87 0.02 . 1 . . . A 109 LEU H . 17530 1 1308 . 1 1 109 109 LEU HA H 1 4.93 0.02 . 1 . . . A 109 LEU HA . 17530 1 1309 . 1 1 109 109 LEU HB2 H 1 0.85 0.02 . 2 . . . A 109 LEU HB2 . 17530 1 1310 . 1 1 109 109 LEU HB3 H 1 1.21 0.02 . 2 . . . A 109 LEU HB3 . 17530 1 1311 . 1 1 109 109 LEU HG H 1 0.71 0.02 . 1 . . . A 109 LEU HG . 17530 1 1312 . 1 1 109 109 LEU HD11 H 1 -0.43 0.02 . 2 . . . A 109 LEU HD11 . 17530 1 1313 . 1 1 109 109 LEU HD12 H 1 -0.43 0.02 . 2 . . . A 109 LEU HD12 . 17530 1 1314 . 1 1 109 109 LEU HD13 H 1 -0.43 0.02 . 2 . . . A 109 LEU HD13 . 17530 1 1315 . 1 1 109 109 LEU HD21 H 1 -0.43 0.02 . 2 . . . A 109 LEU HD21 . 17530 1 1316 . 1 1 109 109 LEU HD22 H 1 -0.43 0.02 . 2 . . . A 109 LEU HD22 . 17530 1 1317 . 1 1 109 109 LEU HD23 H 1 -0.43 0.02 . 2 . . . A 109 LEU HD23 . 17530 1 1318 . 1 1 109 109 LEU C C 13 175.7 0.2 . 1 . . . A 109 LEU C . 17530 1 1319 . 1 1 109 109 LEU CA C 13 53.6 0.2 . 1 . . . A 109 LEU CA . 17530 1 1320 . 1 1 109 109 LEU CB C 13 45.4 0.2 . 1 . . . A 109 LEU CB . 17530 1 1321 . 1 1 109 109 LEU CG C 13 27.1 0.2 . 1 . . . A 109 LEU CG . 17530 1 1322 . 1 1 109 109 LEU CD1 C 13 24.6 0.2 . 2 . . . A 109 LEU CD1 . 17530 1 1323 . 1 1 109 109 LEU CD2 C 13 24.2 0.2 . 2 . . . A 109 LEU CD2 . 17530 1 1324 . 1 1 109 109 LEU N N 15 129.0 0.2 . 1 . . . A 109 LEU N . 17530 1 1325 . 1 1 110 110 THR H H 1 9.01 0.02 . 1 . . . A 110 THR H . 17530 1 1326 . 1 1 110 110 THR HA H 1 4.97 0.02 . 1 . . . A 110 THR HA . 17530 1 1327 . 1 1 110 110 THR HB H 1 3.96 0.02 . 1 . . . A 110 THR HB . 17530 1 1328 . 1 1 110 110 THR HG21 H 1 1.12 0.02 . 1 . . . A 110 THR HG21 . 17530 1 1329 . 1 1 110 110 THR HG22 H 1 1.12 0.02 . 1 . . . A 110 THR HG22 . 17530 1 1330 . 1 1 110 110 THR HG23 H 1 1.12 0.02 . 1 . . . A 110 THR HG23 . 17530 1 1331 . 1 1 110 110 THR C C 13 173.1 0.2 . 1 . . . A 110 THR C . 17530 1 1332 . 1 1 110 110 THR CA C 13 62 0.2 . 1 . . . A 110 THR CA . 17530 1 1333 . 1 1 110 110 THR CB C 13 70.8 0.2 . 1 . . . A 110 THR CB . 17530 1 1334 . 1 1 110 110 THR CG2 C 13 21.8 0.2 . 1 . . . A 110 THR CG2 . 17530 1 1335 . 1 1 110 110 THR N N 15 123.3 0.2 . 1 . . . A 110 THR N . 17530 1 1336 . 1 1 111 111 HIS H H 1 9.82 0.02 . 1 . . . A 111 HIS H . 17530 1 1337 . 1 1 111 111 HIS HA H 1 5.93 0.02 . 1 . . . A 111 HIS HA . 17530 1 1338 . 1 1 111 111 HIS HB2 H 1 2.35 0.02 . 2 . . . A 111 HIS HB2 . 17530 1 1339 . 1 1 111 111 HIS HB3 H 1 3.32 0.02 . 2 . . . A 111 HIS HB3 . 17530 1 1340 . 1 1 111 111 HIS HD2 H 1 7.08 0.02 . 1 . . . A 111 HIS HD2 . 17530 1 1341 . 1 1 111 111 HIS HE1 H 1 8.21 0.02 . 1 . . . A 111 HIS HE1 . 17530 1 1342 . 1 1 111 111 HIS C C 13 174.6 0.2 . 1 . . . A 111 HIS C . 17530 1 1343 . 1 1 111 111 HIS CA C 13 52.9 0.2 . 1 . . . A 111 HIS CA . 17530 1 1344 . 1 1 111 111 HIS CB C 13 33.5 0.2 . 1 . . . A 111 HIS CB . 17530 1 1345 . 1 1 111 111 HIS CD2 C 13 115.3 0.2 . 1 . . . A 111 HIS CD2 . 17530 1 1346 . 1 1 111 111 HIS CE1 C 13 137.2 0.2 . 1 . . . A 111 HIS CE1 . 17530 1 1347 . 1 1 111 111 HIS N N 15 131.7 0.2 . 1 . . . A 111 HIS N . 17530 1 1348 . 1 1 111 111 HIS ND1 N 15 200.4 0.2 . 1 . . . A 111 HIS ND1 . 17530 1 1349 . 1 1 111 111 HIS NE2 N 15 176.7 0.2 . 1 . . . A 111 HIS NE2 . 17530 1 1350 . 1 1 112 112 SER H H 1 9.83 0.02 . 1 . . . A 112 SER H . 17530 1 1351 . 1 1 112 112 SER HA H 1 5.28 0.02 . 1 . . . A 112 SER HA . 17530 1 1352 . 1 1 112 112 SER HB2 H 1 3.86 0.02 . 2 . . . A 112 SER HB2 . 17530 1 1353 . 1 1 112 112 SER HB3 H 1 4.04 0.02 . 2 . . . A 112 SER HB3 . 17530 1 1354 . 1 1 112 112 SER C C 13 174.8 0.2 . 1 . . . A 112 SER C . 17530 1 1355 . 1 1 112 112 SER CA C 13 57.5 0.2 . 1 . . . A 112 SER CA . 17530 1 1356 . 1 1 112 112 SER CB C 13 66.6 0.2 . 1 . . . A 112 SER CB . 17530 1 1357 . 1 1 112 112 SER N N 15 121.4 0.2 . 1 . . . A 112 SER N . 17530 1 1358 . 1 1 113 113 GLY H H 1 8.76 0.02 . 1 . . . A 113 GLY H . 17530 1 1359 . 1 1 113 113 GLY HA2 H 1 3.89 0.02 . 2 . . . A 113 GLY HA2 . 17530 1 1360 . 1 1 113 113 GLY HA3 H 1 4.33 0.02 . 2 . . . A 113 GLY HA3 . 17530 1 1361 . 1 1 113 113 GLY C C 13 175.3 0.2 . 1 . . . A 113 GLY C . 17530 1 1362 . 1 1 113 113 GLY CA C 13 46.3 0.2 . 1 . . . A 113 GLY CA . 17530 1 1363 . 1 1 113 113 GLY N N 15 107.5 0.2 . 1 . . . A 113 GLY N . 17530 1 1364 . 1 1 114 114 LEU H H 1 8.2 0.02 . 1 . . . A 114 LEU H . 17530 1 1365 . 1 1 114 114 LEU HA H 1 4.64 0.02 . 1 . . . A 114 LEU HA . 17530 1 1366 . 1 1 114 114 LEU HB2 H 1 0.91 0.02 . 2 . . . A 114 LEU HB2 . 17530 1 1367 . 1 1 114 114 LEU HB3 H 1 1.92 0.02 . 2 . . . A 114 LEU HB3 . 17530 1 1368 . 1 1 114 114 LEU HG H 1 1.1 0.02 . 1 . . . A 114 LEU HG . 17530 1 1369 . 1 1 114 114 LEU HD11 H 1 0.23 0.02 . 2 . . . A 114 LEU HD11 . 17530 1 1370 . 