data_15440 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 15440 _Entry.Title ; 1H, 13C and 15N resonance assignments of the C-terminal domain of HasB from Serratia marcescens ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2007-08-22 _Entry.Accession_date 2007-08-22 _Entry.Last_release_date . _Entry.Original_release_date . _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 3.0.8.100 _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 Julien Lefevre . . . 15440 2 Catherine Simenel . . . 15440 3 Philippe Delepelaire . . . 15440 4 Muriel Delepierre . . . 15440 5 Nadia Izadi-Pruneyre . . . 15440 stop_ loop_ _Entry_src.ID _Entry_src.Project_name _Entry_src.Organization_full_name _Entry_src.Organization_initials _Entry_src.Entry_ID 1 . 'Unite de RMN des Biomolecules-Institut Pasteur CNRS URA 2185' . 15440 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 15440 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 546 15440 '15N chemical shifts' 125 15440 '1H chemical shifts' 905 15440 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 4 . . 2009-08-12 2007-08-22 update BMRB 'added PubMed ID' 15440 3 . . 2009-01-28 2007-08-22 update author 'complete chemical shift table' 15440 2 . . 2008-01-30 2007-08-22 update BMRB 'complete entry citation' 15440 1 . . 2007-08-28 2007-08-22 original author 'original release' 15440 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 2M2K 'BMRB Entry Tracking System' 15440 stop_ save_ ############### # Citations # ############### save_citation_1 _Citation.Sf_category citations _Citation.Sf_framecode citation_1 _Citation.Entry_ID 15440 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 19636864 _Citation.Full_citation . _Citation.Title '(1)H, (13)C and (15)N resonance assignments of the C-terminal domain of HasB, a specific TonB like protein, from Serratia marcescens' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Biomol. NMR Assignments' _Citation.Journal_name_full . _Citation.Journal_volume 1 _Citation.Journal_issue 2 _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 197 _Citation.Page_last 199 _Citation.Year 2007 _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 Julien Lefevre . . . 15440 1 2 Catherine Simenel . . . 15440 1 3 Philippe Delepelaire . . . 15440 1 4 Muriel Delepierre . . . 15440 1 5 Nadia Izadi-Pruneyre . . . 15440 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID HasB 15440 1 'heme transport' 15440 1 'NMR assignment' 15440 1 TonB 15440 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 15440 _Assembly.ID 1 _Assembly.Name HasB _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 HasB 1 $HasB A . yes native no no . . . 15440 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_HasB _Entity.Sf_category entity _Entity.Sf_framecode HasB _Entity.Entry_ID 15440 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name HasB _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; MKVQEQSVGAPPPGRADKTA APQTRLTPYAQAGEDNWRSR ISGRLNRFKRYPKDALRLKR QGVGQVRFTLDRQGHVLAVT LVSSAGLPSLDREIQALVKR ASPLPTPPADAYVNGTVELT LPIDFSLRGAGF ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details 'HasB is the periplasmic domain of a membrane protein' _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 132 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method . _Entity.Parent_entity_ID 1 _Entity.Fragment 'HasB133:the last 131 residues of HasB (amino acids 133-263) and an additional N-terminal methionine.' _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-11-26 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 no PDB 2M2K . "The Structure Of Hasb Ctd" . . . . . 99.24 131 100.00 100.00 3.13e-87 . . . . 15440 1 2 no EMBL CAE46937 . "hasB [Serratia marcescens]" . . . . . 99.24 263 100.00 100.00 1.92e-86 . . . . 15440 1 3 no EMBL CDG10879 . "TonB-like protein [Serratia marcescens subsp. marcescens Db11]" . . . . . 99.24 263 99.24 99.24 2.10e-85 . . . . 15440 1 4 no GB AGE16788 . "hypothetical protein SMWW4_v1c09840 [Serratia marcescens WW4]" . . . . . 99.24 263 98.47 99.24 7.19e-85 . . . . 15440 1 5 no GB AIA50123 . "hypothetical protein L085_23630 [Serratia sp. FS14]" . . . . . 99.24 263 98.47 99.24 3.95e-85 . . . . 15440 1 6 no GB ALD43843 . "hypothetical protein AN479_05185 [Serratia marcescens]" . . . . . 99.24 263 100.00 100.00 1.86e-86 . . . . 15440 1 7 no GB ALL36754 . "hypothetical protein AR325_07175 [Serratia marcescens]" . . . . . 99.24 263 99.24 100.00 4.95e-86 . . . . 15440 1 8 no GB EMF03481 . "hypothetical protein F518_23595 [Serratia marcescens VGH107]" . . . . . 99.24 263 98.47 99.24 2.13e-85 . . . . 15440 1 9 no REF WP_004940473 . "hypothetical protein [Serratia marcescens]" . . . . . 99.24 263 98.47 99.24 2.13e-85 . . . . 15440 1 10 no REF WP_015376815 . "hypothetical protein [Serratia marcescens]" . . . . . 99.24 263 98.47 99.24 7.19e-85 . . . . 15440 1 11 no REF WP_016928895 . "hypothetical protein [Serratia marcescens]" . . . . . 99.24 263 99.24 99.24 7.48e-86 . . . . 15440 1 12 no REF WP_021504696 . "hypothetical protein [Serratia marcescens]" . . . . . 99.24 263 98.47 99.24 2.27e-85 . . . . 15440 1 13 no REF WP_025301729 . "hypothetical protein [Serratia marcescens]" . . . . . 99.24 263 99.24 99.24 2.10e-85 . . . . 15440 1 stop_ loop_ _Entity_biological_function.Biological_function _Entity_biological_function.Entry_ID _Entity_biological_function.Entity_ID 'ENERGY TRANSDUCER' 15440 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 . 15440 1 2 . LYS . 15440 1 3 . VAL . 15440 1 4 . GLN . 15440 1 5 . GLU . 15440 1 6 . GLN . 15440 1 7 . SER . 15440 1 8 . VAL . 15440 1 9 . GLY . 15440 1 10 . ALA . 15440 1 11 . PRO . 15440 1 12 . PRO . 15440 1 13 . PRO . 15440 1 14 . GLY . 15440 1 15 . ARG . 15440 1 16 . ALA . 15440 1 17 . ASP . 15440 1 18 . LYS . 15440 1 19 . THR . 15440 1 20 . ALA . 15440 1 21 . ALA . 15440 1 22 . PRO . 15440 1 23 . GLN . 15440 1 24 . THR . 15440 1 25 . ARG . 15440 1 26 . LEU . 15440 1 27 . THR . 15440 1 28 . PRO . 15440 1 29 . TYR . 15440 1 30 . ALA . 15440 1 31 . GLN . 15440 1 32 . ALA . 15440 1 33 . GLY . 15440 1 34 . GLU . 15440 1 35 . ASP . 15440 1 36 . ASN . 15440 1 37 . TRP . 15440 1 38 . ARG . 15440 1 39 . SER . 15440 1 40 . ARG . 15440 1 41 . ILE . 15440 1 42 . SER . 15440 1 43 . GLY . 15440 1 44 . ARG . 15440 1 45 . LEU . 15440 1 46 . ASN . 15440 1 47 . ARG . 15440 1 48 . PHE . 15440 1 49 . LYS . 15440 1 50 . ARG . 15440 1 51 . TYR . 15440 1 52 . PRO . 15440 1 53 . LYS . 15440 1 54 . ASP . 15440 1 55 . ALA . 15440 1 56 . LEU . 15440 1 57 . ARG . 15440 1 58 . LEU . 15440 1 59 . LYS . 15440 1 60 . ARG . 15440 1 61 . GLN . 15440 1 62 . GLY . 15440 1 63 . VAL . 15440 1 64 . GLY . 15440 1 65 . GLN . 15440 1 66 . VAL . 15440 1 67 . ARG . 15440 1 68 . PHE . 15440 1 69 . THR . 15440 1 70 . LEU . 15440 1 71 . ASP . 15440 1 72 . ARG . 15440 1 73 . GLN . 15440 1 74 . GLY . 15440 1 75 . HIS . 15440 1 76 . VAL . 15440 1 77 . LEU . 15440 1 78 . ALA . 15440 1 79 . VAL . 15440 1 80 . THR . 15440 1 81 . LEU . 15440 1 82 . VAL . 15440 1 83 . SER . 15440 1 84 . SER . 15440 1 85 . ALA . 15440 1 86 . GLY . 15440 1 87 . LEU . 15440 1 88 . PRO . 15440 1 89 . SER . 15440 1 90 . LEU . 15440 1 91 . ASP . 15440 1 92 . ARG . 15440 1 93 . GLU . 15440 1 94 . ILE . 15440 1 95 . GLN . 15440 1 96 . ALA . 15440 1 97 . LEU . 15440 1 98 . VAL . 15440 1 99 . LYS . 15440 1 100 . ARG . 15440 1 101 . ALA . 15440 1 102 . SER . 15440 1 103 . PRO . 15440 1 104 . LEU . 15440 1 105 . PRO . 15440 1 106 . THR . 15440 1 107 . PRO . 15440 1 108 . PRO . 15440 1 109 . ALA . 15440 1 110 . ASP . 15440 1 111 . ALA . 15440 1 112 . TYR . 15440 1 113 . VAL . 15440 1 114 . ASN . 15440 1 115 . GLY . 15440 1 116 . THR . 15440 1 117 . VAL . 15440 1 118 . GLU . 15440 1 119 . LEU . 15440 1 120 . THR . 15440 1 121 . LEU . 15440 1 122 . PRO . 15440 1 123 . ILE . 15440 1 124 . ASP . 15440 1 125 . PHE . 15440 1 126 . SER . 15440 1 127 . LEU . 15440 1 128 . ARG . 15440 1 129 . GLY . 15440 1 130 . ALA . 15440 1 131 . GLY . 15440 1 132 . PHE . 15440 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 15440 1 . LYS 2 2 15440 1 . VAL 3 3 15440 1 . GLN 4 4 15440 1 . GLU 5 5 15440 1 . GLN 6 6 15440 1 . SER 7 7 15440 1 . VAL 8 8 15440 1 . GLY 9 9 15440 1 . ALA 10 10 15440 1 . PRO 11 11 15440 1 . PRO 12 12 15440 1 . PRO 13 13 15440 1 . GLY 14 14 15440 1 . ARG 15 15 15440 1 . ALA 16 16 15440 1 . ASP 17 17 15440 1 . LYS 18 18 15440 1 . THR 19 19 15440 1 . ALA 20 20 15440 1 . ALA 21 21 15440 1 . PRO 22 22 15440 1 . GLN 23 23 15440 1 . THR 24 24 15440 1 . ARG 25 25 15440 1 . LEU 26 26 15440 1 . THR 27 27 15440 1 . PRO 28 28 15440 1 . TYR 29 29 15440 1 . ALA 30 30 15440 1 . GLN 31 31 15440 1 . ALA 32 32 15440 1 . GLY 33 33 15440 1 . GLU 34 34 15440 1 . ASP 35 35 15440 1 . ASN 36 36 15440 1 . TRP 37 37 15440 1 . ARG 38 38 15440 1 . SER 39 39 15440 1 . ARG 40 40 15440 1 . ILE 41 41 15440 1 . SER 42 42 15440 1 . GLY 43 43 15440 1 . ARG 44 44 15440 1 . LEU 45 45 15440 1 . ASN 46 46 15440 1 . ARG 47 47 15440 1 . PHE 48 48 15440 1 . LYS 49 49 15440 1 . ARG 50 50 15440 1 . TYR 51 51 15440 1 . PRO 52 52 15440 1 . LYS 53 53 15440 1 . ASP 54 54 15440 1 . ALA 55 55 15440 1 . LEU 56 56 15440 1 . ARG 57 57 15440 1 . LEU 58 58 15440 1 . LYS 59 59 15440 1 . ARG 60 60 15440 1 . GLN 61 61 15440 1 . GLY 62 62 15440 1 . VAL 63 63 15440 1 . GLY 64 64 15440 1 . GLN 65 65 15440 1 . VAL 66 66 15440 1 . ARG 67 67 15440 1 . PHE 68 68 15440 1 . THR 69 69 15440 1 . LEU 70 70 15440 1 . ASP 71 71 15440 1 . ARG 72 72 15440 1 . GLN 73 73 15440 1 . GLY 74 74 15440 1 . HIS 75 75 15440 1 . VAL 76 76 15440 1 . LEU 77 77 15440 1 . ALA 78 78 15440 1 . VAL 79 79 15440 1 . THR 80 80 15440 1 . LEU 81 81 15440 1 . VAL 82 82 15440 1 . SER 83 83 15440 1 . SER 84 84 15440 1 . ALA 85 85 15440 1 . GLY 86 86 15440 1 . LEU 87 87 15440 1 . PRO 88 88 15440 1 . SER 89 89 15440 1 . LEU 90 90 15440 1 . ASP 91 91 15440 1 . ARG 92 92 15440 1 . GLU 93 93 15440 1 . ILE 94 94 15440 1 . GLN 95 95 15440 1 . ALA 96 96 15440 1 . LEU 97 97 15440 1 . VAL 98 98 15440 1 . LYS 99 99 15440 1 . ARG 100 100 15440 1 . ALA 101 101 15440 1 . SER 102 102 15440 1 . PRO 103 103 15440 1 . LEU 104 104 15440 1 . PRO 105 105 15440 1 . THR 106 106 15440 1 . PRO 107 107 15440 1 . PRO 108 108 15440 1 . ALA 109 109 15440 1 . ASP 110 110 15440 1 . ALA 111 111 15440 1 . TYR 112 112 15440 1 . VAL 113 113 15440 1 . ASN 114 114 15440 1 . GLY 115 115 15440 1 . THR 116 116 15440 1 . VAL 117 117 15440 1 . GLU 118 118 15440 1 . LEU 119 119 15440 1 . THR 120 120 15440 1 . LEU 121 121 15440 1 . PRO 122 122 15440 1 . ILE 123 123 15440 1 . ASP 124 124 15440 1 . PHE 125 125 15440 1 . SER 126 126 15440 1 . LEU 127 127 15440 1 . ARG 128 128 15440 1 . GLY 129 129 15440 1 . ALA 130 130 15440 1 . GLY 131 131 15440 1 . PHE 132 132 15440 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 15440 _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 $HasB . 615 organism . 'Serratia marcescens' 'Bacillus marcescens' . . Bacteria . Serratia marcescens . . . . . . . . . . . . . . . . hasb . . . . 15440 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 15440 _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 $HasB . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli JP313 . . . . . . . . . . . . . . . pBAD24 . . . . . . 15440 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 15440 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '85% H2O/15% 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 HasB '[U-99% 13C; U-99% 15N]' . . 1 $HasB . . 0.8 . . mM . . . . 15440 1 2 'Sodium Phosphate' . . . . . . . 50 . . mM . . . . 15440 1 3 NaCl . . . . . . . 50 . . mM . . . . 15440 1 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID 15440 _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' 100 . mM 15440 1 pH 7 . pH 15440 1 pressure 1 . atm 15440 1 temperature 293 . K 15440 1 stop_ save_ ############################ # Computer software used # ############################ save_XEASY _Software.Sf_category software _Software.Sf_framecode XEASY _Software.Entry_ID 15440 _Software.ID 1 _Software.Name XEASY _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bartels et al.' . . 15440 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'peak picking' 15440 1 stop_ save_ save_NMRPipe _Software.Sf_category software _Software.Sf_framecode NMRPipe _Software.Entry_ID 15440 _Software.ID 2 _Software.Name NMRPipe _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . 15440 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 15440 2 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_1 _NMR_spectrometer.Entry_ID 15440 _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_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 15440 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 Varian INOVA . 600 . . . 15440 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 15440 _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' yes . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 15440 1 2 '2D 1H-13C HSQC' yes . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 15440 1 3 '3D CBCA(CO)NH' yes . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 15440 1 4 '3D C(CO)NH' yes . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 15440 1 5 '3D HNCO' yes . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 15440 1 6 '3D HNCACB' yes . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 15440 1 7 '3D HBHA(CO)NH' yes . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 15440 1 8 '3D H(CCO)NH' yes . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 15440 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 15440 _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 . . . 1 $citation_1 . . 1 $citation_1 15440 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . 1 $citation_1 . . 1 $citation_1 15440 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 . indirect 0.101329118 . . . 1 $citation_1 . . 1 $citation_1 15440 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 15440 _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' . . . 15440 1 2 '2D 1H-13C HSQC' . . . 15440 1 3 '3D CBCA(CO)NH' . . . 15440 1 4 '3D C(CO)NH' . . . 15440 1 5 '3D HNCO' . . . 15440 1 6 '3D HNCACB' . . . 15440 1 7 '3D HBHA(CO)NH' . . . 15440 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 LYS HA H 1 4.377 0.100 . 1 . . . . 2 LYS HA . 15440 1 2 . 1 1 2 2 LYS HB2 H 1 1.679 0.100 . 1 . . . . 2 LYS HB2 . 15440 1 3 . 1 1 2 2 LYS HB3 H 1 1.679 0.100 . 1 . . . . 2 LYS HB3 . 15440 1 4 . 1 1 2 2 LYS HD2 H 1 1.396 0.100 . 1 . . . . 2 LYS HD2 . 15440 1 5 . 1 1 2 2 LYS HD3 H 1 1.396 0.100 . 1 . . . . 2 LYS HD3 . 15440 1 6 . 1 1 2 2 LYS HE2 H 1 2.969 0.100 . 1 . . . . 2 LYS HE2 . 15440 1 7 . 1 1 2 2 LYS HE3 H 1 2.969 0.100 . 1 . . . . 2 LYS HE3 . 15440 1 8 . 1 1 2 2 LYS HG2 H 1 1.157 0.100 . 1 . . . . 2 LYS HG2 . 15440 1 9 . 1 1 2 2 LYS HG3 H 1 1.157 0.100 . 1 . . . . 2 LYS HG3 . 15440 1 10 . 1 1 2 2 LYS C C 13 176.271 0.300 . 1 . . . . 2 LYS C . 15440 1 11 . 1 1 2 2 LYS CA C 13 56.312 0.300 . 1 . . . . 2 LYS CA . 15440 1 12 . 1 1 2 2 LYS CB C 13 33.271 0.300 . 1 . . . . 2 LYS CB . 15440 1 13 . 1 1 2 2 LYS CD C 13 29.097 0.300 . 1 . . . . 2 LYS CD . 15440 1 14 . 1 1 2 2 LYS CE C 13 41.995 0.300 . 1 . . . . 2 LYS CE . 15440 1 15 . 1 1 2 2 LYS CG C 13 24.530 0.300 . 1 . . . . 2 LYS CG . 15440 1 16 . 1 1 3 3 VAL H H 1 8.362 0.100 . 1 . . . . 3 VAL H . 15440 1 17 . 1 1 3 3 VAL HA H 1 4.031 0.100 . 1 . . . . 3 VAL HA . 15440 1 18 . 1 1 3 3 VAL HB H 1 2.024 0.100 . 1 . . . . 3 VAL HB . 15440 1 19 . 1 1 3 3 VAL HG11 H 1 0.923 0.100 . 1 . . . . 3 VAL HG11 . 15440 1 20 . 1 1 3 3 VAL HG12 H 1 0.923 0.100 . 1 . . . . 3 VAL HG12 . 15440 1 21 . 1 1 3 3 VAL HG13 H 1 0.923 0.100 . 1 . . . . 3 VAL HG13 . 15440 1 22 . 1 1 3 3 VAL HG21 H 1 0.923 0.100 . 1 . . . . 3 VAL HG21 . 15440 1 23 . 1 1 3 3 VAL HG22 H 1 0.923 0.100 . 1 . . . . 3 VAL HG22 . 15440 1 24 . 1 1 3 3 VAL HG23 H 1 0.923 0.100 . 1 . . . . 3 VAL HG23 . 15440 1 25 . 1 1 3 3 VAL C C 13 176.056 0.300 . 1 . . . . 3 VAL C . 15440 1 26 . 1 1 3 3 VAL CA C 13 62.429 0.300 . 1 . . . . 3 VAL CA . 15440 1 27 . 1 1 3 3 VAL CB C 13 32.798 0.300 . 1 . . . . 3 VAL CB . 15440 1 28 . 1 1 3 3 VAL CG1 C 13 20.606 0.300 . 2 . . . . 3 VAL CG1 . 15440 1 29 . 1 1 3 3 VAL CG2 C 13 21.196 0.300 . 2 . . . . 3 VAL CG2 . 15440 1 30 . 1 1 3 3 VAL N N 15 123.212 0.300 . 1 . . . . 3 VAL N . 15440 1 31 . 1 1 4 4 GLN H H 1 8.531 0.100 . 1 . . . . 4 GLN H . 15440 1 32 . 1 1 4 4 GLN HA H 1 4.301 0.100 . 1 . . . . 4 GLN HA . 15440 1 33 . 1 1 4 4 GLN HB2 H 1 1.681 0.100 . 2 . . . . 4 GLN HB2 . 15440 1 34 . 1 1 4 4 GLN HB3 H 1 1.410 0.100 . 2 . . . . 4 GLN HB3 . 15440 1 35 . 1 1 4 4 GLN HE21 H 1 7.580 0.100 . 1 . . . . 4 GLN HE21 . 15440 1 36 . 1 1 4 4 GLN HE22 H 1 6.885 0.100 . 1 . . . . 4 GLN HE22 . 15440 1 37 . 1 1 4 4 GLN HG2 H 1 2.351 0.100 . 1 . . . . 4 GLN HG2 . 15440 1 38 . 1 1 4 4 GLN HG3 H 1 2.351 0.100 . 1 . . . . 4 GLN HG3 . 15440 1 39 . 1 1 4 4 GLN C C 13 175.805 0.300 . 1 . . . . 4 GLN C . 15440 1 40 . 1 1 4 4 GLN CA C 13 55.798 0.300 . 1 . . . . 4 GLN CA . 15440 1 41 . 1 1 4 4 GLN CB C 13 29.494 0.300 . 1 . . . . 4 GLN CB . 15440 1 42 . 1 1 4 4 GLN CD C 13 180.490 0.300 . 1 . . . . 4 GLN CD . 15440 1 43 . 1 1 4 4 GLN CG C 13 33.757 0.300 . 1 . . . . 4 GLN CG . 15440 1 44 . 1 1 4 4 GLN N N 15 124.648 0.300 . 1 . . . . 4 GLN N . 15440 1 45 . 1 1 4 4 GLN NE2 N 15 112.500 0.300 . 1 . . . . 4 GLN NE2 . 15440 1 46 . 1 1 5 5 GLU H H 1 8.509 0.100 . 1 . . . . 5 GLU H . 15440 1 47 . 1 1 5 5 GLU HA H 1 4.230 0.100 . 1 . . . . 5 GLU HA . 15440 1 48 . 1 1 5 5 GLU HB2 H 1 2.250 0.100 . 1 . . . . 5 GLU HB2 . 15440 1 49 . 1 1 5 5 GLU HB3 H 1 2.250 0.100 . 1 . . . . 5 GLU HB3 . 15440 1 50 . 1 1 5 5 GLU HG2 H 1 2.018 0.100 . 2 . . . . 5 GLU HG2 . 15440 1 51 . 1 1 5 5 GLU HG3 H 1 1.927 0.100 . 2 . . . . 5 GLU HG3 . 15440 1 52 . 1 1 5 5 GLU C C 13 175.380 0.300 . 1 . . . . 5 GLU C . 15440 1 53 . 1 1 5 5 GLU CA C 13 56.659 0.300 . 1 . . . . 5 GLU CA . 15440 1 54 . 1 1 5 5 GLU CB C 13 30.448 0.300 . 1 . . . . 5 GLU CB . 15440 1 55 . 1 1 5 5 GLU CG C 13 36.344 0.300 . 1 . . . . 5 GLU CG . 15440 1 56 . 1 1 5 5 GLU N N 15 123.348 0.300 . 1 . . . . 5 GLU N . 15440 1 57 . 1 1 6 6 GLN H H 1 8.483 0.100 . 1 . . . . 6 GLN H . 15440 1 58 . 1 1 6 6 GLN HA H 1 4.333 0.100 . 1 . . . . 6 GLN HA . 15440 1 59 . 1 1 6 6 GLN HB2 H 1 2.090 0.100 . 2 . . . . 6 GLN HB2 . 15440 1 60 . 1 1 6 6 GLN HB3 H 1 2.357 0.100 . 2 . . . . 6 GLN HB3 . 15440 1 61 . 1 1 6 6 GLN HE21 H 1 6.792 0.100 . 1 . . . . 6 GLN HE21 . 15440 1 62 . 1 1 6 6 GLN HE22 H 1 7.549 0.100 . 1 . . . . 6 GLN HE22 . 15440 1 63 . 1 1 6 6 GLN HG2 H 1 1.950 0.100 . 1 . . . . 6 GLN HG2 . 15440 1 64 . 1 1 6 6 GLN HG3 H 1 1.950 0.100 . 1 . . . . 6 GLN HG3 . 15440 1 65 . 1 1 6 6 GLN C C 13 175.904 0.300 . 1 . . . . 6 GLN C . 15440 1 66 . 1 1 6 6 GLN CA C 13 55.848 0.300 . 1 . . . . 6 GLN CA . 15440 1 67 . 1 1 6 6 GLN CB C 13 29.647 0.300 . 1 . . . . 6 GLN CB . 15440 1 68 . 1 1 6 6 GLN CD C 13 180.636 0.300 . 1 . . . . 6 GLN CD . 15440 1 69 . 1 1 6 6 GLN CG C 13 33.792 0.300 . 1 . . . . 6 GLN CG . 15440 1 70 . 1 1 6 6 GLN N N 15 121.537 0.300 . 1 . . . . 6 GLN N . 15440 1 71 . 1 1 6 6 GLN NE2 N 15 111.700 0.300 . 1 . . . . 6 GLN NE2 . 15440 1 72 . 1 1 7 7 SER H H 1 8.434 0.100 . 1 . . . . 7 SER H . 15440 1 73 . 1 1 7 7 SER HA H 1 4.449 0.100 . 1 . . . . 7 SER HA . 15440 1 74 . 1 1 7 7 SER HB2 H 1 3.830 0.100 . 1 . . . . 7 SER HB2 . 15440 1 75 . 1 1 7 7 SER HB3 H 1 3.830 0.100 . 1 . . . . 7 SER HB3 . 15440 1 76 . 1 1 7 7 SER C C 13 174.560 0.300 . 1 . . . . 7 SER C . 15440 1 77 . 1 1 7 7 SER CA C 13 58.311 0.300 . 1 . . . . 7 SER CA . 15440 1 78 . 1 1 7 7 SER CB C 13 63.721 0.300 . 1 . . . . 7 SER CB . 15440 1 79 . 1 1 7 7 SER N N 15 117.712 0.300 . 1 . . . . 7 SER N . 15440 1 80 . 1 1 8 8 VAL H H 1 8.218 0.100 . 1 . . . . 8 VAL H . 15440 1 81 . 1 1 8 8 VAL HA H 1 4.126 0.100 . 1 . . . . 8 VAL HA . 15440 1 82 . 1 1 8 8 VAL HB H 1 2.087 0.100 . 1 . . . . 8 VAL HB . 15440 1 83 . 1 1 8 8 VAL HG11 H 1 0.935 0.100 . 1 . . . . 8 VAL HG11 . 15440 1 84 . 1 1 8 8 VAL HG12 H 1 0.935 0.100 . 1 . . . . 8 VAL HG12 . 15440 1 85 . 1 1 8 8 VAL HG13 H 1 0.935 0.100 . 1 . . . . 8 VAL HG13 . 15440 1 86 . 1 1 8 8 VAL HG21 H 1 0.935 0.100 . 1 . . . . 8 VAL HG21 . 15440 1 87 . 1 1 8 8 VAL HG22 H 1 0.935 0.100 . 1 . . . . 8 VAL HG22 . 15440 1 88 . 1 1 8 8 VAL HG23 H 1 0.935 0.100 . 1 . . . . 8 VAL HG23 . 15440 1 89 . 1 1 8 8 VAL C C 13 176.635 0.300 . 1 . . . . 8 VAL C . 15440 1 90 . 1 1 8 8 VAL CA C 13 62.520 0.300 . 1 . . . . 8 VAL CA . 15440 1 91 . 1 1 8 8 VAL CB C 13 32.761 0.300 . 1 . . . . 8 VAL CB . 15440 1 92 . 1 1 8 8 VAL CG1 C 13 21.123 0.300 . 2 . . . . 8 VAL CG1 . 15440 1 93 . 1 1 8 8 VAL CG2 C 13 20.397 0.300 . 2 . . . . 8 VAL CG2 . 15440 1 94 . 1 1 8 8 VAL N N 15 121.897 0.300 . 1 . . . . 8 VAL N . 15440 1 95 . 1 1 9 9 GLY H H 1 8.435 0.100 . 1 . . . . 9 GLY H . 15440 1 96 . 1 1 9 9 GLY HA2 H 1 3.908 0.100 . 1 . . . . 9 GLY HA2 . 15440 1 97 . 1 1 9 9 GLY HA3 H 1 3.908 0.100 . 1 . . . . 9 GLY HA3 . 15440 1 98 . 1 1 9 9 GLY C C 13 173.270 0.300 . 1 . . . . 9 GLY C . 15440 1 99 . 1 1 9 9 GLY CA C 13 44.957 0.300 . 1 . . . . 9 GLY CA . 15440 1 100 . 1 1 9 9 GLY N N 15 112.689 0.300 . 1 . . . . 9 GLY N . 15440 1 101 . 1 1 10 10 ALA H H 1 8.096 0.100 . 1 . . . . 10 ALA H . 15440 1 102 . 1 1 10 10 ALA HA H 1 4.570 0.100 . 1 . . . . 10 ALA HA . 15440 1 103 . 1 1 10 10 ALA HB1 H 1 1.316 0.100 . 1 . . . . 10 ALA HB1 . 15440 1 104 . 1 1 10 10 ALA HB2 H 1 1.316 0.100 . 1 . . . . 10 ALA HB2 . 15440 1 105 . 1 1 10 10 ALA HB3 H 1 1.316 0.100 . 1 . . . . 10 ALA HB3 . 15440 1 106 . 1 1 10 10 ALA CA C 13 50.408 0.300 . 1 . . . . 10 ALA CA . 15440 1 107 . 1 1 10 10 ALA CB C 13 18.200 0.300 . 1 . . . . 10 ALA CB . 15440 1 108 . 1 1 10 10 ALA N N 15 125.010 0.300 . 1 . . . . 10 ALA N . 15440 1 109 . 1 1 13 13 PRO HA H 1 4.393 0.100 . 1 . . . . 13 PRO HA . 15440 1 110 . 1 1 13 13 PRO HB2 H 1 2.277 0.100 . 2 . . . . 13 PRO HB2 . 15440 1 111 . 1 1 13 13 PRO HB3 H 1 1.914 0.100 . 2 . . . . 13 PRO HB3 . 15440 1 112 . 1 1 13 13 PRO HD2 H 1 3.800 0.100 . 2 . . . . 13 PRO HD2 . 15440 1 113 . 1 1 13 13 PRO HD3 H 1 3.626 0.100 . 2 . . . . 13 PRO HD3 . 15440 1 114 . 1 1 13 13 PRO HG2 H 1 2.003 0.100 . 1 . . . . 13 PRO HG2 . 15440 1 115 . 1 1 13 13 PRO HG3 H 1 2.003 0.100 . 1 . . . . 13 PRO HG3 . 15440 1 116 . 1 1 13 13 PRO C C 13 177.606 0.300 . 1 . . . . 13 PRO C . 15440 1 117 . 1 1 13 13 PRO CA C 13 63.244 0.300 . 1 . . . . 13 PRO CA . 15440 1 118 . 1 1 13 13 PRO CB C 13 32.150 0.300 . 1 . . . . 13 PRO CB . 15440 1 119 . 1 1 13 13 PRO CD C 13 50.521 0.300 . 1 . . . . 13 PRO CD . 15440 1 120 . 1 1 13 13 PRO CG C 13 27.361 0.300 . 1 . . . . 13 PRO CG . 15440 1 121 . 1 1 14 14 GLY H H 1 8.458 0.100 . 1 . . . . 14 GLY H . 15440 1 122 . 1 1 14 14 GLY HA2 H 1 3.893 0.100 . 1 . . . . 14 GLY HA2 . 15440 1 123 . 1 1 14 14 GLY HA3 H 1 3.893 0.100 . 1 . . . . 14 GLY HA3 . 15440 1 124 . 1 1 14 14 GLY C C 13 174.102 0.300 . 1 . . . . 14 GLY C . 15440 1 125 . 1 1 14 14 GLY CA C 13 45.189 0.300 . 1 . . . . 14 GLY CA . 15440 1 126 . 1 1 14 14 GLY N N 15 108.974 0.300 . 1 . . . . 14 GLY N . 15440 1 127 . 1 1 15 15 ARG H H 1 8.169 0.100 . 1 . . . . 15 ARG H . 15440 1 128 . 1 1 15 15 ARG HA H 1 4.315 0.100 . 1 . . . . 15 ARG HA . 15440 1 129 . 1 1 15 15 ARG HB2 H 1 1.855 0.100 . 2 . . . . 15 ARG HB2 . 15440 1 130 . 1 1 15 15 ARG HB3 H 1 1.730 0.100 . 2 . . . . 15 ARG HB3 . 15440 1 131 . 1 1 15 15 ARG HD2 H 1 3.176 0.100 . 1 . . . . 15 ARG HD2 . 15440 1 132 . 1 1 15 15 ARG HD3 H 1 3.176 0.100 . 1 . . . . 15 ARG HD3 . 15440 1 133 . 1 1 15 15 ARG HG2 H 1 1.596 0.100 . 1 . . . . 15 ARG HG2 . 15440 1 134 . 1 1 15 15 ARG HG3 H 1 1.596 0.100 . 1 . . . . 15 ARG HG3 . 15440 1 135 . 1 1 15 15 ARG C C 13 176.206 0.300 . 1 . . . . 15 ARG C . 15440 1 136 . 1 1 15 15 ARG CA C 13 55.984 0.300 . 1 . . . . 15 ARG CA . 15440 1 137 . 1 1 15 15 ARG CB C 13 31.000 0.300 . 1 . . . . 15 ARG CB . 15440 1 138 . 1 1 15 15 ARG CD C 13 43.353 0.300 . 1 . . . . 15 ARG CD . 15440 1 139 . 1 1 15 15 ARG CG C 13 26.897 0.300 . 1 . . . . 15 ARG CG . 15440 1 140 . 1 1 15 15 ARG N N 15 120.707 0.300 . 1 . . . . 15 ARG N . 15440 1 141 . 1 1 16 16 ALA H H 1 8.435 0.100 . 1 . . . . 16 ALA H . 15440 1 142 . 1 1 16 16 ALA HA H 1 4.297 0.100 . 1 . . . . 16 ALA HA . 15440 1 143 . 1 1 16 16 ALA HB1 H 1 1.347 0.100 . 1 . . . . 16 ALA HB1 . 15440 1 144 . 1 1 16 16 ALA HB2 H 1 1.347 0.100 . 1 . . . . 16 ALA HB2 . 15440 1 145 . 1 1 16 16 ALA HB3 H 1 1.347 0.100 . 1 . . . . 16 ALA HB3 . 15440 1 146 . 1 1 16 16 ALA C C 13 177.331 0.300 . 1 . . . . 16 ALA C . 15440 1 147 . 1 1 16 16 ALA CA C 13 52.535 0.300 . 1 . . . . 16 ALA CA . 15440 1 148 . 1 1 16 16 ALA CB C 13 19.254 0.300 . 1 . . . . 16 ALA CB . 15440 1 149 . 1 1 16 16 ALA N N 15 125.487 0.300 . 1 . . . . 16 ALA N . 15440 1 150 . 1 1 17 17 ASP H H 1 8.290 0.100 . 1 . . . . 17 ASP H . 15440 1 151 . 1 1 17 17 ASP HA H 1 4.551 0.100 . 1 . . . . 17 ASP HA . 15440 1 152 . 1 1 17 17 ASP HB2 H 1 2.664 0.100 . 2 . . . . 17 ASP HB2 . 15440 1 153 . 1 1 17 17 ASP HB3 H 1 2.620 0.100 . 2 . . . . 17 ASP HB3 . 15440 1 154 . 1 1 17 17 ASP C C 13 176.452 0.300 . 1 . . . . 17 ASP C . 15440 1 155 . 1 1 17 17 ASP CA C 13 54.187 0.300 . 1 . . . . 17 ASP CA . 15440 1 156 . 1 1 17 17 ASP CB C 13 41.135 0.300 . 1 . . . . 17 ASP CB . 15440 1 157 . 1 1 17 17 ASP N N 15 119.499 0.300 . 1 . . . . 17 ASP N . 15440 1 158 . 1 1 18 18 LYS H H 1 8.314 0.100 . 1 . . . . 18 LYS H . 15440 1 159 . 1 1 18 18 LYS HA H 1 4.328 0.100 . 1 . . . . 18 LYS HA . 15440 1 160 . 1 1 18 18 LYS HB2 H 1 1.876 0.100 . 1 . . . . 18 LYS HB2 . 15440 1 161 . 1 1 18 18 LYS HB3 H 1 1.876 0.100 . 1 . . . . 18 LYS HB3 . 15440 1 162 . 1 1 18 18 LYS HD2 H 1 1.721 0.100 . 2 . . . . 18 LYS HD2 . 15440 1 163 . 1 1 18 18 LYS HD3 H 1 1.666 0.100 . 2 . . . . 18 LYS HD3 . 15440 1 164 . 1 1 18 18 LYS HE2 H 1 2.977 0.100 . 1 . . . . 18 LYS HE2 . 15440 1 165 . 1 1 18 18 LYS HE3 H 1 2.977 0.100 . 1 . . . . 18 LYS HE3 . 15440 1 166 . 1 1 18 18 LYS HG2 H 1 1.431 0.100 . 2 . . . . 18 LYS HG2 . 15440 1 167 . 1 1 18 18 LYS HG3 H 1 1.410 0.100 . 2 . . . . 18 LYS HG3 . 15440 1 168 . 1 1 18 18 LYS C C 13 176.816 0.300 . 1 . . . . 18 LYS C . 15440 1 169 . 1 1 18 18 LYS CA C 13 56.515 0.300 . 1 . . . . 18 LYS CA . 15440 1 170 . 1 1 18 18 LYS CB C 13 32.795 0.300 . 1 . . . . 18 LYS CB . 15440 1 171 . 1 1 18 18 LYS CD C 13 28.888 0.300 . 1 . . . . 18 LYS CD . 15440 1 172 . 