1 1 114 114 LEU HD12 H 1 0.23 0.02 . 2 . . . A 114 LEU HD12 . 17530 1 1371 . 1 1 114 114 LEU HD13 H 1 0.23 0.02 . 2 . . . A 114 LEU HD13 . 17530 1 1372 . 1 1 114 114 LEU HD21 H 1 0.27 0.02 . 2 . . . A 114 LEU HD21 . 17530 1 1373 . 1 1 114 114 LEU HD22 H 1 0.27 0.02 . 2 . . . A 114 LEU HD22 . 17530 1 1374 . 1 1 114 114 LEU HD23 H 1 0.27 0.02 . 2 . . . A 114 LEU HD23 . 17530 1 1375 . 1 1 114 114 LEU CA C 13 52.7 0.2 . 1 . . . A 114 LEU CA . 17530 1 1376 . 1 1 114 114 LEU CB C 13 41.3 0.2 . 1 . . . A 114 LEU CB . 17530 1 1377 . 1 1 114 114 LEU CG C 13 27.8 0.2 . 1 . . . A 114 LEU CG . 17530 1 1378 . 1 1 114 114 LEU CD1 C 13 25.6 0.2 . 2 . . . A 114 LEU CD1 . 17530 1 1379 . 1 1 114 114 LEU CD2 C 13 22.4 0.2 . 2 . . . A 114 LEU CD2 . 17530 1 1380 . 1 1 114 114 LEU N N 15 121.2 0.2 . 1 . . . A 114 LEU N . 17530 1 1381 . 1 1 115 115 PRO HA H 1 4.76 0.02 . 1 . . . A 115 PRO HA . 17530 1 1382 . 1 1 115 115 PRO HB2 H 1 2.44 0.02 . 2 . . . A 115 PRO HB2 . 17530 1 1383 . 1 1 115 115 PRO HB3 H 1 2.24 0.02 . 2 . . . A 115 PRO HB3 . 17530 1 1384 . 1 1 115 115 PRO HG2 H 1 1.77 0.02 . 2 . . . A 115 PRO HG2 . 17530 1 1385 . 1 1 115 115 PRO HG3 H 1 2.53 0.02 . 2 . . . A 115 PRO HG3 . 17530 1 1386 . 1 1 115 115 PRO HD2 H 1 4.14 0.02 . 2 . . . A 115 PRO HD2 . 17530 1 1387 . 1 1 115 115 PRO HD3 H 1 3.26 0.02 . 2 . . . A 115 PRO HD3 . 17530 1 1388 . 1 1 115 115 PRO C C 13 175.7 0.2 . 1 . . . A 115 PRO C . 17530 1 1389 . 1 1 115 115 PRO CA C 13 65.1 0.2 . 1 . . . A 115 PRO CA . 17530 1 1390 . 1 1 115 115 PRO CB C 13 33 0.2 . 1 . . . A 115 PRO CB . 17530 1 1391 . 1 1 115 115 PRO CG C 13 27.1 0.2 . 1 . . . A 115 PRO CG . 17530 1 1392 . 1 1 115 115 PRO CD C 13 50.3 0.2 . 1 . . . A 115 PRO CD . 17530 1 1393 . 1 1 116 116 SER H H 1 6.76 0.02 . 1 . . . A 116 SER H . 17530 1 1394 . 1 1 116 116 SER HA H 1 4.24 0.02 . 1 . . . A 116 SER HA . 17530 1 1395 . 1 1 116 116 SER HB2 H 1 3.83 0.02 . 2 . . . A 116 SER HB2 . 17530 1 1396 . 1 1 116 116 SER HB3 H 1 4.09 0.02 . 2 . . . A 116 SER HB3 . 17530 1 1397 . 1 1 116 116 SER C C 13 173.2 0.2 . 1 . . . A 116 SER C . 17530 1 1398 . 1 1 116 116 SER CA C 13 55.6 0.2 . 1 . . . A 116 SER CA . 17530 1 1399 . 1 1 116 116 SER CB C 13 66.8 0.2 . 1 . . . A 116 SER CB . 17530 1 1400 . 1 1 116 116 SER N N 15 110.3 0.2 . 1 . . . A 116 SER N . 17530 1 1401 . 1 1 117 117 ALA H H 1 8.73 0.02 . 1 . . . A 117 ALA H . 17530 1 1402 . 1 1 117 117 ALA HA H 1 3.60 0.02 . 1 . . . A 117 ALA HA . 17530 1 1403 . 1 1 117 117 ALA HB1 H 1 1.36 0.02 . 1 . . . A 117 ALA HB1 . 17530 1 1404 . 1 1 117 117 ALA HB2 H 1 1.36 0.02 . 1 . . . A 117 ALA HB2 . 17530 1 1405 . 1 1 117 117 ALA HB3 H 1 1.36 0.02 . 1 . . . A 117 ALA HB3 . 17530 1 1406 . 1 1 117 117 ALA C C 13 180.4 0.2 . 1 . . . A 117 ALA C . 17530 1 1407 . 1 1 117 117 ALA CA C 13 54.9 0.2 . 1 . . . A 117 ALA CA . 17530 1 1408 . 1 1 117 117 ALA CB C 13 17.9 0.2 . 1 . . . A 117 ALA CB . 17530 1 1409 . 1 1 117 117 ALA N N 15 125.8 0.2 . 1 . . . A 117 ALA N . 17530 1 1410 . 1 1 118 118 GLU H H 1 8.84 0.02 . 1 . . . A 118 GLU H . 17530 1 1411 . 1 1 118 118 GLU HA H 1 4.08 0.02 . 1 . . . A 118 GLU HA . 17530 1 1412 . 1 1 118 118 GLU HB2 H 1 1.88 0.02 . 2 . . . A 118 GLU HB2 . 17530 1 1413 . 1 1 118 118 GLU HB3 H 1 2.05 0.02 . 2 . . . A 118 GLU HB3 . 17530 1 1414 . 1 1 118 118 GLU HG2 H 1 2.24 0.02 . 2 . . . A 118 GLU HG2 . 17530 1 1415 . 1 1 118 118 GLU HG3 H 1 2.24 0.02 . 2 . . . A 118 GLU HG3 . 17530 1 1416 . 1 1 118 118 GLU C C 13 180.1 0.2 . 1 . . . A 118 GLU C . 17530 1 1417 . 1 1 118 118 GLU CA C 13 60 0.2 . 1 . . . A 118 GLU CA . 17530 1 1418 . 1 1 118 118 GLU CB C 13 29.2 0.2 . 1 . . . A 118 GLU CB . 17530 1 1419 . 1 1 118 118 GLU CG C 13 36.7 0.2 . 1 . . . A 118 GLU CG . 17530 1 1420 . 1 1 118 118 GLU N N 15 119.47 0.2 . 1 . . . A 118 GLU N . 17530 1 1421 . 1 1 119 119 GLN H H 1 7.81 0.02 . 1 . . . A 119 GLN H . 17530 1 1422 . 1 1 119 119 GLN HA H 1 4.28 0.02 . 1 . . . A 119 GLN HA . 17530 1 1423 . 1 1 119 119 GLN HB2 H 1 1.77 0.02 . 2 . . . A 119 GLN HB2 . 17530 1 1424 . 1 1 119 119 GLN HB3 H 1 2.31 0.02 . 2 . . . A 119 GLN HB3 . 17530 1 1425 . 1 1 119 119 GLN HG2 H 1 1.76 0.02 . 2 . . . A 119 GLN HG2 . 17530 1 1426 . 1 1 119 119 GLN HG3 H 1 1.83 0.02 . 2 . . . A 119 GLN HG3 . 17530 1 1427 . 1 1 119 119 GLN C C 13 180 0.2 . 1 . . . A 119 GLN C . 17530 1 1428 . 1 1 119 119 GLN CA C 13 57.9 0.2 . 1 . . . A 119 GLN CA . 17530 1 1429 . 1 1 119 119 GLN CB C 13 28 0.2 . 1 . . . A 119 GLN CB . 17530 1 1430 . 1 1 119 119 GLN CG C 13 33.4 0.2 . 1 . . . A 119 GLN CG . 17530 1 1431 . 1 1 119 119 GLN N N 15 117.3 0.2 . 1 . . . A 119 GLN N . 17530 1 1432 . 1 1 120 120 CYS H H 1 8.4 0.02 . 1 . . . A 120 CYS H . 17530 1 1433 . 1 1 120 120 CYS HA H 1 4.02 0.02 . 1 . . . A 120 CYS HA . 17530 1 1434 . 1 1 120 120 CYS HB2 H 1 2.8 0.02 . 2 . . . A 120 CYS HB2 . 17530 1 1435 . 1 1 120 120 CYS HB3 H 1 3.09 0.02 . 2 . . . A 120 CYS HB3 . 17530 1 1436 . 1 1 120 120 CYS C C 13 175.1 0.2 . 1 . . . A 120 CYS C . 17530 1 1437 . 1 1 120 120 CYS CA C 13 63.6 0.2 . 1 . . . A 120 CYS CA . 17530 1 1438 . 1 1 120 120 CYS CB C 13 26.4 0.2 . 1 . . . A 120 CYS CB . 17530 1 1439 . 1 1 120 120 CYS N N 15 123.07 0.2 . 1 . . . A 120 CYS N . 17530 1 1440 . 1 1 121 121 ALA H H 1 8.39 0.02 . 1 . . . A 121 ALA H . 17530 1 1441 . 1 1 121 121 ALA HA H 1 4.34 0.02 . 1 . . . A 121 ALA HA . 17530 1 1442 . 1 1 121 121 ALA HB1 H 1 1.51 0.02 . 1 . . . A 121 ALA HB1 . 17530 1 1443 . 1 1 121 121 ALA HB2 H 1 1.51 0.02 . 1 . . . A 121 ALA HB2 . 17530 1 1444 . 1 1 121 121 ALA HB3 H 1 1.51 0.02 . 1 . . . A 121 ALA HB3 . 17530 1 1445 . 1 1 121 121 ALA C C 13 181.3 0.2 . 1 . . . A 121 ALA C . 17530 1 1446 . 1 1 121 121 ALA CA C 13 55.4 0.2 . 1 . . . A 121 ALA CA . 17530 1 1447 . 1 1 121 121 ALA CB C 13 18 0.2 . 1 . . . A 121 ALA CB . 17530 1 1448 . 1 1 121 121 ALA N N 15 121.6 0.2 . 1 . . . A 121 ALA N . 17530 1 1449 . 1 1 122 122 GLY H H 1 8.14 0.02 . 1 . . . A 122 GLY H . 17530 1 1450 . 1 1 122 122 GLY HA2 H 1 3.9 0.02 . 2 . . . A 122 GLY HA2 . 17530 1 1451 . 1 1 122 122 GLY HA3 H 1 3.9 0.02 . 2 . . . A 122 GLY HA3 . 17530 1 1452 . 1 1 122 122 GLY C C 13 176.8 0.2 . 1 . . . A 122 GLY C . 17530 1 1453 . 1 1 122 122 GLY CA C 13 47.3 0.2 . 1 . . . A 122 GLY CA . 17530 1 1454 . 1 1 122 122 GLY N N 15 104.3 0.2 . 1 . . . A 122 GLY N . 17530 1 1455 . 1 1 123 123 HIS H H 1 8.30 0.02 . 1 . . . A 123 HIS H . 17530 1 1456 . 1 1 123 123 HIS HA H 1 4.4 0.02 . 1 . . . A 123 HIS HA . 17530 1 1457 . 1 1 123 123 HIS HB2 H 1 3.09 0.02 . 2 . . . A 123 HIS HB2 . 17530 1 1458 . 1 1 123 123 HIS HB3 H 1 3.27 0.02 . 2 . . . A 123 HIS HB3 . 17530 1 1459 . 1 1 123 123 HIS HD2 H 1 7.03 0.02 . 1 . . . A 123 HIS HD2 . 17530 1 1460 . 1 1 123 123 HIS HE1 H 1 8.26 0.02 . 1 . . . A 123 HIS HE1 . 17530 1 1461 . 1 1 123 123 HIS C C 13 176.9 0.2 . 1 . . . A 123 HIS C . 17530 1 1462 . 1 1 123 123 HIS CA C 13 62.4 0.2 . 1 . . . A 123 HIS CA . 17530 1 1463 . 1 1 123 123 HIS CB C 13 27.8 0.2 . 1 . . . A 123 HIS CB . 17530 1 1464 . 1 1 123 123 HIS CD2 C 13 119.4 0.2 . 1 . . . A 123 HIS CD2 . 17530 1 1465 . 1 1 123 123 HIS CE1 C 13 139.7 0.2 . 1 . . . A 123 HIS CE1 . 17530 1 1466 . 1 1 123 123 HIS N N 15 119.2 0.2 . 1 . . . A 123 HIS N . 17530 1 1467 . 1 1 123 123 HIS ND1 N 15 167 0.2 . 1 . . . A 123 HIS ND1 . 17530 1 1468 . 1 1 123 123 HIS NE2 N 15 251.3 0.2 . 1 . . . A 123 HIS NE2 . 17530 1 1469 . 1 1 124 124 GLU H H 1 9.35 0.02 . 1 . . . A 124 GLU H . 17530 1 1470 . 1 1 124 124 GLU HA H 1 4.14 0.02 . 1 . . . A 124 GLU HA . 17530 1 1471 . 1 1 124 124 GLU HB2 H 1 2.45 0.02 . 2 . . . A 124 GLU HB2 . 17530 1 1472 . 1 1 124 124 GLU HB3 H 1 2.45 0.02 . 2 . . . A 124 GLU HB3 . 17530 1 1473 . 1 1 124 124 GLU HG2 H 1 2.34 0.02 . 2 . . . A 124 GLU HG2 . 17530 1 1474 . 1 1 124 124 GLU HG3 H 1 2.47 0.02 . 2 . . . A 124 GLU HG3 . 17530 1 1475 . 1 1 124 124 GLU C C 13 177.9 0.2 . 1 . . . A 124 GLU C . 17530 1 1476 . 1 1 124 124 GLU CA C 13 61.5 0.2 . 1 . . . A 124 GLU CA . 17530 1 1477 . 1 1 124 124 GLU CB C 13 29.2 0.2 . 1 . . . A 124 GLU CB . 17530 1 1478 . 1 1 124 124 GLU CG C 13 36.6 0.2 . 1 . . . A 124 GLU CG . 17530 1 1479 . 1 1 124 124 GLU N N 15 123.4 0.2 . 1 . . . A 124 GLU N . 17530 1 1480 . 1 1 125 125 GLU H H 1 7.91 0.02 . 1 . . . A 125 GLU H . 17530 1 1481 . 1 1 125 125 GLU HA H 1 4.25 0.02 . 1 . . . A 125 GLU HA . 17530 1 1482 . 1 1 125 125 GLU HB2 H 1 2.26 0.02 . 2 . . . A 125 GLU HB2 . 17530 1 1483 . 1 1 125 125 GLU HB3 H 1 2.26 0.02 . 2 . . . A 125 GLU HB3 . 17530 1 1484 . 1 1 125 125 GLU HG2 H 1 2.36 0.02 . 2 . . . A 125 GLU HG2 . 17530 1 1485 . 1 1 125 125 GLU HG3 H 1 2.56 0.02 . 2 . . . A 125 GLU HG3 . 17530 1 1486 . 1 1 125 125 GLU C C 13 180.4 0.2 . 1 . . . A 125 GLU C . 17530 1 1487 . 1 1 125 125 GLU CA C 13 59.4 0.2 . 1 . . . A 125 GLU CA . 17530 1 1488 . 1 1 125 125 GLU CB C 13 29.7 0.2 . 1 . . . A 125 GLU CB . 17530 1 1489 . 1 1 125 125 GLU CG C 13 36.4 0.2 . 1 . . . A 125 GLU CG . 17530 1 1490 . 1 1 125 125 GLU N N 15 118.1 0.2 . 1 . . . A 125 GLU N . 17530 1 1491 . 1 1 126 126 GLY H H 1 8.18 0.02 . 1 . . . A 126 GLY H . 17530 1 1492 . 1 1 126 126 GLY HA2 H 1 3.93 0.02 . 2 . . . A 126 GLY HA2 . 17530 1 1493 . 1 1 126 126 GLY HA3 H 1 3.93 0.02 . 2 . . . A 126 GLY HA3 . 17530 1 1494 . 1 1 126 126 GLY C C 13 175.3 0.2 . 1 . . . A 126 GLY C . 17530 1 1495 . 1 1 126 126 GLY CA C 13 47.7 0.2 . 1 . . . A 126 GLY CA . 17530 1 1496 . 1 1 126 126 GLY N N 15 107.1 0.2 . 