1 1 18 18 LYS CE C 13 42.410 0.300 . 1 . . . . 18 LYS CE . 15440 1 173 . 1 1 18 18 LYS CG C 13 24.494 0.300 . 1 . . . . 18 LYS CG . 15440 1 174 . 1 1 18 18 LYS N N 15 121.653 0.300 . 1 . . . . 18 LYS N . 15440 1 175 . 1 1 19 19 THR H H 1 8.170 0.100 . 1 . . . . 19 THR H . 15440 1 176 . 1 1 19 19 THR HA H 1 4.225 0.100 . 1 . . . . 19 THR HA . 15440 1 177 . 1 1 19 19 THR HB H 1 4.177 0.100 . 1 . . . . 19 THR HB . 15440 1 178 . 1 1 19 19 THR HG21 H 1 1.191 0.100 . 1 . . . . 19 THR HG21 . 15440 1 179 . 1 1 19 19 THR HG22 H 1 1.191 0.100 . 1 . . . . 19 THR HG22 . 15440 1 180 . 1 1 19 19 THR HG23 H 1 1.191 0.100 . 1 . . . . 19 THR HG23 . 15440 1 181 . 1 1 19 19 THR C C 13 174.159 0.300 . 1 . . . . 19 THR C . 15440 1 182 . 1 1 19 19 THR CA C 13 62.159 0.300 . 1 . . . . 19 THR CA . 15440 1 183 . 1 1 19 19 THR CB C 13 69.714 0.300 . 1 . . . . 19 THR CB . 15440 1 184 . 1 1 19 19 THR CG2 C 13 21.605 0.300 . 1 . . . . 19 THR CG2 . 15440 1 185 . 1 1 19 19 THR N N 15 114.957 0.300 . 1 . . . . 19 THR N . 15440 1 186 . 1 1 20 20 ALA H H 1 8.194 0.100 . 1 . . . . 20 ALA H . 15440 1 187 . 1 1 20 20 ALA HA H 1 4.295 0.100 . 1 . . . . 20 ALA HA . 15440 1 188 . 1 1 20 20 ALA HB1 H 1 1.340 0.100 . 1 . . . . 20 ALA HB1 . 15440 1 189 . 1 1 20 20 ALA HB2 H 1 1.340 0.100 . 1 . . . . 20 ALA HB2 . 15440 1 190 . 1 1 20 20 ALA HB3 H 1 1.340 0.100 . 1 . . . . 20 ALA HB3 . 15440 1 191 . 1 1 20 20 ALA C C 13 176.940 0.300 . 1 . . . . 20 ALA C . 15440 1 192 . 1 1 20 20 ALA CA C 13 52.195 0.300 . 1 . . . . 20 ALA CA . 15440 1 193 . 1 1 20 20 ALA CB C 13 19.434 0.300 . 1 . . . . 20 ALA CB . 15440 1 194 . 1 1 20 20 ALA N N 15 126.681 0.300 . 1 . . . . 20 ALA N . 15440 1 195 . 1 1 21 21 ALA H H 1 8.266 0.100 . 1 . . . . 21 ALA H . 15440 1 196 . 1 1 21 21 ALA HA H 1 4.540 0.100 . 1 . . . . 21 ALA HA . 15440 1 197 . 1 1 21 21 ALA HB1 H 1 1.335 0.100 . 1 . . . . 21 ALA HB1 . 15440 1 198 . 1 1 21 21 ALA HB2 H 1 1.335 0.100 . 1 . . . . 21 ALA HB2 . 15440 1 199 . 1 1 21 21 ALA HB3 H 1 1.335 0.100 . 1 . . . . 21 ALA HB3 . 15440 1 200 . 1 1 21 21 ALA CA C 13 50.547 0.300 . 1 . . . . 21 ALA CA . 15440 1 201 . 1 1 21 21 ALA CB C 13 18.082 0.300 . 1 . . . . 21 ALA CB . 15440 1 202 . 1 1 21 21 ALA N N 15 125.124 0.300 . 1 . . . . 21 ALA N . 15440 1 203 . 1 1 22 22 PRO HA H 1 4.375 0.100 . 1 . . . . 22 PRO HA . 15440 1 204 . 1 1 22 22 PRO HB2 H 1 2.274 0.100 . 2 . . . . 22 PRO HB2 . 15440 1 205 . 1 1 22 22 PRO HB3 H 1 1.870 0.100 . 2 . . . . 22 PRO HB3 . 15440 1 206 . 1 1 22 22 PRO HD2 H 1 3.780 0.100 . 2 . . . . 22 PRO HD2 . 15440 1 207 . 1 1 22 22 PRO HD3 H 1 3.560 0.100 . 2 . . . . 22 PRO HD3 . 15440 1 208 . 1 1 22 22 PRO HG2 H 1 2.009 0.100 . 1 . . . . 22 PRO HG2 . 15440 1 209 . 1 1 22 22 PRO HG3 H 1 2.009 0.100 . 1 . . . . 22 PRO HG3 . 15440 1 210 . 1 1 22 22 PRO C C 13 177.042 0.300 . 1 . . . . 22 PRO C . 15440 1 211 . 1 1 22 22 PRO CA C 13 63.199 0.300 . 1 . . . . 22 PRO CA . 15440 1 212 . 1 1 22 22 PRO CB C 13 32.080 0.300 . 1 . . . . 22 PRO CB . 15440 1 213 . 1 1 22 22 PRO CD C 13 50.564 0.300 . 1 . . . . 22 PRO CD . 15440 1 214 . 1 1 22 22 PRO CG C 13 27.434 0.300 . 1 . . . . 22 PRO CG . 15440 1 215 . 1 1 23 23 GLN H H 1 8.579 0.100 . 1 . . . . 23 GLN H . 15440 1 216 . 1 1 23 23 GLN HA H 1 4.329 0.100 . 1 . . . . 23 GLN HA . 15440 1 217 . 1 1 23 23 GLN HB2 H 1 2.379 0.100 . 1 . . . . 23 GLN HB2 . 15440 1 218 . 1 1 23 23 GLN HB3 H 1 2.379 0.100 . 1 . . . . 23 GLN HB3 . 15440 1 219 . 1 1 23 23 GLN HG2 H 1 2.101 0.100 . 2 . . . . 23 GLN HG2 . 15440 1 220 . 1 1 23 23 GLN HG3 H 1 1.981 0.100 . 2 . . . . 23 GLN HG3 . 15440 1 221 . 1 1 23 23 GLN C C 13 176.254 0.300 . 1 . . . . 23 GLN C . 15440 1 222 . 1 1 23 23 GLN CA C 13 55.955 0.300 . 1 . . . . 23 GLN CA . 15440 1 223 . 1 1 23 23 GLN CB C 13 29.497 0.300 . 1 . . . . 23 GLN CB . 15440 1 224 . 1 1 23 23 GLN CG C 13 33.958 0.300 . 1 . . . . 23 GLN CG . 15440 1 225 . 1 1 23 23 GLN N N 15 120.579 0.300 . 1 . . . . 23 GLN N . 15440 1 226 . 1 1 24 24 THR H H 1 8.194 0.100 . 1 . . . . 24 THR H . 15440 1 227 . 1 1 24 24 THR HA H 1 4.138 0.100 . 1 . . . . 24 THR HA . 15440 1 228 . 1 1 24 24 THR HB H 1 3.903 0.100 . 1 . . . . 24 THR HB . 15440 1 229 . 1 1 24 24 THR HG21 H 1 1.164 0.100 . 1 . . . . 24 THR HG21 . 15440 1 230 . 1 1 24 24 THR HG22 H 1 1.164 0.100 . 1 . . . . 24 THR HG22 . 15440 1 231 . 1 1 24 24 THR HG23 H 1 1.164 0.100 . 1 . . . . 24 THR HG23 . 15440 1 232 . 1 1 24 24 THR C C 13 176.278 0.300 . 1 . . . . 24 THR C . 15440 1 233 . 1 1 24 24 THR CA C 13 62.066 0.300 . 1 . . . . 24 THR CA . 15440 1 234 . 1 1 24 24 THR CB C 13 69.835 0.300 . 1 . . . . 24 THR CB . 15440 1 235 . 1 1 24 24 THR CG2 C 13 21.582 0.300 . 1 . . . . 24 THR CG2 . 15440 1 236 . 1 1 24 24 THR N N 15 116.036 0.300 . 1 . . . . 24 THR N . 15440 1 237 . 1 1 25 25 ARG H H 1 8.376 0.100 . 1 . . . . 25 ARG H . 15440 1 238 . 1 1 25 25 ARG HA H 1 4.325 0.100 . 1 . . . . 25 ARG HA . 15440 1 239 . 1 1 25 25 ARG HB2 H 1 1.730 0.100 . 1 . . . . 25 ARG HB2 . 15440 1 240 . 1 1 25 25 ARG HB3 H 1 1.730 0.100 . 1 . . . . 25 ARG HB3 . 15440 1 241 . 1 1 25 25 ARG HD2 H 1 3.144 0.100 . 1 . . . . 25 ARG HD2 . 15440 1 242 . 1 1 25 25 ARG HD3 H 1 3.144 0.100 . 1 . . . . 25 ARG HD3 . 15440 1 243 . 1 1 25 25 ARG HG2 H 1 1.590 0.100 . 1 . . . . 25 ARG HG2 . 15440 1 244 . 1 1 25 25 ARG HG3 H 1 1.590 0.100 . 1 . . . . 25 ARG HG3 . 15440 1 245 . 1 1 25 25 ARG C C 13 175.937 0.300 . 1 . . . . 25 ARG C . 15440 1 246 . 1 1 25 25 ARG CA C 13 56.120 0.300 . 1 . . . . 25 ARG CA . 15440 1 247 . 1 1 25 25 ARG CB C 13 30.941 0.300 . 1 . . . . 25 ARG CB . 15440 1 248 . 1 1 25 25 ARG CD C 13 43.472 0.300 . 1 . . . . 25 ARG CD . 15440 1 249 . 1 1 25 25 ARG CG C 13 27.117 0.300 . 1 . . . . 25 ARG CG . 15440 1 250 . 1 1 25 25 ARG N N 15 123.919 0.300 . 1 . . . . 25 ARG N . 15440 1 251 . 1 1 26 26 LEU H H 1 8.365 0.100 . 1 . . . . 26 LEU H . 15440 1 252 . 1 1 26 26 LEU HA H 1 4.374 0.100 . 1 . . . . 26 LEU HA . 15440 1 253 . 1 1 26 26 LEU HB2 H 1 1.534 0.100 . 2 . . . . 26 LEU HB2 . 15440 1 254 . 1 1 26 26 LEU HB3 H 1 1.588 0.100 . 2 . . . . 26 LEU HB3 . 15440 1 255 . 1 1 26 26 LEU HD11 H 1 0.838 0.100 . 1 . . . . 26 LEU HD11 . 15440 1 256 . 1 1 26 26 LEU HD12 H 1 0.838 0.100 . 1 . . . . 26 LEU HD12 . 15440 1 257 . 1 1 26 26 LEU HD13 H 1 0.838 0.100 . 1 . . . . 26 LEU HD13 . 15440 1 258 . 1 1 26 26 LEU HD21 H 1 0.838 0.100 . 1 . . . . 26 LEU HD21 . 15440 1 259 . 1 1 26 26 LEU HD22 H 1 0.838 0.100 . 1 . . . . 26 LEU HD22 . 15440 1 260 . 1 1 26 26 LEU HD23 H 1 0.838 0.100 . 1 . . . . 26 LEU HD23 . 15440 1 261 . 1 1 26 26 LEU HG H 1 1.408 0.100 . 1 . . . . 26 LEU HG . 15440 1 262 . 1 1 26 26 LEU C C 13 177.203 0.300 . 1 . . . . 26 LEU C . 15440 1 263 . 1 1 26 26 LEU CA C 13 55.076 0.300 . 1 . . . . 26 LEU CA . 15440 1 264 . 1 1 26 26 LEU CB C 13 42.433 0.300 . 1 . . . . 26 LEU CB . 15440 1 265 . 1 1 26 26 LEU CD1 C 13 23.232 0.300 . 2 . . . . 26 LEU CD1 . 15440 1 266 . 1 1 26 26 LEU CD2 C 13 24.878 0.300 . 2 . . . . 26 LEU CD2 . 15440 1 267 . 1 1 26 26 LEU CG C 13 26.903 0.300 . 1 . . . . 26 LEU CG . 15440 1 268 . 1 1 26 26 LEU N N 15 123.550 0.300 . 1 . . . . 26 LEU N . 15440 1 269 . 1 1 27 27 THR H H 1 8.097 0.100 . 1 . . . . 27 THR H . 15440 1 270 . 1 1 27 27 THR HA H 1 4.556 0.100 . 1 . . . . 27 THR HA . 15440 1 271 . 1 1 27 27 THR HB H 1 4.139 0.100 . 1 . . . . 27 THR HB . 15440 1 272 . 1 1 27 27 THR HG21 H 1 1.178 0.100 . 1 . . . . 27 THR HG21 . 15440 1 273 . 1 1 27 27 THR HG22 H 1 1.178 0.100 . 1 . . . . 27 THR HG22 . 15440 1 274 . 1 1 27 27 THR HG23 H 1 1.178 0.100 . 1 . . . . 27 THR HG23 . 15440 1 275 . 1 1 27 27 THR CA C 13 59.542 0.300 . 1 . . . . 27 THR CA . 15440 1 276 . 1 1 27 27 THR CB C 13 69.586 0.300 . 1 . . . . 27 THR CB . 15440 1 277 . 1 1 27 27 THR N N 15 116.750 0.300 . 1 . . . . 27 THR N . 15440 1 278 . 1 1 28 28 PRO HA H 1 4.320 0.100 . 1 . . . . 28 PRO HA . 15440 1 279 . 1 1 28 28 PRO HB2 H 1 2.178 0.100 . 2 . . . . 28 PRO HB2 . 15440 1 280 . 1 1 28 28 PRO HB3 H 1 1.731 0.100 . 2 . . . . 28 PRO HB3 . 15440 1 281 . 1 1 28 28 PRO HD2 H 1 3.766 0.100 . 2 . . . . 28 PRO HD2 . 15440 1 282 . 1 1 28 28 PRO HD3 H 1 3.599 0.100 . 2 . . . . 28 PRO HD3 . 15440 1 283 . 1 1 28 28 PRO HG2 H 1 1.887 0.100 . 1 . . . . 28 PRO HG2 . 15440 1 284 . 1 1 28 28 PRO HG3 H 1 1.887 0.100 . 1 . . . . 28 PRO HG3 . 15440 1 285 . 1 1 28 28 PRO C C 13 176.668 0.300 . 1 . . . . 28 PRO C . 15440 1 286 . 1 1 28 28 PRO CA C 13 63.429 0.300 . 1 . . . . 28 PRO CA . 15440 1 287 . 1 1 28 28 PRO CB C 13 31.954 0.300 . 1 . . . . 28 PRO CB . 15440 1 288 . 1 1 28 28 PRO CD C 13 50.700 0.300 . 1 . . . . 28 PRO CD . 15440 1 289 . 1 1 28 28 PRO CG C 13 27.291 0.300 . 1 . . . . 28 PRO CG . 15440 1 290 . 1 1 29 29 TYR H H 1 8.073 0.100 . 1 . . . . 29 TYR H . 15440 1 291 . 1 1 29 29 TYR HA H 1 4.468 0.100 . 1 . . . . 29 TYR HA . 15440 1 292 . 1 1 29 29 TYR HB2 H 1 2.940 0.100 . 2 . . . . 29 TYR HB2 . 15440 1 293 . 1 1 29 29 TYR HB3 H 1 3.014 0.100 . 2 . . . . 29 TYR HB3 . 15440 1 294 . 1 1 29 29 TYR HD1 H 1 7.100 0.100 . 3 . . . . 29 TYR HD1 . 15440 1 295 . 1 1 29 29 TYR HD2 H 1 7.100 0.100 . 3 . . . . 29 TYR HD2 . 15440 1 296 . 1 1 29 29 TYR HE1 H 1 6.797 0.100 . 3 . . . . 29 TYR HE1 . 15440 1 297 . 1 1 29 29 TYR HE2 H 1 6.797 0.100 . 3 . . . . 29 TYR HE2 . 15440 1 298 . 1 1 29 29 TYR C C 13 175.620 0.300 . 1 . . . . 29 TYR C . 15440 1 299 . 1 1 29 29 TYR CA C 13 57.935 0.300 . 1 . . . . 29 TYR CA . 15440 1 300 . 1 1 29 29 TYR CB C 13 38.840 0.300 . 1 . . . . 29 TYR CB . 15440 1 301 . 1 1 29 29 TYR CD1 C 13 132.990 0.300 . 3 . . . . 29 TYR CD1 . 15440 1 302 . 1 1 29 29 TYR CD2 C 13 132.990 0.300 . 3 . . . . 29 TYR CD2 . 15440 1 303 . 1 1 29 29 TYR CE1 C 13 118.300 0.300 . 3 . . . . 29 TYR CE1 . 15440 1 304 . 1 1 29 29 TYR CE2 C 13 118.300 0.300 . 3 . . . . 29 TYR CE2 . 15440 1 305 . 1 1 29 29 TYR N N 15 119.981 0.300 . 1 . . . . 29 TYR N . 15440 1 306 . 1 1 30 30 ALA H H 1 8.086 0.100 . 1 . . . . 30 ALA H . 15440 1 307 . 1 1 30 30 ALA HA H 1 4.248 0.100 . 1 . . . . 30 ALA HA . 15440 1 308 . 1 1 30 30 ALA HB1 H 1 1.311 0.100 . 1 . . . . 30 ALA HB1 . 15440 1 309 . 1 1 30 30 ALA HB2 H 1 1.311 0.100 . 1 . . . . 30 ALA HB2 . 15440 1 310 . 1 1 30 30 ALA HB3 H 1 1.311 0.100 . 1 . . . . 30 ALA HB3 . 15440 1 311 . 1 1 30 30 ALA C C 13 177.322 0.300 . 1 . . . . 30 ALA C . 15440 1 312 . 1 1 30 30 ALA CA C 13 52.493 0.300 . 1 . . . . 30 ALA CA . 15440 1 313 . 1 1 30 30 ALA CB C 13 19.495 0.300 . 1 . . . . 30 ALA CB . 15440 1 314 . 1 1 30 30 ALA N N 15 125.661 0.300 . 1 . . . . 30 ALA N . 15440 1 315 . 1 1 31 31 GLN H H 1 8.245 0.100 . 1 . . . . 31 GLN H . 15440 1 316 . 1 1 31 31 GLN HA H 1 4.236 0.100 . 1 . . . . 31 GLN HA . 15440 1 317 . 1 1 31 31 GLN HB2 H 1 2.075 0.100 . 2 . . . . 31 GLN HB2 . 15440 1 318 . 1 1 31 31 GLN HB3 H 1 1.965 0.100 . 2 . . . . 31 GLN HB3 . 15440 1 319 . 1 1 31 31 GLN HE21 H 1 6.879 0.100 . 1 . . . . 31 GLN HE21 . 15440 1 320 . 1 1 31 31 GLN HE22 H 1 7.580 0.100 . 1 . . . . 31 GLN HE22 . 15440 1 321 . 1 1 31 31 GLN HG2 H 1 2.360 0.100 . 2 . . . . 31 GLN HG2 . 15440 1 322 . 1 1 31 31 GLN HG3 H 1 2.345 0.100 . 2 . . . . 31 GLN HG3 . 15440 1 323 . 1 1 31 31 GLN C C 13 175.807 0.300 . 1 . . . . 31 GLN C . 15440 1 324 . 1 1 31 31 GLN CA C 13 55.856 0.300 . 1 . . . . 31 GLN CA . 15440 1 325 . 1 1 31 31 GLN CB C 13 29.375 0.300 . 1 . . . . 31 GLN CB . 15440 1 326 . 1 1 31 31 GLN CD C 13 180.430 0.300 . 1 . . . . 31 GLN CD . 15440 1 327 . 1 1 31 31 GLN CG C 13 33.894 0.300 . 1 . . . . 31 GLN CG . 15440 1 328 . 1 1 31 31 GLN N N 15 119.736 0.300 . 1 . . . . 31 GLN N . 15440 1 329 . 1 1 31 31 GLN NE2 N 15 112.102 0.300 . 1 . . . . 31 GLN NE2 . 15440 1 330 . 1 1 32 32 ALA H H 1 8.362 0.100 . 1 . . . . 32 ALA H . 15440 1 331 . 1 1 32 32 ALA HA H 1 4.301 0.100 . 1 . . . . 32 ALA HA . 15440 1 332 . 1 1 32 32 ALA HB1 H 1 1.387 0.100 . 1 . . . . 32 ALA HB1 . 15440 1 333 . 1 1 32 32 ALA HB2 H 1 1.387 0.100 . 1 . . . . 32 ALA HB2 . 15440 1 334 . 1 1 32 32 ALA HB3 H 1 1.387 0.100 . 1 . . . . 32 ALA HB3 . 15440 1 335 . 1 1 32 32 ALA C C 13 178.294 0.300 . 1 . . . . 32 ALA C . 15440 1 336 . 1 1 32 32 ALA CA C 13 52.900 0.300 . 1 . . . . 32 ALA CA . 15440 1 337 . 1 1 32 32 ALA CB C 13 19.258 0.300 . 1 . . . . 32 ALA CB . 15440 1 338 . 1 1 32 32 ALA N N 15 125.239 0.300 . 1 . . . . 32 ALA N . 15440 1 339 . 1 1 33 33 GLY H H 1 8.386 0.100 . 1 . . . . 33 GLY H . 15440 1 340 . 1 1 33 33 GLY HA2 H 1 3.953 0.100 . 1 . . . . 33 GLY HA2 . 15440 1 341 . 1 1 33 33 GLY HA3 H 1 3.953 0.100 . 1 . . . . 33 GLY HA3 . 15440 1 342 . 1 1 33 33 GLY C C 13 174.490 0.300 . 1 . . . . 33 GLY C . 15440 1 343 . 1 1 33 33 GLY CA C 13 45.493 0.300 . 1 . . . . 33 GLY CA . 15440 1 344 . 1 1 33 33 GLY N N 15 108.255 0.300 . 1 . . . . 33 GLY N . 15440 1 345 . 1 1 34 34 GLU H H 1 8.282 0.100 . 1 . . . . 34 GLU H . 15440 1 346 . 1 1 34 34 GLU HA H 1 4.242 0.100 . 1 . . . . 34 GLU HA . 15440 1 347 . 1 1 34 34 GLU HB2 H 1 1.932 0.100 . 1 . . . . 34 GLU HB2 . 15440 1 348 . 1 1 34 34 GLU HB3 H 1 1.932 0.100 . 1 . . . . 34 GLU HB3 . 15440 1 349 . 1 1 34 34 GLU HG2 H 1 2.249 0.100 . 1 . . . . 34 GLU HG2 . 15440 1 350 . 1 1 34 34 GLU HG3 H 1 2.249 0.100 . 1 . . . . 34 GLU HG3 . 15440 1 351 . 1 1 34 34 GLU C C 13 176.436 0.300 . 1 . . . . 34 GLU C . 15440 1 352 . 1 1 34 34 GLU CA C 13 56.966 0.300 . 1 . . . . 34 GLU CA . 