1 . . . A 126 GLY N . 17530 1 1497 . 1 1 127 127 TRP H H 1 9.6 0.02 . 1 . . . A 127 TRP H . 17530 1 1498 . 1 1 127 127 TRP HA H 1 4.86 0.02 . 1 . . . A 127 TRP HA . 17530 1 1499 . 1 1 127 127 TRP HB2 H 1 3.09 0.02 . 2 . . . A 127 TRP HB2 . 17530 1 1500 . 1 1 127 127 TRP HB3 H 1 3.41 0.02 . 2 . . . A 127 TRP HB3 . 17530 1 1501 . 1 1 127 127 TRP HD1 H 1 7.06 0.02 . 1 . . . A 127 TRP HD1 . 17530 1 1502 . 1 1 127 127 TRP HE1 H 1 9.06 0.02 . 1 . . . A 127 TRP HE1 . 17530 1 1503 . 1 1 127 127 TRP HE3 H 1 7.57 0.02 . 1 . . . A 127 TRP HE3 . 17530 1 1504 . 1 1 127 127 TRP HZ2 H 1 6.68 0.02 . 1 . . . A 127 TRP HZ2 . 17530 1 1505 . 1 1 127 127 TRP HZ3 H 1 6.91 0.02 . 1 . . . A 127 TRP HZ3 . 17530 1 1506 . 1 1 127 127 TRP HH2 H 1 6.99 0.02 . 1 . . . A 127 TRP HH2 . 17530 1 1507 . 1 1 127 127 TRP C C 13 179.2 0.2 . 1 . . . A 127 TRP C . 17530 1 1508 . 1 1 127 127 TRP CA C 13 61.4 0.2 . 1 . . . A 127 TRP CA . 17530 1 1509 . 1 1 127 127 TRP CB C 13 30.3 0.2 . 1 . . . A 127 TRP CB . 17530 1 1510 . 1 1 127 127 TRP CD1 C 13 126.7 0.2 . 1 . . . A 127 TRP CD1 . 17530 1 1511 . 1 1 127 127 TRP CE3 C 13 119.8 0.2 . 1 . . . A 127 TRP CE3 . 17530 1 1512 . 1 1 127 127 TRP CZ2 C 13 115.1 0.2 . 1 . . . A 127 TRP CZ2 . 17530 1 1513 . 1 1 127 127 TRP CZ3 C 13 121.4 0.2 . 1 . . . A 127 TRP CZ3 . 17530 1 1514 . 1 1 127 127 TRP CH2 C 13 123.8 0.2 . 1 . . . A 127 TRP CH2 . 17530 1 1515 . 1 1 127 127 TRP N N 15 123.2 0.2 . 1 . . . A 127 TRP N . 17530 1 1516 . 1 1 128 128 ALA H H 1 8.86 0.02 . 1 . . . A 128 ALA H . 17530 1 1517 . 1 1 128 128 ALA HA H 1 4.07 0.02 . 1 . . . A 128 ALA HA . 17530 1 1518 . 1 1 128 128 ALA HB1 H 1 1.65 0.02 . 1 . . . A 128 ALA HB1 . 17530 1 1519 . 1 1 128 128 ALA HB2 H 1 1.65 0.02 . 1 . . . A 128 ALA HB2 . 17530 1 1520 . 1 1 128 128 ALA HB3 H 1 1.65 0.02 . 1 . . . A 128 ALA HB3 . 17530 1 1521 . 1 1 128 128 ALA C C 13 181 0.2 . 1 . . . A 128 ALA C . 17530 1 1522 . 1 1 128 128 ALA CA C 13 56.2 0.2 . 1 . . . A 128 ALA CA . 17530 1 1523 . 1 1 128 128 ALA CB C 13 17.8 0.2 . 1 . . . A 128 ALA CB . 17530 1 1524 . 1 1 128 128 ALA N N 15 121.0 0.2 . 1 . . . A 128 ALA N . 17530 1 1525 . 1 1 129 129 HIS H H 1 7.85 0.02 . 1 . . . A 129 HIS H . 17530 1 1526 . 1 1 129 129 HIS HA H 1 4.34 0.02 . 1 . . . A 129 HIS HA . 17530 1 1527 . 1 1 129 129 HIS HB2 H 1 2.96 0.02 . 2 . . . A 129 HIS HB2 . 17530 1 1528 . 1 1 129 129 HIS HB3 H 1 3.09 0.02 . 2 . . . A 129 HIS HB3 . 17530 1 1529 . 1 1 129 129 HIS HD2 H 1 6.91 0.02 . 1 . . . A 129 HIS HD2 . 17530 1 1530 . 1 1 129 129 HIS HE1 H 1 7.91 0.02 . 1 . . . A 129 HIS HE1 . 17530 1 1531 . 1 1 129 129 HIS C C 13 178.8 0.2 . 1 . . . A 129 HIS C . 17530 1 1532 . 1 1 129 129 HIS CA C 13 59.6 0.2 . 1 . . . A 129 HIS CA . 17530 1 1533 . 1 1 129 129 HIS CB C 13 30.6 0.2 . 1 . . . A 129 HIS CB . 17530 1 1534 . 1 1 129 129 HIS CD2 C 13 119.8 0.2 . 1 . . . A 129 HIS CD2 . 17530 1 1535 . 1 1 129 129 HIS CE1 C 13 137.7 0.2 . 1 . . . A 129 HIS CE1 . 17530 1 1536 . 1 1 129 129 HIS N N 15 117.6 0.2 . 1 . . . A 129 HIS N . 17530 1 1537 . 1 1 129 129 HIS ND1 N 15 209.7 0.2 . 1 . . . A 129 HIS ND1 . 17530 1 1538 . 1 1 129 129 HIS NE2 N 15 178.7 0.2 . 1 . . . A 129 HIS NE2 . 17530 1 1539 . 1 1 130 130 TYR H H 1 8.95 0.02 . 1 . . . A 130 TYR H . 17530 1 1540 . 1 1 130 130 TYR HA H 1 4.2 0.02 . 1 . . . A 130 TYR HA . 17530 1 1541 . 1 1 130 130 TYR HB2 H 1 2.86 0.02 . 2 . . . A 130 TYR HB2 . 17530 1 1542 . 1 1 130 130 TYR HB3 H 1 3.6 0.02 . 2 . . . A 130 TYR HB3 . 17530 1 1543 . 1 1 130 130 TYR HD1 H 1 6.34 0.02 . 3 . . . A 130 TYR HD1 . 17530 1 1544 . 1 1 130 130 TYR HD2 H 1 6.34 0.02 . 3 . . . A 130 TYR HD2 . 17530 1 1545 . 1 1 130 130 TYR HE1 H 1 6.11 0.02 . 3 . . . A 130 TYR HE1 . 17530 1 1546 . 1 1 130 130 TYR HE2 H 1 6.11 0.02 . 3 . . . A 130 TYR HE2 . 17530 1 1547 . 1 1 130 130 TYR C C 13 178.9 0.2 . 1 . . . A 130 TYR C . 17530 1 1548 . 1 1 130 130 TYR CA C 13 65.9 0.2 . 1 . . . A 130 TYR CA . 17530 1 1549 . 1 1 130 130 TYR CB C 13 37.6 0.2 . 1 . . . A 130 TYR CB . 17530 1 1550 . 1 1 130 130 TYR CD1 C 13 133.7 0.2 . 3 . . . A 130 TYR CD1 . 17530 1 1551 . 1 1 130 130 TYR CD2 C 13 133.7 0.2 . 3 . . . A 130 TYR CD2 . 17530 1 1552 . 1 1 130 130 TYR CE1 C 13 116.1 0.2 . 3 . . . A 130 TYR CE1 . 17530 1 1553 . 1 1 130 130 TYR CE2 C 13 116.1 0.2 . 3 . . . A 130 TYR CE2 . 17530 1 1554 . 1 1 130 130 TYR N N 15 119 0.2 . 1 . . . A 130 TYR N . 17530 1 1555 . 1 1 131 131 LEU H H 1 9.92 0.02 . 1 . . . A 131 LEU H . 17530 1 1556 . 1 1 131 131 LEU HA H 1 4.3 0.02 . 1 . . . A 131 LEU HA . 17530 1 1557 . 1 1 131 131 LEU HB2 H 1 1.22 0.02 . 2 . . . A 131 LEU HB2 . 17530 1 1558 . 1 1 131 131 LEU HB3 H 1 2.24 0.02 . 2 . . . A 131 LEU HB3 . 17530 1 1559 . 1 1 131 131 LEU HG H 1 2.42 0.02 . 1 . . . A 131 LEU HG . 17530 1 1560 . 1 1 131 131 LEU HD11 H 1 0.74 0.02 . 2 . . . A 131 LEU HD11 . 17530 1 1561 . 1 1 131 131 LEU HD12 H 1 0.74 0.02 . 2 . . . A 131 LEU HD12 . 17530 1 1562 . 1 1 131 131 LEU HD13 H 1 0.74 0.02 . 2 . . . A 131 LEU HD13 . 17530 1 1563 . 1 1 131 131 LEU HD21 H 1 0.78 0.02 . 2 . . . A 131 LEU HD21 . 17530 1 1564 . 1 1 131 131 LEU HD22 H 1 0.78 0.02 . 2 . . . A 131 LEU HD22 . 17530 1 1565 . 1 1 131 131 LEU HD23 H 1 0.78 0.02 . 2 . . . A 131 LEU HD23 . 17530 1 1566 . 1 1 131 131 LEU C C 13 181.2 0.2 . 1 . . . A 131 LEU C . 17530 1 1567 . 1 1 131 131 LEU CA C 13 58 0.2 . 1 . . . A 131 LEU CA . 17530 1 1568 . 1 1 131 131 LEU CB C 13 40.7 0.2 . 1 . . . A 131 LEU CB . 17530 1 1569 . 1 1 131 131 LEU CG C 13 27.8 0.2 . 1 . . . A 131 LEU CG . 17530 1 1570 . 1 1 131 131 LEU CD1 C 13 25.7 0.2 . 2 . . . A 131 LEU CD1 . 17530 1 1571 . 1 1 131 131 LEU CD2 C 13 22.4 0.2 . 2 . . . A 131 LEU CD2 . 17530 1 1572 . 1 1 131 131 LEU N N 15 119.3 0.2 . 1 . . . A 131 LEU N . 17530 1 1573 . 1 1 132 132 GLY H H 1 7.84 0.02 . 1 . . . A 132 GLY H . 17530 1 1574 . 1 1 132 132 GLY HA2 H 1 3.93 0.02 . 2 . . . A 132 GLY HA2 . 17530 1 1575 . 1 1 132 132 GLY HA3 H 1 4.10 0.02 . 2 . . . A 132 GLY HA3 . 17530 1 1576 . 1 1 132 132 GLY C C 13 176.2 0.2 . 1 . . . A 132 GLY C . 17530 1 1577 . 1 1 132 132 GLY CA C 13 47.5 0.2 . 1 . . . A 132 GLY CA . 17530 1 1578 . 1 1 132 132 GLY N N 15 110.4 0.2 . 1 . . . A 132 GLY N . 17530 1 1579 . 1 1 133 133 ARG H H 1 7.40 0.02 . 1 . . . A 133 ARG H . 17530 1 1580 . 1 1 133 133 ARG HA H 1 4.1 0.02 . 1 . . . A 133 ARG HA . 17530 1 1581 . 1 1 133 133 ARG HB2 H 1 2.23 0.02 . 2 . . . A 133 ARG HB2 . 17530 1 1582 . 1 1 133 133 ARG HB3 H 1 2.54 0.02 . 2 . . . A 133 ARG HB3 . 17530 1 1583 . 1 1 133 133 ARG HG2 H 1 1.41 0.02 . 2 . . . A 133 ARG HG2 . 17530 1 1584 . 1 1 133 133 ARG HG3 H 1 1.69 0.02 . 2 . . . A 133 ARG HG3 . 17530 1 1585 . 1 1 133 133 ARG HD2 H 1 3.03 0.02 . 2 . . . A 133 ARG HD2 . 17530 1 1586 . 1 1 133 133 ARG HD3 H 1 3.17 0.02 . 2 . . . A 133 ARG HD3 . 17530 1 1587 . 1 1 133 133 ARG HE H 1 8.05 0.02 . 1 . . . A 133 ARG HE . 17530 1 1588 . 1 1 133 133 ARG C C 13 178.4 0.2 . 1 . . . A 133 ARG C . 17530 1 1589 . 1 1 133 133 ARG CA C 13 60.9 0.2 . 1 . . . A 133 ARG CA . 17530 1 1590 . 1 1 133 133 ARG CB C 13 31.2 0.2 . 1 . . . A 133 ARG CB . 17530 1 1591 . 1 1 133 133 ARG CG C 13 29 0.2 . 1 . . . A 133 ARG CG . 17530 1 1592 . 1 1 133 133 ARG CD C 13 43.3 0.2 . 1 . . . A 133 ARG CD . 17530 1 1593 . 1 1 133 133 ARG N N 15 123.4 0.2 . 1 . . . A 133 ARG N . 17530 1 1594 . 1 1 133 133 ARG NE N 15 80.0 0.2 . 1 . . . A 133 ARG NE . 17530 1 1595 . 1 1 134 134 LEU H H 1 8.66 0.02 . 1 . . . A 134 LEU H . 17530 1 1596 . 1 1 134 134 LEU HA H 1 3.50 0.02 . 1 . . . A 134 LEU HA . 17530 1 1597 . 1 1 134 134 LEU HB2 H 1 0.58 0.02 . 2 . . . A 134 LEU HB2 . 17530 1 1598 . 1 1 134 134 LEU HB3 H 1 1.54 0.02 . 2 . . . A 134 LEU HB3 . 17530 1 1599 . 1 1 134 134 LEU HG H 1 0.97 0.02 . 1 . . . A 134 LEU HG . 17530 1 1600 . 1 1 134 134 LEU HD11 H 1 -0.36 0.02 . 2 . . . A 134 LEU HD11 . 17530 1 1601 . 1 1 134 134 LEU HD12 H 1 -0.36 0.02 . 2 . . . A 134 LEU HD12 . 17530 1 1602 . 1 1 134 134 LEU HD13 H 1 -0.36 0.02 . 2 . . . A 134 LEU HD13 . 17530 1 1603 . 1 1 134 134 LEU HD21 H 1 0.07 0.02 . 2 . . . A 134 LEU HD21 . 17530 1 1604 . 1 1 134 134 LEU HD22 H 1 0.07 0.02 . 2 . . . A 134 LEU HD22 . 17530 1 1605 . 1 1 134 134 LEU HD23 H 1 0.07 0.02 . 2 . . . A 134 LEU HD23 . 17530 1 1606 . 1 1 134 134 LEU C C 13 177.6 0.2 . 1 . . . A 134 LEU C . 17530 1 1607 . 1 1 134 134 LEU CA C 13 58.1 0.2 . 1 . . . A 134 LEU CA . 17530 1 1608 . 1 1 134 134 LEU CB C 13 40.3 0.2 . 1 . . . A 134 LEU CB . 17530 1 1609 . 1 1 134 134 LEU CG C 13 26.2 0.2 . 1 . . . A 134 LEU CG . 17530 1 1610 . 1 1 134 134 LEU CD1 C 13 21.5 0.2 . 2 . . . A 134 LEU CD1 . 17530 1 1611 . 1 1 134 134 LEU CD2 C 13 26.4 0.2 . 2 . . . A 134 LEU CD2 . 17530 1 1612 . 1 1 134 134 LEU N N 15 121.7 0.2 . 1 . . . A 134 LEU N . 17530 1 1613 . 1 1 135 135 THR H H 1 8.00 0.02 . 1 . . . A 135 THR H . 17530 1 1614 . 1 1 135 135 THR HA H 1 3.77 0.02 . 1 . . . A 135 THR HA . 17530 1 1615 . 1 1 135 135 THR HB H 1 4.62 0.02 . 1 . . . A 135 THR HB . 17530 1 1616 . 1 1 135 135 THR HG1 H 1 4.98 0.02 . 1 . . . A 135 THR HG1 . 17530 1 1617 . 1 1 135 135 THR HG21 H 1 1.34 0.02 . 1 . . . A 135 THR HG21 . 17530 1 1618 . 1 1 135 135 THR HG22 H 1 1.34 0.02 . 1 . . . A 135 THR HG22 . 17530 1 1619 . 1 1 135 135 THR HG23 H 1 1.34 0.02 . 1 . . . A 135 THR HG23 . 17530 1 1620 . 1 1 135 135 THR C C 13 176.8 0.2 . 1 . . . A 135 THR C . 17530 1 1621 . 1 1 135 135 THR CA C 13 67.4 0.2 . 1 . . . A 135 THR CA . 