15440 1 353 . 1 1 34 34 GLU CB C 13 30.426 0.300 . 1 . . . . 34 GLU CB . 15440 1 354 . 1 1 34 34 GLU CG C 13 36.369 0.300 . 1 . . . . 34 GLU CG . 15440 1 355 . 1 1 34 34 GLU N N 15 120.684 0.300 . 1 . . . . 34 GLU N . 15440 1 356 . 1 1 35 35 ASP H H 1 8.508 0.100 . 1 . . . . 35 ASP H . 15440 1 357 . 1 1 35 35 ASP HA H 1 4.570 0.100 . 1 . . . . 35 ASP HA . 15440 1 358 . 1 1 35 35 ASP HB2 H 1 2.700 0.100 . 1 . . . . 35 ASP HB2 . 15440 1 359 . 1 1 35 35 ASP HB3 H 1 2.700 0.100 . 1 . . . . 35 ASP HB3 . 15440 1 360 . 1 1 35 35 ASP CA C 13 54.616 0.300 . 1 . . . . 35 ASP CA . 15440 1 361 . 1 1 35 35 ASP CB C 13 41.114 0.300 . 1 . . . . 35 ASP CB . 15440 1 362 . 1 1 35 35 ASP N N 15 121.058 0.300 . 1 . . . . 35 ASP N . 15440 1 363 . 1 1 36 36 ASN H H 1 8.556 0.100 . 1 . . . . 36 ASN H . 15440 1 364 . 1 1 36 36 ASN HA H 1 4.287 0.100 . 1 . . . . 36 ASN HA . 15440 1 365 . 1 1 36 36 ASN HB2 H 1 2.950 0.100 . 2 . . . . 36 ASN HB2 . 15440 1 366 . 1 1 36 36 ASN HB3 H 1 2.200 0.100 . 2 . . . . 36 ASN HB3 . 15440 1 367 . 1 1 36 36 ASN HD21 H 1 6.830 0.100 . 1 . . . . 36 ASN HD21 . 15440 1 368 . 1 1 36 36 ASN HD22 H 1 6.670 0.100 . 1 . . . . 36 ASN HD22 . 15440 1 369 . 1 1 36 36 ASN C C 13 176.220 0.300 . 1 . . . . 36 ASN C . 15440 1 370 . 1 1 36 36 ASN CA C 13 56.210 0.300 . 1 . . . . 36 ASN CA . 15440 1 371 . 1 1 36 36 ASN CB C 13 32.920 0.300 . 1 . . . . 36 ASN CB . 15440 1 372 . 1 1 36 36 ASN N N 15 121.687 0.300 . 1 . . . . 36 ASN N . 15440 1 373 . 1 1 36 36 ASN ND2 N 15 114.480 0.300 . 1 . . . . 36 ASN ND2 . 15440 1 374 . 1 1 37 37 TRP H H 1 8.265 0.100 . 1 . . . . 37 TRP H . 15440 1 375 . 1 1 37 37 TRP HA H 1 4.533 0.100 . 1 . . . . 37 TRP HA . 15440 1 376 . 1 1 37 37 TRP HB2 H 1 3.360 0.100 . 2 . . . . 37 TRP HB2 . 15440 1 377 . 1 1 37 37 TRP HB3 H 1 3.290 0.100 . 2 . . . . 37 TRP HB3 . 15440 1 378 . 1 1 37 37 TRP HD1 H 1 7.496 0.100 . 1 . . . . 37 TRP HD1 . 15440 1 379 . 1 1 37 37 TRP HE1 H 1 10.500 0.100 . 1 . . . . 37 TRP HE1 . 15440 1 380 . 1 1 37 37 TRP HE3 H 1 6.939 0.100 . 1 . . . . 37 TRP HE3 . 15440 1 381 . 1 1 37 37 TRP HH2 H 1 7.270 0.100 . 1 . . . . 37 TRP HH2 . 15440 1 382 . 1 1 37 37 TRP HZ2 H 1 7.476 0.100 . 1 . . . . 37 TRP HZ2 . 15440 1 383 . 1 1 37 37 TRP HZ3 H 1 7.090 0.100 . 1 . . . . 37 TRP HZ3 . 15440 1 384 . 1 1 37 37 TRP CA C 13 55.225 0.300 . 1 . . . . 37 TRP CA . 15440 1 385 . 1 1 37 37 TRP CB C 13 30.950 0.300 . 1 . . . . 37 TRP CB . 15440 1 386 . 1 1 37 37 TRP CD1 C 13 127.990 0.300 . 1 . . . . 37 TRP CD1 . 15440 1 387 . 1 1 37 37 TRP CE3 C 13 121.740 0.300 . 1 . . . . 37 TRP CE3 . 15440 1 388 . 1 1 37 37 TRP CH2 C 13 120.178 0.300 . 1 . . . . 37 TRP CH2 . 15440 1 389 . 1 1 37 37 TRP CZ2 C 13 114.550 0.300 . 1 . . . . 37 TRP CZ2 . 15440 1 390 . 1 1 37 37 TRP CZ3 C 13 124.240 0.300 . 1 . . . . 37 TRP CZ3 . 15440 1 391 . 1 1 37 37 TRP N N 15 124.338 0.300 . 1 . . . . 37 TRP N . 15440 1 392 . 1 1 37 37 TRP NE1 N 15 131.224 0.300 . 1 . . . . 37 TRP NE1 . 15440 1 393 . 1 1 38 38 ARG H H 1 8.203 0.100 . 1 . . . . 38 ARG H . 15440 1 394 . 1 1 38 38 ARG HA H 1 4.811 0.100 . 1 . . . . 38 ARG HA . 15440 1 395 . 1 1 38 38 ARG HB2 H 1 2.020 0.100 . 2 . . . . 38 ARG HB2 . 15440 1 396 . 1 1 38 38 ARG HB3 H 1 1.860 0.100 . 2 . . . . 38 ARG HB3 . 15440 1 397 . 1 1 38 38 ARG HD2 H 1 3.400 0.100 . 2 . . . . 38 ARG HD2 . 15440 1 398 . 1 1 38 38 ARG HD3 H 1 2.807 0.100 . 2 . . . . 38 ARG HD3 . 15440 1 399 . 1 1 38 38 ARG HG2 H 1 1.377 0.100 . 1 . . . . 38 ARG HG2 . 15440 1 400 . 1 1 38 38 ARG HG3 H 1 1.377 0.100 . 1 . . . . 38 ARG HG3 . 15440 1 401 . 1 1 38 38 ARG C C 13 178.894 0.300 . 1 . . . . 38 ARG C . 15440 1 402 . 1 1 38 38 ARG CA C 13 60.431 0.300 . 1 . . . . 38 ARG CA . 15440 1 403 . 1 1 38 38 ARG CB C 13 27.649 0.300 . 1 . . . . 38 ARG CB . 15440 1 404 . 1 1 38 38 ARG CD C 13 43.094 0.300 . 1 . . . . 38 ARG CD . 15440 1 405 . 1 1 38 38 ARG CG C 13 29.143 0.300 . 1 . . . . 38 ARG CG . 15440 1 406 . 1 1 39 39 SER H H 1 7.735 0.100 . 1 . . . . 39 SER H . 15440 1 407 . 1 1 39 39 SER HA H 1 4.230 0.100 . 1 . . . . 39 SER HA . 15440 1 408 . 1 1 39 39 SER HB2 H 1 3.914 0.100 . 2 . . . . 39 SER HB2 . 15440 1 409 . 1 1 39 39 SER HB3 H 1 3.706 0.100 . 2 . . . . 39 SER HB3 . 15440 1 410 . 1 1 39 39 SER C C 13 178.030 0.300 . 1 . . . . 39 SER C . 15440 1 411 . 1 1 39 39 SER CA C 13 61.013 0.300 . 1 . . . . 39 SER CA . 15440 1 412 . 1 1 39 39 SER CB C 13 62.373 0.300 . 1 . . . . 39 SER CB . 15440 1 413 . 1 1 39 39 SER N N 15 115.319 0.300 . 1 . . . . 39 SER N . 15440 1 414 . 1 1 40 40 ARG H H 1 8.024 0.100 . 1 . . . . 40 ARG H . 15440 1 415 . 1 1 40 40 ARG HA H 1 4.198 0.100 . 1 . . . . 40 ARG HA . 15440 1 416 . 1 1 40 40 ARG HB2 H 1 2.283 0.100 . 1 . . . . 40 ARG HB2 . 15440 1 417 . 1 1 40 40 ARG HB3 H 1 2.283 0.100 . 1 . . . . 40 ARG HB3 . 15440 1 418 . 1 1 40 40 ARG HD2 H 1 3.790 0.100 . 2 . . . . 40 ARG HD2 . 15440 1 419 . 1 1 40 40 ARG HD3 H 1 3.570 0.100 . 2 . . . . 40 ARG HD3 . 15440 1 420 . 1 1 40 40 ARG HG2 H 1 1.640 0.100 . 1 . . . . 40 ARG HG2 . 15440 1 421 . 1 1 40 40 ARG HG3 H 1 1.640 0.100 . 1 . . . . 40 ARG HG3 . 15440 1 422 . 1 1 40 40 ARG CA C 13 59.731 0.300 . 1 . . . . 40 ARG CA . 15440 1 423 . 1 1 40 40 ARG CB C 13 30.782 0.300 . 1 . . . . 40 ARG CB . 15440 1 424 . 1 1 40 40 ARG N N 15 122.491 0.300 . 1 . . . . 40 ARG N . 15440 1 425 . 1 1 41 41 ILE H H 1 8.280 0.100 . 1 . . . . 41 ILE H . 15440 1 426 . 1 1 41 41 ILE HA H 1 3.646 0.100 . 1 . . . . 41 ILE HA . 15440 1 427 . 1 1 41 41 ILE HB H 1 2.364 0.100 . 1 . . . . 41 ILE HB . 15440 1 428 . 1 1 41 41 ILE HD11 H 1 1.138 0.100 . 1 . . . . 41 ILE HD11 . 15440 1 429 . 1 1 41 41 ILE HD12 H 1 1.138 0.100 . 1 . . . . 41 ILE HD12 . 15440 1 430 . 1 1 41 41 ILE HD13 H 1 1.138 0.100 . 1 . . . . 41 ILE HD13 . 15440 1 431 . 1 1 41 41 ILE HG12 H 1 1.148 0.100 . 1 . . . . 41 ILE HG12 . 15440 1 432 . 1 1 41 41 ILE HG13 H 1 1.148 0.100 . 1 . . . . 41 ILE HG13 . 15440 1 433 . 1 1 41 41 ILE HG21 H 1 0.995 0.100 . 1 . . . . 41 ILE HG21 . 15440 1 434 . 1 1 41 41 ILE HG22 H 1 0.995 0.100 . 1 . . . . 41 ILE HG22 . 15440 1 435 . 1 1 41 41 ILE HG23 H 1 0.995 0.100 . 1 . . . . 41 ILE HG23 . 15440 1 436 . 1 1 41 41 ILE C C 13 177.117 0.300 . 1 . . . . 41 ILE C . 15440 1 437 . 1 1 41 41 ILE CA C 13 66.873 0.300 . 1 . . . . 41 ILE CA . 15440 1 438 . 1 1 41 41 ILE CB C 13 37.713 0.300 . 1 . . . . 41 ILE CB . 15440 1 439 . 1 1 41 41 ILE CD1 C 13 14.754 0.300 . 1 . . . . 41 ILE CD1 . 15440 1 440 . 1 1 41 41 ILE CG1 C 13 24.740 0.300 . 1 . . . . 41 ILE CG1 . 15440 1 441 . 1 1 41 41 ILE CG2 C 13 18.163 0.300 . 1 . . . . 41 ILE CG2 . 15440 1 442 . 1 1 42 42 SER H H 1 8.255 0.100 . 1 . . . . 42 SER H . 15440 1 443 . 1 1 42 42 SER HA H 1 4.619 0.100 . 1 . . . . 42 SER HA . 15440 1 444 . 1 1 42 42 SER HB2 H 1 3.965 0.100 . 1 . . . . 42 SER HB2 . 15440 1 445 . 1 1 42 42 SER HB3 H 1 3.965 0.100 . 1 . . . . 42 SER HB3 . 15440 1 446 . 1 1 42 42 SER C C 13 176.891 0.300 . 1 . . . . 42 SER C . 15440 1 447 . 1 1 42 42 SER CA C 13 62.548 0.300 . 1 . . . . 42 SER CA . 15440 1 448 . 1 1 42 42 SER CB C 13 62.550 0.300 . 1 . . . . 42 SER CB . 15440 1 449 . 1 1 42 42 SER N N 15 115.788 0.300 . 1 . . . . 42 SER N . 15440 1 450 . 1 1 43 43 GLY H H 1 8.432 0.100 . 1 . . . . 43 GLY H . 15440 1 451 . 1 1 43 43 GLY HA2 H 1 3.942 0.100 . 2 . . . . 43 GLY HA2 . 15440 1 452 . 1 1 43 43 GLY HA3 H 1 3.899 0.100 . 2 . . . . 43 GLY HA3 . 15440 1 453 . 1 1 43 43 GLY C C 13 176.056 0.300 . 1 . . . . 43 GLY C . 15440 1 454 . 1 1 43 43 GLY CA C 13 47.142 0.300 . 1 . . . . 43 GLY CA . 15440 1 455 . 1 1 43 43 GLY N N 15 107.991 0.300 . 1 . . . . 43 GLY N . 15440 1 456 . 1 1 44 44 ARG H H 1 7.638 0.100 . 1 . . . . 44 ARG H . 15440 1 457 . 1 1 44 44 ARG HA H 1 4.265 0.100 . 1 . . . . 44 ARG HA . 15440 1 458 . 1 1 44 44 ARG HB2 H 1 2.062 0.100 . 2 . . . . 44 ARG HB2 . 15440 1 459 . 1 1 44 44 ARG HB3 H 1 1.950 0.100 . 2 . . . . 44 ARG HB3 . 15440 1 460 . 1 1 44 44 ARG HD2 H 1 3.577 0.100 . 1 . . . . 44 ARG HD2 . 15440 1 461 . 1 1 44 44 ARG HD3 H 1 3.577 0.100 . 1 . . . . 44 ARG HD3 . 15440 1 462 . 1 1 44 44 ARG HG2 H 1 1.649 0.100 . 1 . . . . 44 ARG HG2 . 15440 1 463 . 1 1 44 44 ARG HG3 H 1 1.649 0.100 . 1 . . . . 44 ARG HG3 . 15440 1 464 . 1 1 44 44 ARG C C 13 178.101 0.300 . 1 . . . . 44 ARG C . 15440 1 465 . 1 1 44 44 ARG CA C 13 59.263 0.300 . 1 . . . . 44 ARG CA . 15440 1 466 . 1 1 44 44 ARG CB C 13 29.492 0.300 . 1 . . . . 44 ARG CB . 15440 1 467 . 1 1 44 44 ARG CD C 13 43.739 0.300 . 1 . . . . 44 ARG CD . 15440 1 468 . 1 1 44 44 ARG CG C 13 29.500 0.300 . 1 . . . . 44 ARG CG . 15440 1 469 . 1 1 44 44 ARG N N 15 122.848 0.300 . 1 . . . . 44 ARG N . 15440 1 470 . 1 1 45 45 LEU H H 1 8.266 0.100 . 1 . . . . 45 LEU H . 15440 1 471 . 1 1 45 45 LEU HA H 1 3.835 0.100 . 1 . . . . 45 LEU HA . 15440 1 472 . 1 1 45 45 LEU HB2 H 1 1.940 0.100 . 2 . . . . 45 LEU HB2 . 15440 1 473 . 1 1 45 45 LEU HB3 H 1 1.860 0.100 . 2 . . . . 45 LEU HB3 . 15440 1 474 . 1 1 45 45 LEU HD11 H 1 0.700 0.100 . 2 . . . . 45 LEU HD11 . 15440 1 475 . 1 1 45 45 LEU HD12 H 1 0.700 0.100 . 2 . . . . 45 LEU HD12 . 15440 1 476 . 1 1 45 45 LEU HD13 H 1 0.700 0.100 . 2 . . . . 45 LEU HD13 . 15440 1 477 . 1 1 45 45 LEU HD21 H 1 0.537 0.100 . 2 . . . . 45 LEU HD21 . 15440 1 478 . 1 1 45 45 LEU HD22 H 1 0.537 0.100 . 2 . . . . 45 LEU HD22 . 15440 1 479 . 1 1 45 45 LEU HD23 H 1 0.537 0.100 . 2 . . . . 45 LEU HD23 . 15440 1 480 . 1 1 45 45 LEU HG H 1 1.159 0.100 . 1 . . . . 45 LEU HG . 15440 1 481 . 1 1 45 45 LEU C C 13 179.218 0.300 . 1 . . . . 45 LEU C . 15440 1 482 . 1 1 45 45 LEU CA C 13 58.400 0.300 . 1 . . . . 45 LEU CA . 15440 1 483 . 1 1 45 45 LEU CB C 13 40.553 0.300 . 1 . . . . 45 LEU CB . 15440 1 484 . 1 1 45 45 LEU CD1 C 13 23.900 0.300 . 2 . . . . 45 LEU CD1 . 15440 1 485 . 1 1 45 45 LEU CD2 C 13 24.210 0.300 . 2 . . . . 45 LEU CD2 . 15440 1 486 . 1 1 45 45 LEU CG C 13 26.656 0.300 . 1 . . . . 45 LEU CG . 15440 1 487 . 1 1 45 45 LEU N N 15 116.871 0.300 . 1 . . . . 45 LEU N . 15440 1 488 . 1 1 46 46 ASN H H 1 8.151 0.100 . 1 . . . . 46 ASN H . 15440 1 489 . 1 1 46 46 ASN HA H 1 4.391 0.100 . 1 . . . . 46 ASN HA . 15440 1 490 . 1 1 46 46 ASN HB2 H 1 2.833 0.100 . 1 . . . . 46 ASN HB2 . 15440 1 491 . 1 1 46 46 ASN HB3 H 1 2.833 0.100 . 1 . . . . 46 ASN HB3 . 15440 1 492 . 1 1 46 46 ASN HD21 H 1 7.790 0.100 . 1 . . . . 46 ASN HD21 . 15440 1 493 . 1 1 46 46 ASN HD22 H 1 7.705 0.100 . 1 . . . . 46 ASN HD22 . 15440 1 494 . 1 1 46 46 ASN C C 13 177.728 0.300 . 1 . . . . 46 ASN C . 15440 1 495 . 1 1 46 46 ASN CA C 13 56.309 0.300 . 1 . . . . 46 ASN CA . 15440 1 496 . 1 1 46 46 ASN CB C 13 38.318 0.300 . 1 . . . . 46 ASN CB . 15440 1 497 . 1 1 46 46 ASN N N 15 114.585 0.300 . 1 . . . . 46 ASN N . 15440 1 498 . 1 1 46 46 ASN ND2 N 15 113.520 0.300 . 1 . . . . 46 ASN ND2 . 15440 1 499 . 1 1 47 47 ARG H H 1 7.662 0.100 . 1 . . . . 47 ARG H . 15440 1 500 . 1 1 47 47 ARG HA H 1 4.098 0.100 . 1 . . . . 47 ARG HA . 15440 1 501 . 1 1 47 47 ARG HB2 H 1 1.974 0.100 . 2 . . . . 47 ARG HB2 . 15440 1 502 . 1 1 47 47 ARG HB3 H 1 1.863 0.100 . 2 . . . . 47 ARG HB3 . 15440 1 503 . 1 1 47 47 ARG HD2 H 1 3.060 0.100 . 2 . . . . 47 ARG HD2 . 15440 1 504 . 1 1 47 47 ARG HD3 H 1 2.900 0.100 . 2 . . . . 47 ARG HD3 . 15440 1 505 . 1 1 47 47 ARG HG2 H 1 1.640 0.100 . 2 . . . . 47 ARG HG2 . 15440 1 506 . 1 1 47 47 ARG HG3 H 1 1.349 0.100 . 2 . . . . 47 ARG HG3 . 15440 1 507 . 1 1 47 47 ARG HH21 H 1 7.450 0.100 . 1 . . . . 47 ARG HH21 . 15440 1 508 . 1 1 47 47 ARG C C 13 177.345 0.300 . 1 . . . . 47 ARG C . 15440 1 509 . 1 1 47 47 ARG CA C 13 58.434 0.300 . 1 . . . . 47 ARG CA . 15440 1 510 . 1 1 47 47 ARG CB C 13 30.069 0.300 . 1 . . . . 47 ARG CB . 15440 1 511 . 1 1 47 47 ARG CD C 13 43.659 0.300 . 1 . . . . 47 ARG CD . 15440 1 512 . 1 1 47 47 ARG CG C 13 27.289 0.300 . 1 . . . . 47 ARG CG . 15440 1 513 . 1 1 47 47 ARG N N 15 118.782 0.300 . 1 . . . . 47 ARG N . 15440 1 514 . 1 1 48 48 PHE H H 1 7.469 0.100 . 1 . . . . 48 PHE H . 15440 1 515 . 1 1 48 48 PHE HA H 1 4.372 0.100 . 1 . . . . 48 PHE HA . 15440 1 516 . 1 1 48 48 PHE HB2 H 1 3.114 0.100 . 2 . . . . 48 PHE HB2 . 15440 1 517 . 1 1 48 48 PHE HB3 H 1 2.770 0.100 . 2 . . . . 48 PHE HB3 . 15440 1 518 . 1 1 48 48 PHE HD1 H 1 7.420 0.100 . 3 . . . . 48 PHE HD1 . 15440 1 519 . 1 1 48 48 PHE HD2 H 1 7.420 0.100 . 3 . . . . 48 PHE HD2 . 15440 1 520 . 1 1 48 48 PHE HE1 H 1 7.228 0.100 . 3 . . . . 48 PHE HE1 . 15440 1 521 . 1 1 48 48 PHE HE2 H 1 7.228 0.100 . 3 . . . . 48 PHE HE2 . 15440 1 522 . 1 1 48 48 PHE C C 13 174.691 0.300 . 1 . . . . 48 PHE C . 15440 1 523 . 1 1 48 48 PHE CA C 13 59.167 0.300 . 1 . . . . 48 PHE CA . 15440 1 524 . 1 1 48 48 PHE CB C 13 41.374 0.300 . 1 . . . . 48 PHE CB . 15440 1 525 . 1 1 48 48 PHE CD1 C 13 131.741 0.300 . 3 . . . . 48 PHE CD1 . 15440 1 526 . 1 1 48 48 PHE CD2 C 13 131.741 0.300 . 3 . . . . 48 PHE CD2 . 15440 1 527 . 1 1 48 48 PHE CE1 C 13 131.116 0.300 . 3 . . . . 48 PHE CE1 . 15440 1 528 . 1 1 48 48 PHE CE2 C 13 131.116 0.300 . 3 . . . . 48 PHE CE2 . 15440 1 529 . 1 1 48 48 PHE N N 15 115.676 0.300 . 1 . . . . 48 PHE N . 15440 1 530 . 1 1 49 49 LYS H H 1 7.155 0.100 . 1 . . . . 49 LYS H . 15440 1 531 . 1 1 49 49 LYS HA H 1 4.060 0.100 . 1 . . . . 49 LYS HA . 15440 1 532 . 1 1 49 49 LYS HB2 H 1 1.930 0.100 . 2 . . . . 49 LYS HB2 . 