17530 1 1622 . 1 1 135 135 THR CB C 13 68.6 0.2 . 1 . . . A 135 THR CB . 17530 1 1623 . 1 1 135 135 THR CG2 C 13 20.9 0.2 . 1 . . . A 135 THR CG2 . 17530 1 1624 . 1 1 135 135 THR N N 15 114.8 0.2 . 1 . . . A 135 THR N . 17530 1 1625 . 1 1 136 136 GLU H H 1 7.37 0.02 . 1 . . . A 136 GLU H . 17530 1 1626 . 1 1 136 136 GLU HA H 1 3.96 0.02 . 1 . . . A 136 GLU HA . 17530 1 1627 . 1 1 136 136 GLU HB2 H 1 1.95 0.02 . 2 . . . A 136 GLU HB2 . 17530 1 1628 . 1 1 136 136 GLU HB3 H 1 2.25 0.02 . 2 . . . A 136 GLU HB3 . 17530 1 1629 . 1 1 136 136 GLU HG2 H 1 2.37 0.02 . 2 . . . A 136 GLU HG2 . 17530 1 1630 . 1 1 136 136 GLU HG3 H 1 2.46 0.02 . 2 . . . A 136 GLU HG3 . 17530 1 1631 . 1 1 136 136 GLU C C 13 178 0.2 . 1 . . . A 136 GLU C . 17530 1 1632 . 1 1 136 136 GLU CA C 13 59.6 0.2 . 1 . . . A 136 GLU CA . 17530 1 1633 . 1 1 136 136 GLU CB C 13 29.7 0.2 . 1 . . . A 136 GLU CB . 17530 1 1634 . 1 1 136 136 GLU CG C 13 36.3 0.2 . 1 . . . A 136 GLU CG . 17530 1 1635 . 1 1 136 136 GLU N N 15 120 0.2 . 1 . . . A 136 GLU N . 17530 1 1636 . 1 1 137 137 VAL H H 1 8.02 0.02 . 1 . . . A 137 VAL H . 17530 1 1637 . 1 1 137 137 VAL HA H 1 4.07 0.02 . 1 . . . A 137 VAL HA . 17530 1 1638 . 1 1 137 137 VAL HB H 1 2.09 0.02 . 1 . . . A 137 VAL HB . 17530 1 1639 . 1 1 137 137 VAL HG11 H 1 1.06 0.02 . 2 . . . A 137 VAL HG11 . 17530 1 1640 . 1 1 137 137 VAL HG12 H 1 1.06 0.02 . 2 . . . A 137 VAL HG12 . 17530 1 1641 . 1 1 137 137 VAL HG13 H 1 1.06 0.02 . 2 . . . A 137 VAL HG13 . 17530 1 1642 . 1 1 137 137 VAL HG21 H 1 1.24 0.02 . 2 . . . A 137 VAL HG21 . 17530 1 1643 . 1 1 137 137 VAL HG22 H 1 1.24 0.02 . 2 . . . A 137 VAL HG22 . 17530 1 1644 . 1 1 137 137 VAL HG23 H 1 1.24 0.02 . 2 . . . A 137 VAL HG23 . 17530 1 1645 . 1 1 137 137 VAL C C 13 181 0.2 . 1 . . . A 137 VAL C . 17530 1 1646 . 1 1 137 137 VAL CA C 13 66.2 0.2 . 1 . . . A 137 VAL CA . 17530 1 1647 . 1 1 137 137 VAL CB C 13 32.1 0.2 . 1 . . . A 137 VAL CB . 17530 1 1648 . 1 1 137 137 VAL CG1 C 13 22.7 0.2 . 2 . . . A 137 VAL CG1 . 17530 1 1649 . 1 1 137 137 VAL CG2 C 13 24.6 0.2 . 2 . . . A 137 VAL CG2 . 17530 1 1650 . 1 1 137 137 VAL N N 15 119.1 0.2 . 1 . . . A 137 VAL N . 17530 1 1651 . 1 1 138 138 ALA H H 1 9.21 0.02 . 1 . . . A 138 ALA H . 17530 1 1652 . 1 1 138 138 ALA HA H 1 3.90 0.02 . 1 . . . A 138 ALA HA . 17530 1 1653 . 1 1 138 138 ALA HB1 H 1 1.28 0.02 . 1 . . . A 138 ALA HB1 . 17530 1 1654 . 1 1 138 138 ALA HB2 H 1 1.28 0.02 . 1 . . . A 138 ALA HB2 . 17530 1 1655 . 1 1 138 138 ALA HB3 H 1 1.28 0.02 . 1 . . . A 138 ALA HB3 . 17530 1 1656 . 1 1 138 138 ALA C C 13 176.7 0.2 . 1 . . . A 138 ALA C . 17530 1 1657 . 1 1 138 138 ALA CA C 13 54.7 0.2 . 1 . . . A 138 ALA CA . 17530 1 1658 . 1 1 138 138 ALA CB C 13 18.3 0.2 . 1 . . . A 138 ALA CB . 17530 1 1659 . 1 1 138 138 ALA N N 15 123.8 0.2 . 1 . . . A 138 ALA N . 17530 1 1660 . 1 1 139 139 ALA H H 1 7.26 0.02 . 1 . . . A 139 ALA H . 17530 1 1661 . 1 1 139 139 ALA HA H 1 4.41 0.02 . 1 . . . A 139 ALA HA . 17530 1 1662 . 1 1 139 139 ALA HB1 H 1 1.60 0.02 . 1 . . . A 139 ALA HB1 . 17530 1 1663 . 1 1 139 139 ALA HB2 H 1 1.60 0.02 . 1 . . . A 139 ALA HB2 . 17530 1 1664 . 1 1 139 139 ALA HB3 H 1 1.60 0.02 . 1 . . . A 139 ALA HB3 . 17530 1 1665 . 1 1 139 139 ALA C C 13 177.4 0.2 . 1 . . . A 139 ALA C . 17530 1 1666 . 1 1 139 139 ALA CA C 13 51.9 0.2 . 1 . . . A 139 ALA CA . 17530 1 1667 . 1 1 139 139 ALA CB C 13 18.6 0.2 . 1 . . . A 139 ALA CB . 17530 1 1668 . 1 1 139 139 ALA N N 15 116.8 0.2 . 1 . . . A 139 ALA N . 17530 1 1669 . 1 1 140 140 GLY H H 1 8.12 0.02 . 1 . . . A 140 GLY H . 17530 1 1670 . 1 1 140 140 GLY HA2 H 1 3.82 0.02 . 2 . . . A 140 GLY HA2 . 17530 1 1671 . 1 1 140 140 GLY HA3 H 1 4.2 0.02 . 2 . . . A 140 GLY HA3 . 17530 1 1672 . 1 1 140 140 GLY C C 13 174.5 0.2 . 1 . . . A 140 GLY C . 17530 1 1673 . 1 1 140 140 GLY CA C 13 45.6 0.2 . 1 . . . A 140 GLY CA . 17530 1 1674 . 1 1 140 140 GLY N N 15 107 0.2 . 1 . . . A 140 GLY N . 17530 1 1675 . 1 1 141 141 ARG H H 1 8.19 0.02 . 1 . . . A 141 ARG H . 17530 1 1676 . 1 1 141 141 ARG HA H 1 4.56 0.02 . 1 . . . A 141 ARG HA . 17530 1 1677 . 1 1 141 141 ARG HB2 H 1 1.69 0.02 . 2 . . . A 141 ARG HB2 . 17530 1 1678 . 1 1 141 141 ARG HB3 H 1 1.74 0.02 . 2 . . . A 141 ARG HB3 . 17530 1 1679 . 1 1 141 141 ARG HG2 H 1 1.46 0.02 . 2 . . . A 141 ARG HG2 . 17530 1 1680 . 1 1 141 141 ARG HG3 H 1 1.46 0.02 . 2 . . . A 141 ARG HG3 . 17530 1 1681 . 1 1 141 141 ARG HD2 H 1 3.12 0.02 . 2 . . . A 141 ARG HD2 . 17530 1 1682 . 1 1 141 141 ARG HD3 H 1 3.39 0.02 . 2 . . . A 141 ARG HD3 . 17530 1 1683 . 1 1 141 141 ARG HE H 1 8.36 0.02 . 1 . . . A 141 ARG HE . 17530 1 1684 . 1 1 141 141 ARG C C 13 174.6 0.2 . 1 . . . A 141 ARG C . 17530 1 1685 . 1 1 141 141 ARG CA C 13 55.1 0.2 . 1 . . . A 141 ARG CA . 17530 1 1686 . 1 1 141 141 ARG CB C 13 33.2 0.2 . 1 . . . A 141 ARG CB . 17530 1 1687 . 1 1 141 141 ARG CG C 13 29.2 0.2 . 1 . . . A 141 ARG CG . 17530 1 1688 . 1 1 141 141 ARG CD C 13 43.4 0.2 . 1 . . . A 141 ARG CD . 17530 1 1689 . 1 1 141 141 ARG N N 15 120.3 0.2 . 1 . . . A 141 ARG N . 17530 1 1690 . 1 1 141 141 ARG NE N 15 84.9 0.2 . 1 . . . A 141 ARG NE . 17530 1 1691 . 1 1 142 142 ASP H H 1 8.45 0.02 . 1 . . . A 142 ASP H . 17530 1 1692 . 1 1 142 142 ASP HA H 1 4.98 0.02 . 1 . . . A 142 ASP HA . 17530 1 1693 . 1 1 142 142 ASP HB2 H 1 2.64 0.02 . 2 . . . A 142 ASP HB2 . 17530 1 1694 . 1 1 142 142 ASP HB3 H 1 2.89 0.02 . 2 . . . A 142 ASP HB3 . 17530 1 1695 . 1 1 142 142 ASP CA C 13 50.8 0.2 . 1 . . . A 142 ASP CA . 17530 1 1696 . 1 1 142 142 ASP CB C 13 42.1 0.2 . 1 . . . A 142 ASP CB . 17530 1 1697 . 1 1 142 142 ASP N N 15 120.9 0.2 . 1 . . . A 142 ASP N . 17530 1 1698 . 1 1 143 143 PRO HA H 1 4.57 0.02 . 1 . . . A 143 PRO HA . 17530 1 1699 . 1 1 143 143 PRO HB2 H 1 2.2 0.02 . 2 . . . A 143 PRO HB2 . 17530 1 1700 . 1 1 143 143 PRO HB3 H 1 2.2 0.02 . 2 . . . A 143 PRO HB3 . 17530 1 1701 . 1 1 143 143 PRO HG2 H 1 2.23 0.02 . 2 . . . A 143 PRO HG2 . 17530 1 1702 . 1 1 143 143 PRO HG3 H 1 2.29 0.02 . 2 . . . A 143 PRO HG3 . 17530 1 1703 . 1 1 143 143 PRO HD2 H 1 4.33 0.02 . 2 . . . A 143 PRO HD2 . 17530 1 1704 . 1 1 143 143 PRO HD3 H 1 3.95 0.02 . 2 . . . A 143 PRO HD3 . 17530 1 1705 . 1 1 143 143 PRO C C 13 176.5 0.2 . 1 . . . A 143 PRO C . 17530 1 1706 . 1 1 143 143 PRO CA C 13 63.7 0.2 . 1 . . . A 143 PRO CA . 17530 1 1707 . 1 1 143 143 PRO CB C 13 32.4 0.2 . 1 . . . A 143 PRO CB . 17530 1 1708 . 1 1 143 143 PRO CG C 13 26.4 0.2 . 1 . . . A 143 PRO CG . 17530 1 1709 . 1 1 143 143 PRO CD C 13 51.1 0.2 . 1 . . . A 143 PRO CD . 17530 1 1710 . 1 1 144 144 GLY H H 1 8.50 0.02 . 1 . . . A 144 GLY H . 17530 1 1711 . 1 1 144 144 GLY HA2 H 1 3.92 0.02 . 2 . . . A 144 GLY HA2 . 17530 1 1712 . 1 1 144 144 GLY HA3 H 1 4.24 0.02 . 2 . . . A 144 GLY HA3 . 17530 1 1713 . 1 1 144 144 GLY CA C 13 44.7 0.2 . 1 . . . A 144 GLY CA . 17530 1 1714 . 1 1 144 144 GLY N N 15 109.6 0.2 . 1 . . . A 144 GLY N . 17530 1 1715 . 1 1 145 145 PRO HA H 1 4.36 0.02 . 1 . . . A 145 PRO HA . 17530 1 1716 . 1 1 145 145 PRO HB2 H 1 2.25 0.02 . 2 . . . A 145 PRO HB2 . 17530 1 1717 . 1 1 145 145 PRO HB3 H 1 1.81 0.02 . 2 . . . A 145 PRO HB3 . 17530 1 1718 . 1 1 145 145 PRO HG2 H 1 1.97 0.02 . 2 . . . A 145 PRO HG2 . 17530 1 1719 . 1 1 145 145 PRO HG3 H 1 2.07 0.02 . 2 . . . A 145 PRO HG3 . 17530 1 1720 . 1 1 145 145 PRO HD2 H 1 3.64 0.02 . 2 . . . A 145 PRO HD2 . 17530 1 1721 . 1 1 145 145 PRO HD3 H 1 3.64 0.02 . 2 . . . A 145 PRO HD3 . 17530 1 1722 . 1 1 145 145 PRO C C 13 177.2 0.2 . 1 . . . A 145 PRO C . 17530 1 1723 . 1 1 145 145 PRO CA C 13 62.9 0.2 . 1 . . . A 145 PRO CA . 17530 1 1724 . 1 1 145 145 PRO CB C 13 31.8 0.2 . 1 . . . A 145 PRO CB . 17530 1 1725 . 1 1 145 145 PRO CG C 13 27.5 0.2 . 1 . . . A 145 PRO CG . 17530 1 1726 . 1 1 145 145 PRO CD C 13 49.6 0.2 . 1 . . . A 145 PRO CD . 17530 1 1727 . 1 1 146 146 ASP H H 1 9.11 0.02 . 1 . . . A 146 ASP H . 17530 1 1728 . 1 1 146 146 ASP HA H 1 4.9 0.02 . 1 . . . A 146 ASP HA . 17530 1 1729 . 1 1 146 146 ASP HB2 H 1 2.69 0.02 . 2 . . . A 146 ASP HB2 . 17530 1 1730 . 1 1 146 146 ASP HB3 H 1 3.04 0.02 . 2 . . . A 146 ASP HB3 . 17530 1 1731 . 1 1 146 146 ASP CA C 13 52.0 0.2 . 1 . . . A 146 ASP CA . 17530 1 1732 . 1 1 146 146 ASP CB C 13 42 0.2 . 1 . . . A 146 ASP CB . 17530 1 1733 . 1 1 146 146 ASP N N 15 124.2 0.2 . 1 . . . A 146 ASP N . 17530 1 1734 . 1 1 147 147 PRO HA H 1 4.61 0.02 . 1 . . . A 147 PRO HA . 17530 1 1735 . 1 1 147 147 PRO HB2 H 1 2.45 0.02 . 2 . . . A 147 PRO HB2 . 17530 1 1736 . 1 1 147 147 PRO HB3 H 1 1.95 0.02 . 2 . . . A 147 PRO HB3 . 17530 1 1737 . 1 1 147 147 PRO HG2 H 1 2 0.02 . 2 . . . A 147 PRO HG2 . 17530 1 1738 . 1 1 147 147 PRO HG3 H 1 2.20 0.02 . 2 . . . A 147 PRO HG3 . 17530 1 1739 . 1 1 147 147 PRO HD2 H 1 4.42 0.02 . 2 . . . A 147 PRO HD2 . 17530 1 1740 . 1 1 147 147 PRO HD3 H 1 4.26 0.02 . 2 . . . A 147 PRO HD3 . 17530 1 1741 . 1 1 147 147 PRO C C 13 177.5 0.2 . 1 . . . A 147 PRO C . 17530 1 1742 . 1 1 147 147 PRO CA C 13 64.2 0.2 . 1 . . . A 147 PRO CA . 17530 1 1743 . 1 1 147 147 PRO CB C 13 32.3 0.2 . 1 . . . A 147 PRO CB . 17530 1 1744 . 1 1 147 147 PRO CG C 13 27.4 0.2 . 1 . . . A 147 PRO CG . 17530 1 1745 . 1 1 147 147 PRO CD C 13 51.8 0.2 . 1 . . . A 147 PRO CD . 17530 1 1746 . 1 1 148 148 PHE H H 1 8.12 0.02 . 1 . . . A 148 PHE H . 17530 1 1747 . 1 1 148 148 PHE HA H 1 4.37 0.02 . 1 . . . A 148 PHE HA . 17530 1 1748 . 