15440 1 533 . 1 1 49 49 LYS HB3 H 1 1.786 0.100 . 2 . . . . 49 LYS HB3 . 15440 1 534 . 1 1 49 49 LYS HD2 H 1 1.710 0.100 . 1 . . . . 49 LYS HD2 . 15440 1 535 . 1 1 49 49 LYS HD3 H 1 1.710 0.100 . 1 . . . . 49 LYS HD3 . 15440 1 536 . 1 1 49 49 LYS HE2 H 1 3.101 0.100 . 1 . . . . 49 LYS HE2 . 15440 1 537 . 1 1 49 49 LYS HE3 H 1 3.101 0.100 . 1 . . . . 49 LYS HE3 . 15440 1 538 . 1 1 49 49 LYS HG2 H 1 1.247 0.100 . 1 . . . . 49 LYS HG2 . 15440 1 539 . 1 1 49 49 LYS HG3 H 1 1.247 0.100 . 1 . . . . 49 LYS HG3 . 15440 1 540 . 1 1 49 49 LYS C C 13 175.132 0.300 . 1 . . . . 49 LYS C . 15440 1 541 . 1 1 49 49 LYS CA C 13 58.011 0.300 . 1 . . . . 49 LYS CA . 15440 1 542 . 1 1 49 49 LYS CB C 13 33.798 0.300 . 1 . . . . 49 LYS CB . 15440 1 543 . 1 1 49 49 LYS CD C 13 29.898 0.300 . 1 . . . . 49 LYS CD . 15440 1 544 . 1 1 49 49 LYS CE C 13 40.851 0.300 . 1 . . . . 49 LYS CE . 15440 1 545 . 1 1 49 49 LYS CG C 13 23.603 0.300 . 1 . . . . 49 LYS CG . 15440 1 546 . 1 1 49 49 LYS N N 15 123.811 0.300 . 1 . . . . 49 LYS N . 15440 1 547 . 1 1 50 50 ARG H H 1 9.208 0.100 . 1 . . . . 50 ARG H . 15440 1 548 . 1 1 50 50 ARG HA H 1 4.676 0.100 . 1 . . . . 50 ARG HA . 15440 1 549 . 1 1 50 50 ARG HB2 H 1 1.693 0.100 . 1 . . . . 50 ARG HB2 . 15440 1 550 . 1 1 50 50 ARG HB3 H 1 1.693 0.100 . 1 . . . . 50 ARG HB3 . 15440 1 551 . 1 1 50 50 ARG HD2 H 1 3.170 0.100 . 2 . . . . 50 ARG HD2 . 15440 1 552 . 1 1 50 50 ARG HD3 H 1 3.090 0.100 . 2 . . . . 50 ARG HD3 . 15440 1 553 . 1 1 50 50 ARG HG2 H 1 1.577 0.100 . 1 . . . . 50 ARG HG2 . 15440 1 554 . 1 1 50 50 ARG HG3 H 1 1.577 0.100 . 1 . . . . 50 ARG HG3 . 15440 1 555 . 1 1 50 50 ARG HH21 H 1 5.900 0.100 . 1 . . . . 50 ARG HH21 . 15440 1 556 . 1 1 50 50 ARG HH22 H 1 6.200 0.100 . 1 . . . . 50 ARG HH22 . 15440 1 557 . 1 1 50 50 ARG C C 13 174.243 0.300 . 1 . . . . 50 ARG C . 15440 1 558 . 1 1 50 50 ARG CA C 13 54.313 0.300 . 1 . . . . 50 ARG CA . 15440 1 559 . 1 1 50 50 ARG CB C 13 32.200 0.300 . 1 . . . . 50 ARG CB . 15440 1 560 . 1 1 50 50 ARG CD C 13 43.918 0.300 . 1 . . . . 50 ARG CD . 15440 1 561 . 1 1 50 50 ARG CG C 13 26.783 0.300 . 1 . . . . 50 ARG CG . 15440 1 562 . 1 1 50 50 ARG N N 15 130.028 0.300 . 1 . . . . 50 ARG N . 15440 1 563 . 1 1 51 51 TYR H H 1 8.714 0.100 . 1 . . . . 51 TYR H . 15440 1 564 . 1 1 51 51 TYR HA H 1 4.817 0.100 . 1 . . . . 51 TYR HA . 15440 1 565 . 1 1 51 51 TYR HB2 H 1 3.224 0.100 . 2 . . . . 51 TYR HB2 . 15440 1 566 . 1 1 51 51 TYR HB3 H 1 2.796 0.100 . 2 . . . . 51 TYR HB3 . 15440 1 567 . 1 1 51 51 TYR HD1 H 1 7.140 0.100 . 3 . . . . 51 TYR HD1 . 15440 1 568 . 1 1 51 51 TYR HD2 H 1 7.140 0.100 . 3 . . . . 51 TYR HD2 . 15440 1 569 . 1 1 51 51 TYR HE1 H 1 6.635 0.100 . 3 . . . . 51 TYR HE1 . 15440 1 570 . 1 1 51 51 TYR HE2 H 1 6.635 0.100 . 3 . . . . 51 TYR HE2 . 15440 1 571 . 1 1 51 51 TYR CA C 13 56.436 0.300 . 1 . . . . 51 TYR CA . 15440 1 572 . 1 1 51 51 TYR CB C 13 39.844 0.300 . 1 . . . . 51 TYR CB . 15440 1 573 . 1 1 51 51 TYR CD1 C 13 131.741 0.300 . 3 . . . . 51 TYR CD1 . 15440 1 574 . 1 1 51 51 TYR CD2 C 13 131.741 0.300 . 3 . . . . 51 TYR CD2 . 15440 1 575 . 1 1 51 51 TYR CE1 C 13 117.991 0.300 . 3 . . . . 51 TYR CE1 . 15440 1 576 . 1 1 51 51 TYR CE2 C 13 117.991 0.300 . 3 . . . . 51 TYR CE2 . 15440 1 577 . 1 1 51 51 TYR N N 15 126.649 0.300 . 1 . . . . 51 TYR N . 15440 1 578 . 1 1 52 52 PRO HA H 1 4.396 0.100 . 1 . . . . 52 PRO HA . 15440 1 579 . 1 1 52 52 PRO HB2 H 1 1.840 0.100 . 2 . . . . 52 PRO HB2 . 15440 1 580 . 1 1 52 52 PRO HB3 H 1 1.547 0.100 . 2 . . . . 52 PRO HB3 . 15440 1 581 . 1 1 52 52 PRO HD2 H 1 3.964 0.100 . 1 . . . . 52 PRO HD2 . 15440 1 582 . 1 1 52 52 PRO HD3 H 1 3.964 0.100 . 1 . . . . 52 PRO HD3 . 15440 1 583 . 1 1 52 52 PRO HG2 H 1 1.759 0.100 . 1 . . . . 52 PRO HG2 . 15440 1 584 . 1 1 52 52 PRO HG3 H 1 1.759 0.100 . 1 . . . . 52 PRO HG3 . 15440 1 585 . 1 1 52 52 PRO C C 13 177.246 0.300 . 1 . . . . 52 PRO C . 15440 1 586 . 1 1 52 52 PRO CA C 13 63.223 0.300 . 1 . . . . 52 PRO CA . 15440 1 587 . 1 1 52 52 PRO CB C 13 32.790 0.300 . 1 . . . . 52 PRO CB . 15440 1 588 . 1 1 52 52 PRO CG C 13 27.836 0.300 . 1 . . . . 52 PRO CG . 15440 1 589 . 1 1 53 53 LYS H H 1 8.834 0.100 . 1 . . . . 53 LYS H . 15440 1 590 . 1 1 53 53 LYS HA H 1 3.934 0.100 . 1 . . . . 53 LYS HA . 15440 1 591 . 1 1 53 53 LYS HB2 H 1 1.878 0.100 . 2 . . . . 53 LYS HB2 . 15440 1 592 . 1 1 53 53 LYS HB3 H 1 1.709 0.100 . 2 . . . . 53 LYS HB3 . 15440 1 593 . 1 1 53 53 LYS HD2 H 1 1.692 0.100 . 1 . . . . 53 LYS HD2 . 15440 1 594 . 1 1 53 53 LYS HD3 H 1 1.692 0.100 . 1 . . . . 53 LYS HD3 . 15440 1 595 . 1 1 53 53 LYS HE2 H 1 3.290 0.100 . 2 . . . . 53 LYS HE2 . 15440 1 596 . 1 1 53 53 LYS HE3 H 1 2.860 0.100 . 2 . . . . 53 LYS HE3 . 15440 1 597 . 1 1 53 53 LYS HG2 H 1 1.520 0.100 . 1 . . . . 53 LYS HG2 . 15440 1 598 . 1 1 53 53 LYS HG3 H 1 1.520 0.100 . 1 . . . . 53 LYS HG3 . 15440 1 599 . 1 1 53 53 LYS C C 13 174.694 0.300 . 1 . . . . 53 LYS C . 15440 1 600 . 1 1 53 53 LYS CA C 13 59.727 0.300 . 1 . . . . 53 LYS CA . 15440 1 601 . 1 1 53 53 LYS CB C 13 32.561 0.300 . 1 . . . . 53 LYS CB . 15440 1 602 . 1 1 53 53 LYS CD C 13 29.046 0.300 . 1 . . . . 53 LYS CD . 15440 1 603 . 1 1 53 53 LYS CE C 13 42.000 0.300 . 1 . . . . 53 LYS CE . 15440 1 604 . 1 1 53 53 LYS CG C 13 24.964 0.300 . 1 . . . . 53 LYS CG . 15440 1 605 . 1 1 53 53 LYS N N 15 122.608 0.300 . 1 . . . . 53 LYS N . 15440 1 606 . 1 1 54 54 ASP H H 1 8.654 0.100 . 1 . . . . 54 ASP H . 15440 1 607 . 1 1 54 54 ASP HA H 1 4.254 0.100 . 1 . . . . 54 ASP HA . 15440 1 608 . 1 1 54 54 ASP HB2 H 1 2.757 0.100 . 2 . . . . 54 ASP HB2 . 15440 1 609 . 1 1 54 54 ASP HB3 H 1 2.588 0.100 . 2 . . . . 54 ASP HB3 . 15440 1 610 . 1 1 54 54 ASP C C 13 177.424 0.300 . 1 . . . . 54 ASP C . 15440 1 611 . 1 1 54 54 ASP CA C 13 56.432 0.300 . 1 . . . . 54 ASP CA . 15440 1 612 . 1 1 54 54 ASP CB C 13 38.664 0.300 . 1 . . . . 54 ASP CB . 15440 1 613 . 1 1 54 54 ASP N N 15 118.540 0.300 . 1 . . . . 54 ASP N . 15440 1 614 . 1 1 55 55 ALA H H 1 7.445 0.100 . 1 . . . . 55 ALA H . 15440 1 615 . 1 1 55 55 ALA HA H 1 3.769 0.100 . 1 . . . . 55 ALA HA . 15440 1 616 . 1 1 55 55 ALA HB1 H 1 1.370 0.100 . 1 . . . . 55 ALA HB1 . 15440 1 617 . 1 1 55 55 ALA HB2 H 1 1.370 0.100 . 1 . . . . 55 ALA HB2 . 15440 1 618 . 1 1 55 55 ALA HB3 H 1 1.370 0.100 . 1 . . . . 55 ALA HB3 . 15440 1 619 . 1 1 55 55 ALA C C 13 178.711 0.300 . 1 . . . . 55 ALA C . 15440 1 620 . 1 1 55 55 ALA CA C 13 54.657 0.300 . 1 . . . . 55 ALA CA . 15440 1 621 . 1 1 55 55 ALA CB C 13 18.820 0.300 . 1 . . . . 55 ALA CB . 15440 1 622 . 1 1 55 55 ALA N N 15 124.052 0.300 . 1 . . . . 55 ALA N . 15440 1 623 . 1 1 56 56 LEU H H 1 8.024 0.100 . 1 . . . . 56 LEU H . 15440 1 624 . 1 1 56 56 LEU HA H 1 3.750 0.100 . 1 . . . . 56 LEU HA . 15440 1 625 . 1 1 56 56 LEU HB2 H 1 1.619 0.100 . 2 . . . . 56 LEU HB2 . 15440 1 626 . 1 1 56 56 LEU HB3 H 1 1.410 0.100 . 2 . . . . 56 LEU HB3 . 15440 1 627 . 1 1 56 56 LEU HD11 H 1 0.611 0.100 . 2 . . . . 56 LEU HD11 . 15440 1 628 . 1 1 56 56 LEU HD12 H 1 0.611 0.100 . 2 . . . . 56 LEU HD12 . 15440 1 629 . 1 1 56 56 LEU HD13 H 1 0.611 0.100 . 2 . . . . 56 LEU HD13 . 15440 1 630 . 1 1 56 56 LEU HD21 H 1 0.418 0.100 . 2 . . . . 56 LEU HD21 . 15440 1 631 . 1 1 56 56 LEU HD22 H 1 0.418 0.100 . 2 . . . . 56 LEU HD22 . 15440 1 632 . 1 1 56 56 LEU HD23 H 1 0.418 0.100 . 2 . . . . 56 LEU HD23 . 15440 1 633 . 1 1 56 56 LEU HG H 1 1.481 0.100 . 1 . . . . 56 LEU HG . 15440 1 634 . 1 1 56 56 LEU C C 13 180.232 0.300 . 1 . . . . 56 LEU C . 15440 1 635 . 1 1 56 56 LEU CA C 13 58.056 0.300 . 1 . . . . 56 LEU CA . 15440 1 636 . 1 1 56 56 LEU CB C 13 42.176 0.300 . 1 . . . . 56 LEU CB . 15440 1 637 . 1 1 56 56 LEU CD1 C 13 24.718 0.300 . 2 . . . . 56 LEU CD1 . 15440 1 638 . 1 1 56 56 LEU CD2 C 13 23.686 0.300 . 2 . . . . 56 LEU CD2 . 15440 1 639 . 1 1 56 56 LEU CG C 13 22.959 0.300 . 1 . . . . 56 LEU CG . 15440 1 640 . 1 1 56 56 LEU N N 15 117.832 0.300 . 1 . . . . 56 LEU N . 15440 1 641 . 1 1 57 57 ARG H H 1 7.951 0.100 . 1 . . . . 57 ARG H . 15440 1 642 . 1 1 57 57 ARG HA H 1 3.990 0.100 . 1 . . . . 57 ARG HA . 15440 1 643 . 1 1 57 57 ARG HB2 H 1 1.910 0.100 . 1 . . . . 57 ARG HB2 . 15440 1 644 . 1 1 57 57 ARG HB3 H 1 1.910 0.100 . 1 . . . . 57 ARG HB3 . 15440 1 645 . 1 1 57 57 ARG HD2 H 1 3.192 0.100 . 1 . . . . 57 ARG HD2 . 15440 1 646 . 1 1 57 57 ARG HD3 H 1 3.192 0.100 . 1 . . . . 57 ARG HD3 . 15440 1 647 . 1 1 57 57 ARG HG2 H 1 1.668 0.100 . 2 . . . . 57 ARG HG2 . 15440 1 648 . 1 1 57 57 ARG HG3 H 1 1.602 0.100 . 2 . . . . 57 ARG HG3 . 15440 1 649 . 1 1 57 57 ARG C C 13 178.333 0.300 . 1 . . . . 57 ARG C . 15440 1 650 . 1 1 57 57 ARG CA C 13 58.955 0.300 . 1 . . . . 57 ARG CA . 15440 1 651 . 1 1 57 57 ARG CB C 13 29.900 0.300 . 1 . . . . 57 ARG CB . 15440 1 652 . 1 1 57 57 ARG CD C 13 43.368 0.300 . 1 . . . . 57 ARG CD . 15440 1 653 . 1 1 57 57 ARG CG C 13 27.392 0.300 . 1 . . . . 57 ARG CG . 15440 1 654 . 1 1 57 57 ARG N N 15 120.463 0.300 . 1 . . . . 57 ARG N . 15440 1 655 . 1 1 58 58 LEU H H 1 7.808 0.100 . 1 . . . . 58 LEU H . 15440 1 656 . 1 1 58 58 LEU HA H 1 4.182 0.100 . 1 . . . . 58 LEU HA . 15440 1 657 . 1 1 58 58 LEU HB2 H 1 1.611 0.100 . 1 . . . . 58 LEU HB2 . 15440 1 658 . 1 1 58 58 LEU HB3 H 1 1.611 0.100 . 1 . . . . 58 LEU HB3 . 15440 1 659 . 1 1 58 58 LEU HD11 H 1 0.837 0.100 . 1 . . . . 58 LEU HD11 . 15440 1 660 . 1 1 58 58 LEU HD12 H 1 0.837 0.100 . 1 . . . . 58 LEU HD12 . 15440 1 661 . 1 1 58 58 LEU HD13 H 1 0.837 0.100 . 1 . . . . 58 LEU HD13 . 15440 1 662 . 1 1 58 58 LEU HD21 H 1 0.837 0.100 . 1 . . . . 58 LEU HD21 . 15440 1 663 . 1 1 58 58 LEU HD22 H 1 0.837 0.100 . 1 . . . . 58 LEU HD22 . 15440 1 664 . 1 1 58 58 LEU HD23 H 1 0.837 0.100 . 1 . . . . 58 LEU HD23 . 15440 1 665 . 1 1 58 58 LEU HG H 1 1.594 0.100 . 1 . . . . 58 LEU HG . 15440 1 666 . 1 1 58 58 LEU C C 13 175.752 0.300 . 1 . . . . 58 LEU C . 15440 1 667 . 1 1 58 58 LEU CA C 13 54.905 0.300 . 1 . . . . 58 LEU CA . 15440 1 668 . 1 1 58 58 LEU CB C 13 43.260 0.300 . 1 . . . . 58 LEU CB . 15440 1 669 . 1 1 58 58 LEU CD1 C 13 22.189 0.300 . 1 . . . . 58 LEU CD1 . 15440 1 670 . 1 1 58 58 LEU CD2 C 13 22.189 0.300 . 1 . . . . 58 LEU CD2 . 15440 1 671 . 1 1 58 58 LEU CG C 13 25.148 0.300 . 1 . . . . 58 LEU CG . 15440 1 672 . 1 1 58 58 LEU N N 15 117.345 0.300 . 1 . . . . 58 LEU N . 15440 1 673 . 1 1 59 59 LYS H H 1 7.856 0.100 . 1 . . . . 59 LYS H . 15440 1 674 . 1 1 59 59 LYS HA H 1 3.564 0.100 . 1 . . . . 59 LYS HA . 15440 1 675 . 1 1 59 59 LYS HB2 H 1 1.647 0.100 . 1 . . . . 59 LYS HB2 . 15440 1 676 . 1 1 59 59 LYS HB3 H 1 1.647 0.100 . 1 . . . . 59 LYS HB3 . 15440 1 677 . 1 1 59 59 LYS HD2 H 1 1.604 0.100 . 1 . . . . 59 LYS HD2 . 15440 1 678 . 1 1 59 59 LYS HD3 H 1 1.604 0.100 . 1 . . . . 59 LYS HD3 . 15440 1 679 . 1 1 59 59 LYS HE2 H 1 2.951 0.100 . 2 . . . . 59 LYS HE2 . 15440 1 680 . 1 1 59 59 LYS HE3 H 1 2.935 0.100 . 2 . . . . 59 LYS HE3 . 15440 1 681 . 1 1 59 59 LYS HG2 H 1 1.358 0.100 . 2 . . . . 59 LYS HG2 . 15440 1 682 . 1 1 59 59 LYS HG3 H 1 1.261 0.100 . 2 . . . . 59 LYS HG3 . 15440 1 683 . 1 1 59 59 LYS C C 13 175.380 0.300 . 1 . . . . 59 LYS C . 15440 1 684 . 1 1 59 59 LYS CA C 13 57.243 0.300 . 1 . . . . 59 LYS CA . 15440 1 685 . 1 1 59 59 LYS CB C 13 29.257 0.300 . 1 . . . . 59 LYS CB . 15440 1 686 . 1 1 59 59 LYS CD C 13 28.963 0.300 . 1 . . . . 59 LYS CD . 15440 1 687 . 1 1 59 59 LYS CE C 13 42.681 0.300 . 1 . . . . 59 LYS CE . 15440 1 688 . 1 1 59 59 LYS CG C 13 24.938 0.300 . 1 . . . . 59 LYS CG . 15440 1 689 . 1 1 59 59 LYS N N 15 117.827 0.300 . 1 . . . . 59 LYS N . 15440 1 690 . 1 1 60 60 ARG H H 1 8.507 0.100 . 1 . . . . 60 ARG H . 15440 1 691 . 1 1 60 60 ARG HA H 1 4.537 0.100 . 1 . . . . 60 ARG HA . 15440 1 692 . 1 1 60 60 ARG HB2 H 1 1.769 0.100 . 1 . . . . 60 ARG HB2 . 15440 1 693 . 1 1 60 60 ARG HB3 H 1 1.769 0.100 . 1 . . . . 60 ARG HB3 . 15440 1 694 . 1 1 60 60 ARG HD2 H 1 3.283 0.100 . 1 . . . . 60 ARG HD2 . 15440 1 695 . 1 1 60 60 ARG HD3 H 1 3.283 0.100 . 1 . . . . 60 ARG HD3 . 15440 1 696 . 1 1 60 60 ARG HG2 H 1 1.565 0.100 . 1 . . . . 60 ARG HG2 . 15440 1 697 . 1 1 60 60 ARG HG3 H 1 1.565 0.100 . 1 . . . . 60 ARG HG3 . 15440 1 698 . 1 1 60 60 ARG C C 13 175.066 0.300 . 1 . . . . 60 ARG C . 15440 1 699 . 1 1 60 60 ARG CA C 13 54.085 0.300 . 1 . . . . 60 ARG CA . 15440 1 700 . 1 1 60 60 ARG CB C 13 30.906 0.300 . 1 . . . . 60 ARG CB . 15440 1 701 . 1 1 60 60 ARG CD C 13 41.738 0.300 . 1 . . . . 60 ARG CD . 15440 1 702 . 1 1 60 60 ARG CG C 13 26.671 0.300 . 1 . . . . 60 ARG CG . 15440 1 703 . 1 1 60 60 ARG N N 15 118.551 0.300 . 1 . . . . 60 ARG N . 15440 1 704 . 1 1 61 61 GLN H H 1 8.627 0.100 . 1 . . . . 61 GLN H . 15440 1 705 . 1 1 61 61 GLN HA H 1 4.614 0.100 . 1 . . . . 61 GLN HA . 15440 1 706 . 1 1 61 61 GLN HB2 H 1 2.220 0.100 . 1 . . . . 61 GLN HB2 . 15440 1 707 . 1 1 61 61 GLN HB3 H 1 2.220 0.100 . 1 . . . . 61 GLN HB3 . 15440 1 708 . 1 1 61 61 GLN HE21 H 1 7.008 0.100 . 1 . . . . 61 GLN HE21 . 15440 1 709 . 1 1 61 61 GLN HE22 H 1 7.751 0.100 . 1 . . . . 61 GLN HE22 . 15440 1 710 . 1 1 61 61 GLN HG2 H 1 2.370 0.100 . 1 . . . . 61 GLN HG2 . 15440 1 711 . 1 1 61 61 GLN HG3 H 1 2.370 0.100 . 1 . . . . 61 GLN HG3 . 15440 1 712 . 1 1 61 61 GLN C C 13 174.923 0.300 . 1 . . . . 61 GLN C . 15440 1 713 . 1 1 61 61 GLN CA C 13 54.399 0.300 . 1 . . . . 61 GLN CA . 15440 1 714 . 1 1 61 61 GLN CB C 13 32.786 0.300 . 1 . . . . 61 GLN CB . 15440 1 715 . 1 1 61 61 GLN CD C 13 180.840 0.300 . 1 . . . . 61 GLN CD . 15440 1 716 . 1 1 61 61 GLN CG C 13 34.922 0.300 . 1 . . . . 61 GLN CG . 15440 1 717 . 1 1 61 61 GLN N N 15 123.095 0.300 . 1 . . . . 61 GLN N . 15440 1 718 . 1 1 61 61 GLN NE2 N 15 111.988 0.300 . 1 . . . . 61 GLN NE2 . 15440 1 719 . 1 1 62 62 GLY H H 1 8.435 0.100 . 1 . . . . 62 GLY H . 15440 1 720 . 1 1 62 62 GLY HA2 H 1 4.379 0.100 . 2 . . . . 62 GLY HA2 . 15440 1 721 . 1 1 62 62 GLY HA3 H 1 4.184 0.100 . 2 . . . . 62 GLY HA3 . 15440 1 722 . 1 1 62 62 GLY C C 13 170.525 0.300 . 1 . . . . 62 GLY C . 15440 1 723 . 1 1 62 62 GLY CA C 13 46.192 0.300 . 1 . . . . 62 GLY CA . 15440 1 724 . 1 1 62 62 GLY N N 15 107.546 0.300 . 1 . . . . 62 GLY N . 15440 1 725 . 1 1 63 63 VAL H H 1 8.459 0.100 . 1 . . . . 63 VAL H . 15440 1 726 . 1 1 63 63 VAL HA H 1 5.104 0.100 . 1 . . . . 63 VAL HA . 15440 1 727 . 1 1 63 63 VAL HB H 1 1.996 0.100 . 1 . . . . 63 VAL HB . 15440 1 728 . 1 1 63 63 VAL HG11 H 1 0.890 0.100 . 1 . . . . 63 VAL HG11 . 15440 1 729 . 1 1 63 63 VAL HG12 H 1 0.890 0.100 . 1 . . . . 63 VAL HG12 . 15440 1 730 . 1 1 63 63 VAL HG13 H 1 0.890 0.100 . 1 . . . . 63 VAL HG13 . 15440 1 731 . 1 1 63 63 VAL HG21 H 1 0.890 0.100 . 1 . . . . 63 VAL HG21 . 15440 1 732 . 1 1 63 63 VAL HG22 H 1 0.890 0.100 . 1 . . . . 63 VAL HG22 . 15440 1 733 . 1 1 63 63 VAL HG23 H 1 0.890 0.100 . 1 . . . . 63 VAL HG23 . 15440 1 734 . 1 1 63 63 VAL C C 13 175.604 0.300 . 1 . . . . 63 VAL C . 15440 1 735 . 1 1 63 63 VAL CA C 13 60.602 0.300 . 1 . . . . 63 VAL CA . 15440 1 736 . 1 1 63 63 VAL CB C 13 34.551 0.300 . 1 . . . . 63 VAL CB . 15440 1 737 . 1 1 63 63 VAL CG1 C 13 21.169 0.300 . 2 . . . . 63 VAL CG1 . 15440 1 738 . 1 1 63 63 VAL CG2 C 13 20.491 0.300 . 2 . . . . 63 VAL CG2 . 15440 1 739 . 1 1 63 63 VAL N N 15 119.025 0.300 . 1 . . . . 63 VAL N . 15440 1 740 . 1 1 64 64 GLY H H 1 8.531 0.100 . 1 . . . . 64 GLY H . 15440 1 741 . 1 1 64 64 GLY HA2 H 1 4.595 0.100 . 2 . . . . 64 GLY HA2 . 15440 1 742 . 1 1 64 64 GLY HA3 H 1 3.510 0.100 . 2 . . . . 64 GLY HA3 . 15440 1 743 . 1 1 64 64 GLY C C 13 172.230 0.300 . 1 . . . . 64 GLY C . 15440 1 744 . 1 1 64 64 GLY CA C 13 43.134 0.300 . 1 . . . . 64 GLY CA . 15440 1 745 . 1 1 64 64 GLY N N 15 112.686 0.300 . 1 . . . . 64 GLY N . 15440 1 746 . 1 1 65 65 GLN H H 1 8.411 0.100 . 1 . . . . 65 GLN H . 15440 1 747 . 1 1 65 65 GLN HA H 1 5.220 0.100 . 1 . . . . 65 GLN HA . 15440 1 748 . 1 1 65 65 GLN HB2 H 1 2.200 0.100 . 1 . . . . 65 GLN HB2 . 15440 1 749 . 1 1 65 65 GLN HB3 H 1 2.200 0.100 . 1 . . . . 65 GLN HB3 . 15440 1 750 . 1 1 65 65 GLN HE21 H 1 7.334 0.100 . 1 . . . . 65 GLN HE21 . 15440 1 751 . 1 1 65 65 GLN HE22 H 1 6.630 0.100 . 1 . . . . 65 GLN HE22 . 15440 1 752 . 1 1 65 65 GLN HG2 H 1 1.880 0.100 . 1 . . . . 65 GLN HG2 . 15440 1 753 . 1 1 65 65 GLN HG3 H 1 1.880 0.100 . 1 . . . . 65 GLN HG3 . 15440 1 754 . 1 1 65 65 GLN C C 13 174.443 0.300 . 1 . . . . 65 GLN C . 15440 1 755 . 1 1 65 65 GLN CA C 13 55.136 0.300 . 1 . . . . 65 GLN CA . 15440 1 756 . 1 1 65 65 GLN CB C 13 32.907 0.300 . 1 . . . . 65 GLN CB . 15440 1 757 . 1 1 65 65 GLN CD C 13 179.041 0.300 . 1 . . . . 65 GLN CD . 15440 1 758 . 1 1 65 65 GLN CG C 13 33.886 0.300 . 1 . . . . 65 GLN CG . 15440 1 759 . 1 1 65 65 GLN N N 15 116.038 0.300 . 1 . . . . 65 GLN N . 15440 1 760 . 1 1 65 65 GLN NE2 N 15 109.267 0.300 . 1 . . . . 65 GLN NE2 . 15440 1 761 . 1 1 66 66 VAL H H 1 9.158 0.100 . 1 . . . . 66 VAL H . 15440 1 762 . 1 1 66 66 VAL HA H 1 5.004 0.100 . 1 . . . . 66 VAL HA . 15440 1 763 . 1 1 66 66 VAL HB H 1 1.813 0.100 . 1 . . . . 66 VAL HB . 15440 1 764 . 1 1 66 66 VAL HG11 H 1 1.038 0.100 . 2 . . . . 66 VAL HG11 . 15440 1 765 . 1 1 66 66 VAL HG12 H 1 1.038 0.100 . 2 . . . . 66 VAL HG12 . 15440 1 766 . 1 1 66 66 VAL HG13 H 1 1.038 0.100 . 2 . . . . 66 VAL HG13 . 15440 1 767 . 1 1 66 66 VAL HG21 H 1 1.025 0.100 . 2 . . . . 66 VAL HG21 . 15440 1 768 . 1 1 66 66 VAL HG22 H 1 1.025 0.100 . 2 . . . . 66 VAL HG22 . 15440 1 769 . 1 1 66 66 VAL HG23 H 1 1.025 0.100 . 2 . . . . 66 VAL HG23 . 15440 1 770 . 1 1 66 66 VAL C C 13 169.851 0.300 . 1 . . . . 66 VAL C . 15440 1 771 . 1 1 66 66 VAL CA C 13 58.837 0.300 . 1 . . . . 66 VAL CA . 15440 1 772 . 1 1 66 66 VAL CB C 13 36.868 0.300 . 1 . . . . 66 VAL CB . 15440 1 773 . 1 1 66 66 VAL CG1 C 13 23.310 0.300 . 2 . . . . 66 VAL CG1 . 15440 1 774 . 1 1 66 66 VAL CG2 C 13 19.032 0.300 . 2 . . . . 66 VAL CG2 . 15440 1 775 . 1 1 66 66 VAL N N 15 124.291 0.300 . 1 . . . . 66 VAL N . 15440 1 776 . 1 1 67 67 ARG H H 1 9.136 0.100 . 1 . . . . 67 ARG H . 15440 1 777 . 1 1 67 67 ARG HA H 1 5.797 0.100 . 1 . . . . 67 ARG HA . 15440 1 778 . 1 1 67 67 ARG HB2 H 1 1.566 0.100 . 1 . . . . 67 ARG HB2 . 15440 1 779 . 1 1 67 67 ARG HB3 H 1 1.566 0.100 . 1 . . . . 67 ARG HB3 . 15440 1 780 . 1 1 67 67 ARG HD2 H 1 2.566 0.100 . 1 . . . . 67 ARG HD2 . 15440 1 781 . 1 1 67 67 ARG HD3 H 1 2.566 0.100 . 1 . . . . 67 ARG HD3 . 15440 1 782 . 1 1 67 67 ARG HG2 H 1 1.329 0.100 . 1 . . . . 67 ARG HG2 . 15440 1 783 . 1 1 67 67 ARG HG3 H 1 1.329 0.100 . 1 . . . . 67 ARG HG3 . 15440 1 784 . 1 1 67 67 ARG C C 13 176.405 0.300 . 1 . . . . 67 ARG C . 15440 1 785 . 1 1 67 67 ARG CA C 13 53.494 0.300 . 1 . . . . 67 ARG CA . 15440 1 786 . 1 1 67 67 ARG CB C 13 34.081 0.300 . 1 . . . . 67 ARG CB . 15440 1 787 . 1 1 67 67 ARG CD C 13 44.173 0.300 . 1 . . . . 67 ARG CD . 15440 1 788 . 1 1 67 67 ARG CG C 13 26.774 0.300 . 1 . . . . 67 ARG CG . 15440 1 789 . 1 1 67 67 ARG N N 15 128.587 0.300 . 1 . . . . 67 ARG N . 15440 1 790 . 1 1 68 68 PHE H H 1 8.907 0.100 . 1 . . . . 68 PHE H . 15440 1 791 . 1 1 68 68 PHE HA H 1 5.676 0.100 . 1 . . . . 68 PHE HA . 15440 1 792 . 1 1 68 68 PHE HB2 H 1 3.355 0.100 . 2 . . . . 68 PHE HB2 . 15440 1 793 . 1 1 68 68 PHE HB3 H 1 3.215 0.100 . 2 . . . . 68 PHE HB3 . 15440 1 794 . 1 1 68 68 PHE HD1 H 1 6.883 0.100 . 3 . . . . 68 PHE HD1 . 15440 1 795 . 1 1 68 68 PHE HD2 H 1 6.883 0.100 . 3 . . . . 68 PHE HD2 . 15440 1 796 . 1 1 68 68 PHE HE1 H 1 7.010 0.100 . 3 . . . . 68 PHE HE1 . 15440 1 797 . 1 1 68 68 PHE HE2 H 1 7.010 0.100 . 3 . . . . 68 PHE HE2 . 15440 1 798 . 1 1 68 68 PHE HZ H 1 7.010 0.100 . 1 . . . . 68 PHE HZ . 15440 1 799 . 1 1 68 68 PHE C C 13 172.789 0.300 . 1 . . . . 68 PHE C . 15440 1 800 . 1 1 68 68 PHE CA C 13 55.013 0.300 . 1 . . . . 68 PHE CA . 15440 1 801 . 1 1 68 68 PHE CB C 13 42.439 0.300 . 1 . . . . 68 PHE CB . 15440 1 802 . 1 1 68 68 PHE CD1 C 13 132.370 0.300 . 3 . . . . 68 PHE CD1 . 15440 1 803 . 1 1 68 68 PHE CD2 C 13 132.370 0.300 . 3 . . . . 68 PHE CD2 . 15440 1 804 . 1 1 68 68 PHE CE1 C 13 129.866 0.300 . 3 . . . . 68 PHE CE1 . 15440 1 805 . 1 1 68 68 PHE CE2 C 13 129.866 0.300 . 3 . . . . 68 PHE CE2 . 15440 1 806 . 1 1 68 68 PHE CZ C 13 128.929 0.300 . 1 . . . . 68 PHE CZ . 15440 1 807 . 1 1 68 68 PHE N N 15 122.241 0.300 . 1 . . . . 68 PHE N . 15440 1 808 . 1 1 69 69 THR H H 1 8.145 0.100 . 1 . . . . 69 THR H . 15440 1 809 . 1 1 69 69 THR HA H 1 5.513 0.100 . 1 . . . . 69 THR HA . 15440 1 810 . 1 1 69 69 THR HB H 1 3.914 0.100 . 1 . . . . 69 THR HB . 15440 1 811 . 1 1 69 69 THR HG21 H 1 1.210 0.100 . 1 . . . . 69 THR HG21 . 15440 1 812 . 1 1 69 69 THR HG22 H 1 1.210 0.100 . 1 . . . . 69 THR HG22 . 15440 1 813 . 1 1 69 69 THR HG23 H 1 1.210 0.100 . 1 . . . . 69 THR HG23 . 15440 1 814 . 1 1 69 69 THR C C 13 174.356 0.300 . 1 . . . . 69 THR C . 15440 1 815 . 1 1 69 69 THR CA C 13 60.086 0.300 . 1 . . . . 69 THR CA . 15440 1 816 . 1 1 69 69 THR CB C 13 71.129 0.300 . 1 . . . . 69 THR CB . 15440 1 817 . 1 1 69 69 THR CG2 C 13 22.488 0.300 . 1 . . . . 69 THR CG2 . 15440 1 818 . 1 1 69 69 THR N N 15 114.003 0.300 . 1 . . . . 69 THR N . 15440 1 819 . 1 1 70 70 LEU H H 1 9.087 0.100 . 1 . . . . 70 LEU H . 15440 1 820 . 1 1 70 70 LEU HA H 1 5.758 0.100 . 1 . . . . 70 LEU HA . 15440 1 821 . 1 1 70 70 LEU HB2 H 1 1.991 0.100 . 2 . . . . 70 LEU HB2 . 15440 1 822 . 1 1 70 70 LEU HB3 H 1 1.812 0.100 . 2 . . . . 70 LEU HB3 . 15440 1 823 . 1 1 70 70 LEU HD11 H 1 0.950 0.100 . 2 . . . . 70 LEU HD11 . 15440 1 824 . 1 1 70 70 LEU HD12 H 1 0.950 0.100 . 2 . . . . 70 LEU HD12 . 15440 1 825 . 1 1 70 70 LEU HD13 H 1 0.950 0.100 . 2 . . . . 70 LEU HD13 . 15440 1 826 . 1 1 70 70 LEU HD21 H 1 0.983 0.100 . 2 . . . . 70 LEU HD21 . 15440 1 827 . 1 1 70 70 LEU HD22 H 1 0.983 0.100 . 2 . . . . 70 LEU HD22 . 15440 1 828 . 1 1 70 70 LEU HD23 H 1 0.983 0.100 . 2 . . . . 70 LEU HD23 . 15440 1 829 . 1 1 70 70 LEU HG H 1 1.620 0.100 . 1 . . . . 70 LEU HG . 15440 1 830 . 1 1 70 70 LEU C C 13 177.474 0.300 . 1 . . . . 70 LEU C . 15440 1 831 . 1 1 70 70 LEU CA C 13 52.633 0.300 . 1 . . . . 70 LEU CA . 15440 1 832 . 1 1 70 70 LEU CB C 13 46.318 0.300 . 1 . . . . 70 LEU CB . 15440 1 833 . 1 1 70 70 LEU CD1 C 13 26.304 0.300 . 2 . . . . 70 LEU CD1 . 15440 1 834 . 1 1 70 70 LEU CD2 C 13 24.545 0.300 . 2 . . . . 70 LEU CD2 . 15440 1 835 . 1 1 70 70 LEU CG C 13 26.600 0.300 . 1 . . . . 70 LEU CG . 15440 1 836 . 1 1 70 70 LEU N N 15 123.569 0.300 . 1 . . . . 70 LEU N . 15440 1 837 . 1 1 71 71 ASP H H 1 8.049 0.100 . 1 . . . . 71 ASP H . 15440 1 838 . 1 1 71 71 ASP HA H 1 5.353 0.100 . 1 . . . . 71 ASP HA . 15440 1 839 . 1 1 71 71 ASP HB2 H 1 2.859 0.100 . 2 . . . . 71 ASP HB2 . 15440 1 840 . 1 1 71 71 ASP HB3 H 1 3.749 0.100 . 2 . . . . 71 ASP HB3 . 15440 1 841 . 1 1 71 71 ASP C C 13 181.241 0.300 . 1 . . . . 71 ASP C . 15440 1 842 . 1 1 71 71 ASP CA C 13 52.211 0.300 . 1 . . . . 71 ASP CA . 15440 1 843 . 1 1 71 71 ASP CB C 13 41.611 0.300 . 1 . . . . 71 ASP CB . 15440 1 844 . 1 1 71 71 ASP N N 15 118.069 0.100 . 1 . . . . 71 ASP N . 15440 1 845 . 1 1 72 72 ARG H H 1 8.486 0.100 . 1 . . . . 72 ARG H . 15440 1 846 . 1 1 72 72 ARG HA H 1 4.537 0.100 . 1 . . . . 72 ARG HA . 15440 1 847 . 1 1 72 72 ARG HB2 H 1 1.620 0.100 . 1 . . . . 72 ARG HB2 . 15440 1 848 . 1 1 72 72 ARG HB3 H 1 1.620 0.100 . 1 . . . . 72 ARG HB3 . 15440 1 849 . 1 1 72 72 ARG HD2 H 1 3.606 0.100 . 1 . . . . 72 ARG HD2 . 15440 1 850 . 1 1 72 72 ARG HD3 H 1 3.606 0.100 . 1 . . . . 72 ARG HD3 . 15440 1 851 . 1 1 72 72 ARG HG2 H 1 1.408 0.100 . 1 . . . . 72 ARG HG2 . 15440 1 852 . 1 1 72 72 ARG HG3 H 1 1.408 0.100 . 1 . . . . 72 ARG HG3 . 15440 1 853 . 1 1 72 72 ARG C C 13 176.461 0.100 . 1 . . . . 72 ARG C . 15440 1 854 . 1 1 72 72 ARG CA C 13 58.192 0.100 . 1 . . . . 72 ARG CA . 15440 1 855 . 1 1 72 72 ARG CB C 13 29.544 0.100 . 1 . . . . 72 ARG CB . 15440 1 856 . 1 1 72 72 ARG CD C 13 41.868 0.100 . 1 . . . . 72 ARG CD . 15440 1 857 . 1 1 72 72 ARG CG C 13 27.357 0.100 . 1 . . . . 72 ARG CG . 15440 1 858 . 1 1 72 72 ARG N N 15 119.072 0.100 . 1 . . . . 72 ARG N . 15440 1 859 . 1 1 73 73 GLN H H 1 8.024 0.100 . 1 . . . . 73 GLN H . 15440 1 860 . 1 1 73 73 GLN HA H 1 4.380 0.100 . 1 . . . . 73 GLN HA . 15440 1 861 . 1 1 73 73 GLN HB2 H 1 1.965 0.100 . 1 . . . . 73 GLN HB2 . 15440 1 862 . 1 1 73 73 GLN HB3 H 1 1.965 0.100 . 1 . . . . 73 GLN HB3 . 15440 1 863 . 1 1 73 73 GLN HG2 H 1 2.303 0.100 . 2 . . . . 73 GLN HG2 . 15440 1 864 . 1 1 73 73 GLN HG3 H 1 2.140 0.100 . 2 . . . . 73 GLN HG3 . 15440 1 865 . 1 1 73 73 GLN C C 13 175.500 0.100 . 1 . . . . 73 GLN C . 15440 1 866 . 1 1 73 73 GLN CA C 13 55.496 0.100 . 1 . . . . 73 GLN CA . 15440 1 867 . 1 1 73 73 GLN CB C 13 29.614 0.100 . 1 . . . . 73 GLN CB . 15440 1 868 . 1 1 73 73 GLN CG C 13 35.053 0.100 . 1 . . . . 73 GLN CG . 15440 1 869 . 1 1 73 73 GLN N N 15 116.396 0.100 . 1 . . . . 73 GLN N . 15440 1 870 . 1 1 74 74 GLY H H 1 7.856 0.100 . 1 . . . . 74 GLY H . 15440 1 871 . 1 1 74 74 GLY HA2 H 1 4.745 0.100 . 2 . . . . 74 GLY HA2 . 15440 1 872 . 1 1 74 74 GLY HA3 H 1 3.261 0.100 . 2 . . . . 74 GLY HA3 . 15440 1 873 . 1 1 74 74 GLY C C 13 174.032 0.100 . 1 . . . . 74 GLY C . 15440 1 874 . 1 1 74 74 GLY CA C 13 45.960 0.100 . 1 . . . . 74 GLY CA . 15440 1 875 . 1 1 74 74 GLY N N 15 108.015 0.100 . 1 . . . . 74 GLY N . 15440 1 876 . 1 1 75 75 HIS H H 1 8.628 0.100 . 1 . . . . 75 HIS H . 15440 1 877 . 1 1 75 75 HIS HA H 1 4.251 0.100 . 1 . . . . 75 HIS HA . 15440 1 878 . 1 1 75 75 HIS HB2 H 1 3.118 0.100 . 1 . . . . 75 HIS HB2 . 15440 1 879 . 1 1 75 75 HIS HB3 H 1 3.118 0.100 . 1 . . . . 75 HIS HB3 . 15440 1 880 . 1 1 75 75 HIS HD2 H 1 7.238 0.100 . 1 . . . . 75 HIS HD2 . 15440 1 881 . 1 1 75 75 HIS HE1 H 1 8.366 0.100 . 1 . . . . 75 HIS HE1 . 15440 1 882 . 1 1 75 75 HIS C C 13 175.830 0.100 . 1 . . . . 75 HIS C . 15440 1 883 . 1 1 75 75 HIS CA C 13 57.305 0.100 . 1 . . . . 75 HIS CA . 15440 1 884 . 1 1 75 75 HIS CB C 13 29.249 0.100 . 1 . . . . 75 HIS CB . 15440 1 885 . 1 1 75 75 HIS CD2 C 13 118.928 0.100 . 1 . . . . 75 HIS CD2 . 15440 1 886 . 1 1 75 75 HIS CE1 C 13 135.804 0.100 . 1 . . . . 75 HIS CE1 . 15440 1 887 . 1 1 75 75 HIS N N 15 121.300 0.100 . 1 . . . . 75 HIS N . 15440 1 888 . 1 1 76 76 VAL H H 1 8.142 0.100 . 1 . . . . 76 VAL H . 15440 1 889 . 1 1 76 76 VAL HA H 1 4.325 0.100 . 1 . . . . 76 VAL HA . 15440 1 890 . 1 1 76 76 VAL HB H 1 1.820 0.100 . 1 . . . . 76 VAL HB . 15440 1 891 . 1 1 76 76 VAL HG11 H 1 0.900 0.100 . 2 . . . . 76 VAL HG11 . 15440 1 892 . 1 1 76 76 VAL HG12 H 1 0.900 0.100 . 2 . . . . 76 VAL HG12 . 15440 1 893 . 1 1 76 76 VAL HG13 H 1 0.900 0.100 . 