1 1 148 148 PHE HB2 H 1 3.21 0.02 . 2 . . . A 148 PHE HB2 . 17530 1 1749 . 1 1 148 148 PHE HB3 H 1 3.44 0.02 . 2 . . . A 148 PHE HB3 . 17530 1 1750 . 1 1 148 148 PHE HD1 H 1 6.73 0.02 . 3 . . . A 148 PHE HD1 . 17530 1 1751 . 1 1 148 148 PHE HD2 H 1 6.73 0.02 . 3 . . . A 148 PHE HD2 . 17530 1 1752 . 1 1 148 148 PHE C C 13 175.2 0.2 . 1 . . . A 148 PHE C . 17530 1 1753 . 1 1 148 148 PHE CA C 13 56.6 0.2 . 1 . . . A 148 PHE CA . 17530 1 1754 . 1 1 148 148 PHE CB C 13 37.6 0.2 . 1 . . . A 148 PHE CB . 17530 1 1755 . 1 1 148 148 PHE N N 15 118.6 0.2 . 1 . . . A 148 PHE N . 17530 1 1756 . 1 1 149 149 TYR H H 1 7.81 0.02 . 1 . . . A 149 TYR H . 17530 1 1757 . 1 1 149 149 TYR HA H 1 4.46 0.02 . 1 . . . A 149 TYR HA . 17530 1 1758 . 1 1 149 149 TYR HB2 H 1 2.96 0.02 . 2 . . . A 149 TYR HB2 . 17530 1 1759 . 1 1 149 149 TYR HB3 H 1 3.29 0.02 . 2 . . . A 149 TYR HB3 . 17530 1 1760 . 1 1 149 149 TYR HD1 H 1 7.07 0.02 . 3 . . . A 149 TYR HD1 . 17530 1 1761 . 1 1 149 149 TYR HD2 H 1 7.07 0.02 . 3 . . . A 149 TYR HD2 . 17530 1 1762 . 1 1 149 149 TYR HE1 H 1 6.79 0.02 . 3 . . . A 149 TYR HE1 . 17530 1 1763 . 1 1 149 149 TYR HE2 H 1 6.79 0.02 . 3 . . . A 149 TYR HE2 . 17530 1 1764 . 1 1 149 149 TYR C C 13 177.6 0.2 . 1 . . . A 149 TYR C . 17530 1 1765 . 1 1 149 149 TYR CA C 13 60 0.2 . 1 . . . A 149 TYR CA . 17530 1 1766 . 1 1 149 149 TYR CB C 13 38.4 0.2 . 1 . . . A 149 TYR CB . 17530 1 1767 . 1 1 149 149 TYR CD1 C 13 133.5 0.2 . 3 . . . A 149 TYR CD1 . 17530 1 1768 . 1 1 149 149 TYR CD2 C 13 133.5 0.2 . 3 . . . A 149 TYR CD2 . 17530 1 1769 . 1 1 149 149 TYR CE1 C 13 118.0 0.2 . 3 . . . A 149 TYR CE1 . 17530 1 1770 . 1 1 149 149 TYR CE2 C 13 118.0 0.2 . 3 . . . A 149 TYR CE2 . 17530 1 1771 . 1 1 149 149 TYR N N 15 120.5 0.2 . 1 . . . A 149 TYR N . 17530 1 1772 . 1 1 150 150 GLY H H 1 8.83 0.02 . 1 . . . A 150 GLY H . 17530 1 1773 . 1 1 150 150 GLY HA2 H 1 3.2 0.02 . 2 . . . A 150 GLY HA2 . 17530 1 1774 . 1 1 150 150 GLY HA3 H 1 3.84 0.02 . 2 . . . A 150 GLY HA3 . 17530 1 1775 . 1 1 150 150 GLY C C 13 174.1 0.2 . 1 . . . A 150 GLY C . 17530 1 1776 . 1 1 150 150 GLY CA C 13 45.1 0.2 . 1 . . . A 150 GLY CA . 17530 1 1777 . 1 1 150 150 GLY N N 15 114.9 0.2 . 1 . . . A 150 GLY N . 17530 1 1778 . 1 1 151 151 ARG H H 1 7.94 0.02 . 1 . . . A 151 ARG H . 17530 1 1779 . 1 1 151 151 ARG HA H 1 4.1 0.02 . 1 . . . A 151 ARG HA . 17530 1 1780 . 1 1 151 151 ARG HB2 H 1 1.56 0.02 . 2 . . . A 151 ARG HB2 . 17530 1 1781 . 1 1 151 151 ARG HB3 H 1 1.68 0.02 . 2 . . . A 151 ARG HB3 . 17530 1 1782 . 1 1 151 151 ARG HG2 H 1 1.41 0.02 . 2 . . . A 151 ARG HG2 . 17530 1 1783 . 1 1 151 151 ARG HG3 H 1 1.51 0.02 . 2 . . . A 151 ARG HG3 . 17530 1 1784 . 1 1 151 151 ARG HD2 H 1 2.69 0.02 . 2 . . . A 151 ARG HD2 . 17530 1 1785 . 1 1 151 151 ARG HD3 H 1 3.07 0.02 . 2 . . . A 151 ARG HD3 . 17530 1 1786 . 1 1 151 151 ARG HE H 1 6.76 0.02 . 1 . . . A 151 ARG HE . 17530 1 1787 . 1 1 151 151 ARG CA C 13 56.9 0.2 . 1 . . . A 151 ARG CA . 17530 1 1788 . 1 1 151 151 ARG CB C 13 31.1 0.2 . 1 . . . A 151 ARG CB . 17530 1 1789 . 1 1 151 151 ARG CG C 13 27.4 0.2 . 1 . . . A 151 ARG CG . 17530 1 1790 . 1 1 151 151 ARG CD C 13 43.3 0.2 . 1 . . . A 151 ARG CD . 17530 1 1791 . 1 1 151 151 ARG N N 15 119.6 0.2 . 1 . . . A 151 ARG N . 17530 1 1792 . 1 1 152 152 ARG H H 1 8.48 0.02 . 1 . . . A 152 ARG H . 17530 1 1793 . 1 1 154 154 GLU HA H 1 4.69 0.02 . 1 . . . A 154 GLU HA . 17530 1 1794 . 1 1 154 154 GLU HB2 H 1 1.84 0.02 . 2 . . . A 154 GLU HB2 . 17530 1 1795 . 1 1 154 154 GLU HB3 H 1 2.00 0.02 . 2 . . . A 154 GLU HB3 . 17530 1 1796 . 1 1 154 154 GLU HG2 H 1 1.89 0.02 . 2 . . . A 154 GLU HG2 . 17530 1 1797 . 1 1 154 154 GLU HG3 H 1 2.02 0.02 . 2 . . . A 154 GLU HG3 . 17530 1 1798 . 1 1 154 154 GLU CA C 13 53.2 0.2 . 1 . . . A 154 GLU CA . 17530 1 1799 . 1 1 154 154 GLU CB C 13 31.0 0.2 . 1 . . . A 154 GLU CB . 17530 1 1800 . 1 1 154 154 GLU CG C 13 34.5 0.2 . 1 . . . A 154 GLU CG . 17530 1 1801 . 1 1 159 159 HIS HA H 1 4.59 0.02 . 1 . . . A 159 HIS HA . 17530 1 1802 . 1 1 159 159 HIS HB2 H 1 3.1 0.02 . 2 . . . A 159 HIS HB2 . 17530 1 1803 . 1 1 159 159 HIS HB3 H 1 3.1 0.02 . 2 . . . A 159 HIS HB3 . 17530 1 1804 . 1 1 159 159 HIS C C 13 173.9 0.2 . 1 . . . A 159 HIS C . 17530 1 1805 . 1 1 159 159 HIS CA C 13 55.9 0.2 . 1 . . . A 159 HIS CA . 17530 1 1806 . 1 1 159 159 HIS CB C 13 30.1 0.2 . 1 . . . A 159 HIS CB . 17530 1 1807 . 1 1 160 160 HIS H H 1 8.13 0.02 . 1 . . . A 160 HIS H . 17530 1 1808 . 1 1 160 160 HIS CA C 13 57.4 0.2 . 1 . . . A 160 HIS CA . 17530 1 1809 . 1 1 160 160 HIS CB C 13 30.1 0.2 . 1 . . . A 160 HIS CB . 17530 1 1810 . 1 1 160 160 HIS N N 15 125.3 0.2 . 1 . . . A 160 HIS N . 17530 1 stop_ save_