2 . . . . 76 VAL HG13 . 15440 1 894 . 1 1 76 76 VAL HG21 H 1 0.750 0.100 . 2 . . . . 76 VAL HG21 . 15440 1 895 . 1 1 76 76 VAL HG22 H 1 0.750 0.100 . 2 . . . . 76 VAL HG22 . 15440 1 896 . 1 1 76 76 VAL HG23 H 1 0.750 0.100 . 2 . . . . 76 VAL HG23 . 15440 1 897 . 1 1 76 76 VAL C C 13 176.972 0.100 . 1 . . . . 76 VAL C . 15440 1 898 . 1 1 76 76 VAL CA C 13 62.425 0.100 . 1 . . . . 76 VAL CA . 15440 1 899 . 1 1 76 76 VAL CB C 13 32.615 0.100 . 1 . . . . 76 VAL CB . 15440 1 900 . 1 1 76 76 VAL CG1 C 13 21.430 0.100 . 2 . . . . 76 VAL CG1 . 15440 1 901 . 1 1 76 76 VAL CG2 C 13 22.360 0.100 . 2 . . . . 76 VAL CG2 . 15440 1 902 . 1 1 76 76 VAL N N 15 122.663 0.100 . 1 . . . . 76 VAL N . 15440 1 903 . 1 1 77 77 LEU H H 1 9.184 0.100 . 1 . . . . 77 LEU H . 15440 1 904 . 1 1 77 77 LEU HA H 1 4.406 0.100 . 1 . . . . 77 LEU HA . 15440 1 905 . 1 1 77 77 LEU HB2 H 1 1.571 0.100 . 1 . . . . 77 LEU HB2 . 15440 1 906 . 1 1 77 77 LEU HB3 H 1 1.571 0.100 . 1 . . . . 77 LEU HB3 . 15440 1 907 . 1 1 77 77 LEU HD11 H 1 0.911 0.100 . 2 . . . . 77 LEU HD11 . 15440 1 908 . 1 1 77 77 LEU HD12 H 1 0.911 0.100 . 2 . . . . 77 LEU HD12 . 15440 1 909 . 1 1 77 77 LEU HD13 H 1 0.911 0.100 . 2 . . . . 77 LEU HD13 . 15440 1 910 . 1 1 77 77 LEU HD21 H 1 0.791 0.100 . 2 . . . . 77 LEU HD21 . 15440 1 911 . 1 1 77 77 LEU HD22 H 1 0.791 0.100 . 2 . . . . 77 LEU HD22 . 15440 1 912 . 1 1 77 77 LEU HD23 H 1 0.791 0.100 . 2 . . . . 77 LEU HD23 . 15440 1 913 . 1 1 77 77 LEU HG H 1 1.742 0.100 . 1 . . . . 77 LEU HG . 15440 1 914 . 1 1 77 77 LEU C C 13 177.059 0.100 . 1 . . . . 77 LEU C . 15440 1 915 . 1 1 77 77 LEU CA C 13 55.259 0.100 . 1 . . . . 77 LEU CA . 15440 1 916 . 1 1 77 77 LEU CB C 13 42.899 0.100 . 1 . . . . 77 LEU CB . 15440 1 917 . 1 1 77 77 LEU CD1 C 13 25.165 0.100 . 2 . . . . 77 LEU CD1 . 15440 1 918 . 1 1 77 77 LEU CD2 C 13 22.071 0.100 . 2 . . . . 77 LEU CD2 . 15440 1 919 . 1 1 77 77 LEU CG C 13 26.055 0.100 . 1 . . . . 77 LEU CG . 15440 1 920 . 1 1 77 77 LEU N N 15 129.304 0.100 . 1 . . . . 77 LEU N . 15440 1 921 . 1 1 78 78 ALA H H 1 7.421 0.100 . 1 . . . . 78 ALA H . 15440 1 922 . 1 1 78 78 ALA HA H 1 4.528 0.100 . 1 . . . . 78 ALA HA . 15440 1 923 . 1 1 78 78 ALA HB1 H 1 1.382 0.100 . 1 . . . . 78 ALA HB1 . 15440 1 924 . 1 1 78 78 ALA HB2 H 1 1.382 0.100 . 1 . . . . 78 ALA HB2 . 15440 1 925 . 1 1 78 78 ALA HB3 H 1 1.382 0.100 . 1 . . . . 78 ALA HB3 . 15440 1 926 . 1 1 78 78 ALA C C 13 175.354 0.100 . 1 . . . . 78 ALA C . 15440 1 927 . 1 1 78 78 ALA CA C 13 52.314 0.100 . 1 . . . . 78 ALA CA . 15440 1 928 . 1 1 78 78 ALA CB C 13 22.045 0.100 . 1 . . . . 78 ALA CB . 15440 1 929 . 1 1 78 78 ALA N N 15 119.985 0.100 . 1 . . . . 78 ALA N . 15440 1 930 . 1 1 79 79 VAL H H 1 8.338 0.100 . 1 . . . . 79 VAL H . 15440 1 931 . 1 1 79 79 VAL HA H 1 4.856 0.100 . 1 . . . . 79 VAL HA . 15440 1 932 . 1 1 79 79 VAL HB H 1 1.961 0.100 . 1 . . . . 79 VAL HB . 15440 1 933 . 1 1 79 79 VAL HG11 H 1 0.997 0.100 . 2 . . . . 79 VAL HG11 . 15440 1 934 . 1 1 79 79 VAL HG12 H 1 0.997 0.100 . 2 . . . . 79 VAL HG12 . 15440 1 935 . 1 1 79 79 VAL HG13 H 1 0.997 0.100 . 2 . . . . 79 VAL HG13 . 15440 1 936 . 1 1 79 79 VAL HG21 H 1 0.897 0.100 . 2 . . . . 79 VAL HG21 . 15440 1 937 . 1 1 79 79 VAL HG22 H 1 0.897 0.100 . 2 . . . . 79 VAL HG22 . 15440 1 938 . 1 1 79 79 VAL HG23 H 1 0.897 0.100 . 2 . . . . 79 VAL HG23 . 15440 1 939 . 1 1 79 79 VAL C C 13 174.773 0.100 . 1 . . . . 79 VAL C . 15440 1 940 . 1 1 79 79 VAL CA C 13 61.948 0.100 . 1 . . . . 79 VAL CA . 15440 1 941 . 1 1 79 79 VAL CB C 13 35.661 0.100 . 1 . . . . 79 VAL CB . 15440 1 942 . 1 1 79 79 VAL CG1 C 13 22.761 0.100 . 2 . . . . 79 VAL CG1 . 15440 1 943 . 1 1 79 79 VAL CG2 C 13 21.500 0.100 . 2 . . . . 79 VAL CG2 . 15440 1 944 . 1 1 79 79 VAL N N 15 119.022 0.100 . 1 . . . . 79 VAL N . 15440 1 945 . 1 1 80 80 THR H H 1 9.545 0.100 . 1 . . . . 80 THR H . 15440 1 946 . 1 1 80 80 THR HA H 1 4.568 0.100 . 1 . . . . 80 THR HA . 15440 1 947 . 1 1 80 80 THR HB H 1 3.796 0.100 . 1 . . . . 80 THR HB . 15440 1 948 . 1 1 80 80 THR HG21 H 1 1.110 0.100 . 1 . . . . 80 THR HG21 . 15440 1 949 . 1 1 80 80 THR HG22 H 1 1.110 0.100 . 1 . . . . 80 THR HG22 . 15440 1 950 . 1 1 80 80 THR HG23 H 1 1.110 0.100 . 1 . . . . 80 THR HG23 . 15440 1 951 . 1 1 80 80 THR C C 13 172.546 0.100 . 1 . . . . 80 THR C . 15440 1 952 . 1 1 80 80 THR CA C 13 61.609 0.100 . 1 . . . . 80 THR CA . 15440 1 953 . 1 1 80 80 THR CB C 13 71.731 0.100 . 1 . . . . 80 THR CB . 15440 1 954 . 1 1 80 80 THR CG2 C 13 21.360 0.100 . 1 . . . . 80 THR CG2 . 15440 1 955 . 1 1 80 80 THR N N 15 123.095 0.100 . 1 . . . . 80 THR N . 15440 1 956 . 1 1 81 81 LEU H H 1 8.942 0.100 . 1 . . . . 81 LEU H . 15440 1 957 . 1 1 81 81 LEU HA H 1 4.415 0.100 . 1 . . . . 81 LEU HA . 15440 1 958 . 1 1 81 81 LEU HB2 H 1 1.928 0.100 . 1 . . . . 81 LEU HB2 . 15440 1 959 . 1 1 81 81 LEU HB3 H 1 1.928 0.100 . 1 . . . . 81 LEU HB3 . 15440 1 960 . 1 1 81 81 LEU HD11 H 1 0.974 0.100 . 2 . . . . 81 LEU HD11 . 15440 1 961 . 1 1 81 81 LEU HD12 H 1 0.974 0.100 . 2 . . . . 81 LEU HD12 . 15440 1 962 . 1 1 81 81 LEU HD13 H 1 0.974 0.100 . 2 . . . . 81 LEU HD13 . 15440 1 963 . 1 1 81 81 LEU HD21 H 1 0.830 0.100 . 2 . . . . 81 LEU HD21 . 15440 1 964 . 1 1 81 81 LEU HD22 H 1 0.830 0.100 . 2 . . . . 81 LEU HD22 . 15440 1 965 . 1 1 81 81 LEU HD23 H 1 0.830 0.100 . 2 . . . . 81 LEU HD23 . 15440 1 966 . 1 1 81 81 LEU HG H 1 1.164 0.100 . 1 . . . . 81 LEU HG . 15440 1 967 . 1 1 81 81 LEU C C 13 175.736 0.100 . 1 . . . . 81 LEU C . 15440 1 968 . 1 1 81 81 LEU CA C 13 55.571 0.100 . 1 . . . . 81 LEU CA . 15440 1 969 . 1 1 81 81 LEU CB C 13 42.964 0.100 . 1 . . . . 81 LEU CB . 15440 1 970 . 1 1 81 81 LEU CD1 C 13 21.790 0.100 . 2 . . . . 81 LEU CD1 . 15440 1 971 . 1 1 81 81 LEU CD2 C 13 24.173 0.100 . 2 . . . . 81 LEU CD2 . 15440 1 972 . 1 1 81 81 LEU CG C 13 25.955 0.100 . 1 . . . . 81 LEU CG . 15440 1 973 . 1 1 81 81 LEU N N 15 128.590 0.100 . 1 . . . . 81 LEU N . 15440 1 974 . 1 1 82 82 VAL H H 1 8.604 0.100 . 1 . . . . 82 VAL H . 15440 1 975 . 1 1 82 82 VAL HA H 1 4.041 0.100 . 1 . . . . 82 VAL HA . 15440 1 976 . 1 1 82 82 VAL HB H 1 1.659 0.100 . 1 . . . . 82 VAL HB . 15440 1 977 . 1 1 82 82 VAL HG11 H 1 0.840 0.100 . 2 . . . . 82 VAL HG11 . 15440 1 978 . 1 1 82 82 VAL HG12 H 1 0.840 0.100 . 2 . . . . 82 VAL HG12 . 15440 1 979 . 1 1 82 82 VAL HG13 H 1 0.840 0.100 . 2 . . . . 82 VAL HG13 . 15440 1 980 . 1 1 82 82 VAL HG21 H 1 0.832 0.100 . 2 . . . . 82 VAL HG21 . 15440 1 981 . 1 1 82 82 VAL HG22 H 1 0.832 0.100 . 2 . . . . 82 VAL HG22 . 15440 1 982 . 1 1 82 82 VAL HG23 H 1 0.832 0.100 . 2 . . . . 82 VAL HG23 . 15440 1 983 . 1 1 82 82 VAL C C 13 175.956 0.100 . 1 . . . . 82 VAL C . 15440 1 984 . 1 1 82 82 VAL CA C 13 63.745 0.100 . 1 . . . . 82 VAL CA . 15440 1 985 . 1 1 82 82 VAL CB C 13 33.023 0.100 . 1 . . . . 82 VAL CB . 15440 1 986 . 1 1 82 82 VAL CG1 C 13 22.983 0.100 . 2 . . . . 82 VAL CG1 . 15440 1 987 . 1 1 82 82 VAL CG2 C 13 20.926 0.100 . 2 . . . . 82 VAL CG2 . 15440 1 988 . 1 1 82 82 VAL N N 15 127.875 0.100 . 1 . . . . 82 VAL N . 15440 1 989 . 1 1 83 83 SER H H 1 7.686 0.100 . 1 . . . . 83 SER H . 15440 1 990 . 1 1 83 83 SER HA H 1 4.607 0.100 . 1 . . . . 83 SER HA . 15440 1 991 . 1 1 83 83 SER HB2 H 1 3.727 0.100 . 2 . . . . 83 SER HB2 . 15440 1 992 . 1 1 83 83 SER HB3 H 1 3.449 0.100 . 2 . . . . 83 SER HB3 . 15440 1 993 . 1 1 83 83 SER C C 13 172.756 0.100 . 1 . . . . 83 SER C . 15440 1 994 . 1 1 83 83 SER CA C 13 57.641 0.100 . 1 . . . . 83 SER CA . 15440 1 995 . 1 1 83 83 SER CB C 13 64.785 0.100 . 1 . . . . 83 SER CB . 15440 1 996 . 1 1 83 83 SER N N 15 113.045 0.100 . 1 . . . . 83 SER N . 15440 1 997 . 1 1 84 84 SER H H 1 8.411 0.100 . 1 . . . . 84 SER H . 15440 1 998 . 1 1 84 84 SER HA H 1 4.497 0.100 . 1 . . . . 84 SER HA . 15440 1 999 . 1 1 84 84 SER HB2 H 1 3.966 0.100 . 2 . . . . 84 SER HB2 . 15440 1 1000 . 1 1 84 84 SER HB3 H 1 3.624 0.100 . 2 . . . . 84 SER HB3 . 15440 1 1001 . 1 1 84 84 SER C C 13 176.095 0.100 . 1 . . . . 84 SER C . 15440 1 1002 . 1 1 84 84 SER CA C 13 55.130 0.100 . 1 . . . . 84 SER CA . 15440 1 1003 . 1 1 84 84 SER CB C 13 64.309 0.100 . 1 . . . . 84 SER CB . 15440 1 1004 . 1 1 84 84 SER N N 15 116.480 0.100 . 1 . . . . 84 SER N . 15440 1 1005 . 1 1 85 85 ALA H H 1 10.679 0.100 . 1 . . . . 85 ALA H . 15440 1 1006 . 1 1 85 85 ALA HA H 1 4.480 0.100 . 1 . . . . 85 ALA HA . 15440 1 1007 . 1 1 85 85 ALA HB1 H 1 1.212 0.100 . 1 . . . . 85 ALA HB1 . 15440 1 1008 . 1 1 85 85 ALA HB2 H 1 1.212 0.100 . 1 . . . . 85 ALA HB2 . 15440 1 1009 . 1 1 85 85 ALA HB3 H 1 1.212 0.100 . 1 . . . . 85 ALA HB3 . 15440 1 1010 . 1 1 85 85 ALA C C 13 178.351 0.100 . 1 . . . . 85 ALA C . 15440 1 1011 . 1 1 85 85 ALA CA C 13 52.315 0.100 . 1 . . . . 85 ALA CA . 15440 1 1012 . 1 1 85 85 ALA CB C 13 20.261 0.100 . 1 . . . . 85 ALA CB . 15440 1 1013 . 1 1 85 85 ALA N N 15 131.463 0.100 . 1 . . . . 85 ALA N . 15440 1 1014 . 1 1 86 86 GLY H H 1 9.086 0.100 . 1 . . . . 86 GLY H . 15440 1 1015 . 1 1 86 86 GLY HA2 H 1 4.157 0.100 . 2 . . . . 86 GLY HA2 . 15440 1 1016 . 1 1 86 86 GLY HA3 H 1 3.602 0.100 . 2 . . . . 86 GLY HA3 . 15440 1 1017 . 1 1 86 86 GLY C C 13 173.068 0.100 . 1 . . . . 86 GLY C . 15440 1 1018 . 1 1 86 86 GLY CA C 13 45.607 0.100 . 1 . . . . 86 GLY CA . 15440 1 1019 . 1 1 86 86 GLY N N 15 104.914 0.100 . 1 . . . . 86 GLY N . 15440 1 1020 . 1 1 87 87 LEU H H 1 6.672 0.100 . 1 . . . . 87 LEU H . 15440 1 1021 . 1 1 87 87 LEU HA H 1 4.844 0.100 . 1 . . . . 87 LEU HA . 15440 1 1022 . 1 1 87 87 LEU HB2 H 1 1.743 0.100 . 2 . . . . 87 LEU HB2 . 15440 1 1023 . 1 1 87 87 LEU HB3 H 1 1.954 0.100 . 2 . . . . 87 LEU HB3 . 15440 1 1024 . 1 1 87 87 LEU HD11 H 1 0.870 0.100 . 2 . . . . 87 LEU HD11 . 15440 1 1025 . 1 1 87 87 LEU HD12 H 1 0.870 0.100 . 2 . . . . 87 LEU HD12 . 15440 1 1026 . 1 1 87 87 LEU HD13 H 1 0.870 0.100 . 2 . . . . 87 LEU HD13 . 15440 1 1027 . 1 1 87 87 LEU HD21 H 1 0.712 0.100 . 2 . . . . 87 LEU HD21 . 15440 1 1028 . 1 1 87 87 LEU HD22 H 1 0.712 0.100 . 2 . . . . 87 LEU HD22 . 15440 1 1029 . 1 1 87 87 LEU HD23 H 1 0.712 0.100 . 2 . . . . 87 LEU HD23 . 15440 1 1030 . 1 1 87 87 LEU HG H 1 1.550 0.100 . 1 . . . . 87 LEU HG . 15440 1 1031 . 1 1 87 87 LEU CA C 13 52.397 0.100 . 1 . . . . 87 LEU CA . 15440 1 1032 . 1 1 87 87 LEU CB C 13 47.005 0.100 . 1 . . . . 87 LEU CB . 15440 1 1033 . 1 1 87 87 LEU CD1 C 13 26.420 0.100 . 2 . . . . 87 LEU CD1 . 15440 1 1034 . 1 1 87 87 LEU CD2 C 13 25.480 0.100 . 2 . . . . 87 LEU CD2 . 15440 1 1035 . 1 1 87 87 LEU CG C 13 27.350 0.100 . 1 . . . . 87 LEU CG . 15440 1 1036 . 1 1 87 87 LEU N N 15 118.310 0.100 . 1 . . . . 87 LEU N . 15440 1 1037 . 1 1 88 88 PRO HA H 1 4.310 0.100 . 1 . . . . 88 PRO HA . 15440 1 1038 . 1 1 88 88 PRO HB2 H 1 1.840 0.100 . 1 . . . . 88 PRO HB2 . 15440 1 1039 . 1 1 88 88 PRO HB3 H 1 1.840 0.100 . 1 . . . . 88 PRO HB3 . 15440 1 1040 . 1 1 88 88 PRO HD2 H 1 4.411 0.100 . 2 . . . . 88 PRO HD2 . 15440 1 1041 . 1 1 88 88 PRO HD3 H 1 4.027 0.100 . 2 . . . . 88 PRO HD3 . 15440 1 1042 . 1 1 88 88 PRO HG2 H 1 1.661 0.100 . 1 . . . . 88 PRO HG2 . 15440 1 1043 . 1 1 88 88 PRO HG3 H 1 1.661 0.100 . 1 . . . . 88 PRO HG3 . 15440 1 1044 . 1 1 88 88 PRO C C 13 175.953 0.100 . 1 . . . . 88 PRO C . 15440 1 1045 . 1 1 88 88 PRO CA C 13 63.600 0.100 . 1 . . . . 88 PRO CA . 15440 1 1046 . 1 1 88 88 PRO CB C 13 37.446 0.100 . 1 . . . . 88 PRO CB . 15440 1 1047 . 1 1 88 88 PRO CD C 13 54.463 0.100 . 1 . . . . 88 PRO CD . 15440 1 1048 . 1 1 88 88 PRO CG C 13 22.657 0.100 . 1 . . . . 88 PRO CG . 15440 1 1049 . 1 1 89 89 SER H H 1 7.694 0.100 . 1 . . . . 89 SER H . 15440 1 1050 . 1 1 89 89 SER HA H 1 4.620 0.100 . 1 . . . . 89 SER HA . 15440 1 1051 . 1 1 89 89 SER HB2 H 1 3.650 0.100 . 2 . . . . 89 SER HB2 . 15440 1 1052 . 1 1 89 89 SER HB3 H 1 3.760 0.100 . 2 . . . . 89 SER HB3 . 15440 1 1053 . 1 1 89 89 SER C C 13 178.532 0.100 . 1 . . . . 89 SER C . 15440 1 1054 . 1 1 89 89 SER CA C 13 60.770 0.100 . 1 . . . . 89 SER CA . 15440 1 1055 . 1 1 89 89 SER CB C 13 60.170 0.100 . 1 . . . . 89 SER CB . 15440 1 1056 . 1 1 89 89 SER N N 15 113.400 0.100 . 1 . . . . 89 SER N . 15440 1 1057 . 1 1 90 90 LEU H H 1 6.673 0.100 . 1 . . . . 90 LEU H . 15440 1 1058 . 1 1 90 90 LEU HA H 1 3.521 0.100 . 1 . . . . 90 LEU HA . 15440 1 1059 . 1 1 90 90 LEU HB2 H 1 1.730 0.100 . 2 . . . . 90 LEU HB2 . 15440 1 1060 . 1 1 90 90 LEU HB3 H 1 1.618 0.100 . 2 . . . . 90 LEU HB3 . 15440 1 1061 . 1 1 90 90 LEU HD11 H 1 0.325 0.100 . 2 . . . . 90 LEU HD11 . 15440 1 1062 . 1 1 90 90 LEU HD12 H 1 0.325 0.100 . 2 . . . . 90 LEU HD12 . 15440 1 1063 . 1 1 90 90 LEU HD13 H 1 0.325 0.100 . 2 . . . . 90 LEU HD13 . 15440 1 1064 . 1 1 90 90 LEU HD21 H 1 -0.568 0.100 . 2 . . . . 90 LEU HD21 . 15440 1 1065 . 1 1 90 90 LEU HD22 H 1 -0.568 0.100 . 2 . . . . 90 LEU HD22 . 15440 1 1066 . 1 1 90 90 LEU HD23 H 1 -0.568 0.100 . 2 . . . . 90 LEU HD23 . 15440 1 1067 . 1 1 90 90 LEU HG H 1 0.717 0.100 . 1 . . . . 90 LEU HG . 15440 1 1068 . 1 1 90 90 LEU C C 13 177.093 0.100 . 1 . . . . 90 LEU C . 15440 1 1069 . 1 1 90 90 LEU CA C 13 57.190 0.100 . 1 . . . . 90 LEU CA . 15440 1 1070 . 1 1 90 90 LEU CB C 13 40.789 0.100 . 1 . . . . 90 LEU CB . 15440 1 1071 . 1 1 90 90 LEU CD1 C 13 24.545 0.100 . 2 . . . . 90 LEU CD1 . 15440 1 1072 . 1 1 90 90 LEU CD2 C 13 20.100 0.100 . 2 . . . . 90 LEU CD2 . 15440 1 1073 . 1 1 90 90 LEU CG C 13 25.500 0.100 . 1 . . . . 90 LEU CG . 15440 1 1074 . 1 1 90 90 LEU N N 15 122.851 0.100 . 1 . . . . 90 LEU N . 15440 1 1075 . 1 1 91 91 ASP H H 1 7.494 0.100 . 1 . . . . 91 ASP H . 15440 1 1076 . 1 1 91 91 ASP HA H 1 4.453 0.100 . 1 . . . . 91 ASP HA . 15440 1 1077 . 1 1 91 91 ASP HB2 H 1 2.620 0.100 . 1 . . . . 91 ASP HB2 . 15440 1 1078 . 1 1 91 91 ASP HB3 H 1 2.620 0.100 . 1 . . . . 91 ASP HB3 . 15440 1 1079 . 1 1 91 91 ASP C C 13 179.624 0.100 . 1 . . . . 91 ASP C . 15440 1 1080 . 1 1 91 91 ASP CA C 13 57.984 0.100 . 1 . . . . 91 ASP CA . 15440 1 1081 . 1 1 91 91 ASP CB C 13 39.604 0.100 . 1 . . . . 91 ASP CB . 15440 1 1082 . 1 1 91 91 ASP N N 15 121.659 0.100 . 1 . . . . 91 ASP N . 15440 1 1083 . 1 1 92 92 ARG H H 1 8.399 0.100 . 1 . . . . 92 ARG H . 15440 1 1084 . 1 1 92 92 ARG HA H 1 4.063 0.100 . 1 . . . . 92 ARG HA . 15440 1 1085 . 1 1 92 92 ARG HB2 H 1 1.551 0.100 . 1 . . . . 92 ARG HB2 . 15440 1 1086 . 1 1 92 92 ARG HB3 H 1 1.551 0.100 . 1 . . . . 92 ARG HB3 . 15440 1 1087 . 1 1 92 92 ARG HD2 H 1 3.260 0.100 . 2 . . . . 92 ARG HD2 . 15440 1 1088 . 1 1 92 92 ARG HD3 H 1 3.140 0.100 . 2 . . . . 92 ARG HD3 . 15440 1 1089 . 1 1 92 92 ARG HG2 H 1 1.838 0.100 . 1 . . . . 92 ARG HG2 . 15440 1 1090 . 1 1 92 92 ARG HG3 H 1 1.838 0.100 . 1 . . . . 92 ARG HG3 . 15440 1 1091 . 1 1 92 92 ARG C C 13 179.145 0.100 . 1 . . . . 92 ARG C . 15440 1 1092 . 1 1 92 92 ARG CA C 13 59.614 0.100 . 1 . . . . 92 ARG CA . 15440 1 1093 . 1 1 92 92 ARG CB C 13 30.673 0.100 . 1 . . . . 92 ARG CB . 15440 1 1094 . 1 1 92 92 ARG CD C 13 43.462 0.100 . 1 . . . . 92 ARG CD . 15440 1 1095 . 1 1 92 92 ARG CG C 13 27.707 0.100 . 1 . . . . 92 ARG CG . 15440 1 1096 . 1 1 92 92 ARG N N 15 120.544 0.100 . 1 . . . . 92 ARG N . 15440 1 1097 . 1 1 93 93 GLU H H 1 7.686 0.100 . 1 . . . . 93 GLU H . 15440 1 1098 . 1 1 93 93 GLU HA H 1 4.709 0.100 . 1 . . . . 93 GLU HA . 15440 1 1099 . 1 1 93 93 GLU HB2 H 1 2.124 0.100 . 2 . . . . 93 GLU HB2 . 15440 1 1100 . 1 1 93 93 GLU HB3 H 1 2.030 0.100 . 2 . . . . 93 GLU HB3 . 15440 1 1101 . 1 1 93 93 GLU HG2 H 1 2.308 0.100 . 1 . . . . 93 GLU HG2 . 15440 1 1102 . 1 1 93 93 GLU HG3 H 1 2.308 0.100 . 1 . . . . 93 GLU HG3 . 15440 1 1103 . 1 1 93 93 GLU C C 13 177.293 0.100 . 1 . . . . 93 GLU C . 15440 1 1104 . 1 1 93 93 GLU CA C 13 58.082 0.100 . 1 . . . . 93 GLU CA . 15440 1 1105 . 1 1 93 93 GLU CB C 13 27.949 0.100 . 1 . . . . 93 GLU CB . 15440 1 1106 . 1 1 93 93 GLU CG C 13 35.483 0.100 . 1 . . . . 93 GLU CG . 15440 1 1107 . 1 1 93 93 GLU N N 15 122.251 0.100 . 1 . . . . 93 GLU N . 15440 1 1108 . 1 1 94 94 ILE H H 1 8.604 0.100 . 1 . . . . 94 ILE H . 15440 1 1109 . 1 1 94 94 ILE HA H 1 3.561 0.100 . 1 . . . . 94 ILE HA . 15440 1 1110 . 1 1 94 94 ILE HB H 1 1.717 0.100 . 1 . . . . 94 ILE HB . 15440 1 1111 . 1 1 94 94 ILE HD11 H 1 0.810 0.100 . 1 . . . . 94 ILE HD11 . 15440 1 1112 . 1 1 94 94 ILE HD12 H 1 0.810 0.100 . 1 . . . . 94 ILE HD12 . 15440 1 1113 . 1 1 94 94 ILE HD13 H 1 0.810 0.100 . 1 . . . . 94 ILE HD13 . 15440 1 1114 . 1 1 94 94 ILE HG12 H 1 0.975 0.100 . 1 . . . . 94 ILE HG12 . 15440 1 1115 . 1 1 94 94 ILE HG13 H 1 0.975 0.100 . 1 . . . . 94 ILE HG13 . 15440 1 1116 . 1 1 94 94 ILE HG21 H 1 0.990 0.100 . 1 . . . . 94 ILE HG21 . 15440 1 1117 . 1 1 94 94 ILE HG22 H 1 0.990 0.100 . 1 . . . . 94 ILE HG22 . 15440 1 1118 . 1 1 94 94 ILE HG23 H 1 0.990 0.100 . 1 . . . . 94 ILE HG23 . 15440 1 1119 . 1 1 94 94 ILE C C 13 175.526 0.100 . 1 . . . . 94 ILE C . 15440 1 1120 . 1 1 94 94 ILE CA C 13 67.126 0.100 . 1 . . . . 94 ILE CA . 15440 1 1121 . 1 1 94 94 ILE CB C 13 37.385 0.100 . 1 . . . . 94 ILE CB . 15440 1 1122 . 1 1 94 94 ILE CD1 C 13 17.967 0.100 . 1 . . . . 94 ILE CD1 . 15440 1 1123 . 1 1 94 94 ILE CG1 C 13 30.510 0.100 . 1 . . . . 94 ILE CG1 . 15440 1 1124 . 1 1 94 94 ILE CG2 C 13 14.200 0.100 . 1 . . . . 94 ILE CG2 . 15440 1 1125 . 1 1 94 94 ILE N N 15 119.264 0.100 . 1 . . . . 94 ILE N . 15440 1 1126 . 1 1 95 95 GLN H H 1 6.834 0.100 . 1 . . . . 95 GLN H . 15440 1 1127 . 1 1 95 95 GLN HA H 1 3.885 0.100 . 1 . . . . 95 GLN HA . 15440 1 1128 . 1 1 95 95 GLN HB2 H 1 2.250 0.173 . 2 . . . . 95 GLN HB2 . 15440 1 1129 . 1 1 95 95 GLN HB3 H 1 2.061 0.100 . 2 . . . . 95 GLN HB3 . 15440 1 1130 . 1 1 95 95 GLN HE21 H 1 7.096 0.100 . 1 . . . . 95 GLN HE21 . 15440 1 1131 . 1 1 95 95 GLN HE22 H 1 7.150 0.100 . 1 . . . . 95 GLN HE22 . 15440 1 1132 . 1 1 95 95 GLN HG2 H 1 2.547 0.345 . 2 . . . . 95 GLN HG2 . 15440 1 1133 . 1 1 95 95 GLN HG3 H 1 2.543 0.100 . 2 . . . . 95 GLN HG3 . 15440 1 1134 . 1 1 95 95 GLN C C 13 176.917 0.100 . 1 . . . . 95 GLN C . 15440 1 1135 . 1 1 95 95 GLN CA C 13 58.915 0.100 . 1 . . . . 95 GLN CA . 15440 1 1136 . 1 1 95 95 GLN CB C 13 30.200 0.100 . 1 . . . . 95 GLN CB . 15440 1 1137 . 1 1 95 95 GLN CD C 13 179.267 0.100 . 1 . . . . 95 GLN CD . 15440 1 1138 . 1 1 95 95 GLN CG C 13 36.489 0.100 . 1 . . . . 95 GLN CG . 15440 1 1139 . 1 1 95 95 GLN N N 15 112.391 0.100 . 1 . . . . 95 GLN N . 15440 1 1140 . 1 1 95 95 GLN NE2 N 15 111.271 0.100 . 1 . . . . 95 GLN NE2 . 15440 1 1141 . 1 1 96 96 ALA H H 1 8.178 0.100 . 1 . . . . 96 ALA H . 15440 1 1142 . 1 1 96 96 ALA HA H 1 3.998 0.100 . 1 . . . . 96 ALA HA . 15440 1 1143 . 1 1 96 96 ALA HB1 H 1 1.455 0.100 . 1 . . . . 96 ALA HB1 . 15440 1 1144 . 1 1 96 96 ALA HB2 H 1 1.455 0.100 . 1 . . . . 96 ALA HB2 . 15440 1 1145 . 1 1 96 96 ALA HB3 H 1 1.455 0.100 . 1 . . . . 96 ALA HB3 . 15440 1 1146 . 1 1 96 96 ALA C C 13 181.125 0.100 . 1 . . . . 96 ALA C . 15440 1 1147 . 1 1 96 96 ALA CA C 13 54.676 0.100 . 1 . . . . 96 ALA CA . 15440 1 1148 . 1 1 96 96 ALA CB C 13 19.149 0.100 . 1 . . . . 96 ALA CB . 15440 1 1149 . 1 1 96 96 ALA N N 15 120.750 0.100 . 1 . . . . 96 ALA N . 15440 1 1150 . 1 1 97 97 LEU H H 1 9.448 0.100 . 1 . . . . 97 LEU H . 15440 1 1151 . 1 1 97 97 LEU HA H 1 3.882 0.100 . 1 . . . . 97 LEU HA . 15440 1 1152 . 1 1 97 97 LEU HB2 H 1 2.212 0.100 . 2 . . . . 97 LEU HB2 . 15440 1 1153 . 1 1 97 97 LEU HB3 H 1 2.160 0.100 . 2 . . . . 97 LEU HB3 . 15440 1 1154 . 1 1 97 97 LEU HD11 H 1 0.883 0.100 . 1 . . . . 97 LEU HD11 . 15440 1 1155 . 1 1 97 97 LEU HD12 H 1 0.883 0.100 . 1 . . . . 97 LEU HD12 . 15440 1 1156 . 1 1 97 97 LEU HD13 H 1 0.883 0.100 . 1 . . . . 97 LEU HD13 . 15440 1 1157 . 1 1 97 97 LEU HD21 H 1 0.883 0.100 . 1 . . . . 97 LEU HD21 . 15440 1 1158 . 1 1 97 97 LEU HD22 H 1 0.883 0.100 . 1 . . . . 97 LEU HD22 . 15440 1 1159 . 1 1 97 97 LEU HD23 H 1 0.883 0.100 . 1 . . . . 97 LEU HD23 . 15440 1 1160 . 1 1 97 97 LEU HG H 1 1.685 0.100 . 1 . . . . 97 LEU HG . 15440 1 1161 . 1 1 97 97 LEU C C 13 176.942 0.100 . 1 . . . . 97 LEU C . 15440 1 1162 . 1 1 97 97 LEU CA C 13 58.124 0.100 . 1 . . . . 97 LEU CA . 15440 1 1163 . 1 1 97 97 LEU CB C 13 40.891 0.100 . 1 . . . . 97 LEU CB . 15440 1 1164 . 1 1 97 97 LEU CD1 C 13 24.755 0.100 . 2 . . . . 97 LEU CD1 . 15440 1 1165 . 1 1 97 97 LEU CD2 C 13 22.983 0.100 . 2 . . . . 97 LEU CD2 . 15440 1 1166 . 1 1 97 97 LEU CG C 13 27.174 0.100 . 1 . . . . 97 LEU CG . 15440 1 1167 . 1 1 97 97 LEU N N 15 121.177 0.100 . 1 . . . . 97 LEU N . 15440 1 1168 . 1 1 98 98 VAL H H 1 6.745 0.100 . 1 . . . . 98 VAL H . 15440 1 1169 . 1 1 98 98 VAL HA H 1 3.083 0.100 . 1 . . . . 98 VAL HA . 15440 1 1170 . 1 1 98 98 VAL HB H 1 1.790 0.100 . 1 . . . . 98 VAL HB . 15440 1 1171 . 1 1 98 98 VAL HG11 H 1 0.886 0.100 . 2 . . . . 98 VAL HG11 . 15440 1 1172 . 1 1 98 98 VAL HG12 H 1 0.886 0.100 . 2 . . . . 98 VAL HG12 . 15440 1 1173 . 1 1 98 98 VAL HG13 H 1 0.886 0.100 . 2 . . . . 98 VAL HG13 . 15440 1 1174 . 1 1 98 98 VAL HG21 H 1 0.293 0.100 . 2 . . . . 98 VAL HG21 . 15440 1 1175 . 1 1 98 98 VAL HG22 H 1 0.293 0.100 . 2 . . . . 98 VAL HG22 . 15440 1 1176 . 1 1 98 98 VAL HG23 H 1 0.293 0.100 . 2 . . . . 98 VAL HG23 . 15440 1 1177 . 1 1 98 98 VAL C C 13 176.265 0.100 . 1 . . . . 98 VAL C . 15440 1 1178 . 1 1 98 98 VAL CA C 13 66.191 0.100 . 1 . . . . 98 VAL CA . 15440 1 1179 . 1 1 98 98 VAL CB C 13 31.700 0.100 . 1 . . . . 98 VAL CB . 15440 1 1180 . 1 1 98 98 VAL CG1 C 13 22.243 0.100 . 2 . . . . 98 VAL CG1 . 15440 1 1181 . 1 1 98 98 VAL CG2 C 13 22.358 0.100 . 2 . . . . 98 VAL CG2 . 15440 1 1182 . 1 1 98 98 VAL N N 15 116.396 0.100 . 1 . . . . 98 VAL N . 15440 1 1183 . 1 1 99 99 LYS H H 1 6.383 0.100 . 1 . . . . 99 LYS H . 15440 1 1184 . 1 1 99 99 LYS HA H 1 3.789 0.100 . 1 . . . . 99 LYS HA . 15440 1 1185 . 1 1 99 99 LYS HB2 H 1 1.875 0.100 . 1 . . . . 99 LYS HB2 . 15440 1 1186 . 1 1 99 99 LYS HB3 H 1 1.875 0.100 . 1 . . . . 99 LYS HB3 . 15440 1 1187 . 1 1 99 99 LYS HD2 H 1 1.650 0.100 . 2 . . . . 99 LYS HD2 . 15440 1 1188 . 1 1 99 99 LYS HD3 H 1 1.620 0.100 . 2 . . . . 99 LYS HD3 . 15440 1 1189 . 1 1 99 99 LYS HE2 H 1 2.650 0.100 . 2 . . . . 99 LYS HE2 . 15440 1 1190 . 1 1 99 99 LYS HE3 H 1 2.671 0.100 . 2 . . . . 99 LYS HE3 . 15440 1 1191 . 1 1 99 99 LYS HG2 H 1 1.404 0.100 . 2 . . . . 99 LYS HG2 . 15440 1 1192 . 1 1 99 99 LYS HG3 H 1 1.324 0.100 . 2 . . . . 99 LYS HG3 . 15440 1 1193 . 1 1 99 99 LYS C C 13 174.487 0.100 . 1 . . . . 99 LYS C . 15440 1 1194 . 1 1 99 99 LYS CA C 13 59.252 0.100 . 1 . . . . 99 LYS CA . 15440 1 1195 . 1 1 99 99 LYS CB C 13 32.675 0.100 . 1 . . . . 99 LYS CB . 15440 1 1196 . 1 1 99 99 LYS CD C 13 29.229 0.100 . 1 . . . . 99 LYS CD . 15440 1 1197 . 1 1 99 99 LYS CE C 13 41.184 0.100 . 1 . . . . 99 LYS CE . 15440 1 1198 . 1 1 99 99 LYS CG C 13 25.748 0.100 . 1 . . . . 99 LYS CG . 15440 1 1199 . 1 1 99 99 LYS N N 15 113.041 0.100 . 1 . . . . 99 LYS N . 15440 1 1200 . 1 1 100 100 ARG H H 1 8.254 0.100 . 1 . . . . 100 ARG H . 15440 1 1201 . 1 1 100 100 ARG HA H 1 3.892 0.100 . 1 . . . . 100 ARG HA . 15440 1 1202 . 1 1 100 100 ARG HB2 H 1 2.007 0.100 . 1 . . . . 100 ARG HB2 . 15440 1 1203 . 1 1 100 100 ARG HB3 H 1 2.007 0.100 . 1 . . . . 100 ARG HB3 . 15440 1 1204 . 1 1 100 100 ARG HD2 H 1 3.523 0.100 . 1 . . . . 100 ARG HD2 . 15440 1 1205 . 1 1 100 100 ARG HD3 H 1 3.523 0.100 . 1 . . . . 100 ARG HD3 . 15440 1 1206 . 1 1 100 100 ARG HG2 H 1 1.690 0.100 . 1 . . . . 100 ARG HG2 . 15440 1 1207 . 1 1 100 100 ARG HG3 H 1 1.690 0.100 . 1 . . . . 100 ARG HG3 . 15440 1 1208 . 1 1 100 100 ARG C C 13 176.490 0.100 . 1 . . . . 100 ARG C . 15440 1 1209 . 1 1 100 100 ARG CA C 13 58.548 0.100 . 1 . . . . 100 ARG CA . 15440 1 1210 . 1 1 100 100 ARG CB C 13 31.376 0.100 . 1 . . . . 100 ARG CB . 15440 1 1211 . 1 1 100 100 ARG CD C 13 43.648 0.100 . 1 . . . . 100 ARG CD . 15440 1 1212 . 1 1 100 100 ARG CG C 13 27.428 0.100 . 1 . . . . 100 ARG CG . 15440 1 1213 . 1 1 100 100 ARG N N 15 120.701 0.100 . 1 . . . . 100 ARG N . 15440 1 1214 . 1 1 101 101 ALA H H 1 7.324 0.100 . 1 . . . . 101 ALA H . 15440 1 1215 . 1 1 101 101 ALA HA H 1 4.785 0.100 . 1 . . . . 101 ALA HA . 15440 1 1216 . 1 1 101 101 ALA HB1 H 1 0.955 0.100 . 1 . . . . 101 ALA HB1 . 15440 1 1217 . 1 1 101 101 ALA HB2 H 1 0.955 0.100 . 1 . . . . 101 ALA HB2 . 15440 1 1218 . 1 1 101 101 ALA HB3 H 1 0.955 0.100 . 1 . . . . 101 ALA HB3 . 15440 1 1219 . 1 1 101 101 ALA C C 13 175.201 0.100 . 1 . . . . 101 ALA C . 15440 1 1220 . 1 1 101 101 ALA CA C 13 51.246 0.100 . 1 . . . . 101 ALA CA . 15440 1 1221 . 1 1 101 101 ALA CB C 13 20.668 0.100 . 1 . . . . 101 ALA CB . 15440 1 1222 . 1 1 101 101 ALA N N 15 117.353 0.100 . 1 . . . . 101 ALA N . 15440 1 1223 . 1 1 102 102 SER H H 1 6.624 0.100 . 1 . . . . 102 SER H . 15440 1 1224 . 1 1 102 102 SER HA H 1 4.030 0.100 . 1 . . . . 102 SER HA . 15440 1 1225 . 1 1 102 102 SER HB2 H 1 3.784 0.100 . 1 . . . . 102 SER HB2 . 15440 1 1226 . 1 1 102 102 SER HB3 H 1 3.784 0.100 . 1 . . . . 102 SER HB3 . 15440 1 1227 . 1 1 102 102 SER CA C 13 56.917 0.100 . 1 . . . . 102 SER CA . 15440 1 1228 . 1 1 102 102 SER CB C 13 63.959 0.100 . 1 . . . . 102 SER CB . 15440 1 1229 . 1 1 102 102 SER N N 15 112.570 0.100 . 1 . . . . 102 SER N . 15440 1 1230 . 1 1 103 103 PRO HA H 1 5.030 0.100 . 1 . . . . 103 PRO HA . 15440 1 1231 . 1 1 103 103 PRO HB2 H 1 1.791 0.100 . 2 . . . . 103 PRO HB2 . 15440 1 1232 . 1 1 103 103 PRO HB3 H 1 1.565 0.100 . 2 . . . . 103 PRO HB3 . 15440 1 1233 . 1 1 103 103 PRO HD2 H 1 3.700 0.100 . 2 . . . . 103 PRO HD2 . 15440 1 1234 . 1 1 103 103 PRO HD3 H 1 3.420 0.100 . 2 . . . . 103 PRO HD3 . 15440 1 1235 . 1 1 103 103 PRO HG2 H 1 1.502 0.100 . 1 . . . . 103 PRO HG2 . 15440 1 1236 . 1 1 103 103 PRO HG3 H 1 1.502 0.100 . 1 . . . . 103 PRO HG3 . 15440 1 1237 . 1 1 103 103 PRO C C 13 175.172 0.100 . 1 . . . . 103 PRO C . 15440 1 1238 . 1 1 103 103 PRO CA C 13 62.191 0.100 . 1 . . . . 103 PRO CA . 15440 1 1239 . 1 1 103 103 PRO CB C 13 33.960 0.100 . 1 . . . . 103 PRO CB . 15440 1 1240 . 1 1 103 103 PRO CD C 13 50.803 0.100 . 1 . . . . 103 PRO CD . 15440 1 1241 . 1 1 103 103 PRO CG C 13 28.164 0.100 . 1 . . . . 103 PRO CG . 15440 1 1242 . 1 1 104 104 LEU H H 1 8.991 0.100 . 1 . . . . 104 LEU H . 15440 1 1243 . 1 1 104 104 LEU HA H 1 5.020 0.100 . 1 . . . . 104 LEU HA . 15440 1 1244 . 1 1 104 104 LEU HB2 H 1 1.780 0.100 . 2 . . . . 104 LEU HB2 . 15440 1 1245 . 1 1 104 104 LEU HB3 H 1 1.550 0.100 . 2 . . . . 104 LEU HB3 . 15440 1 1246 . 1 1 104 104 LEU HD11 H 1 0.718 0.100 . 1 . . . . 104 LEU HD11 . 15440 1 1247 . 1 1 104 104 LEU HD12 H 1 0.718 0.100 . 1 . . . . 104 LEU HD12 . 15440 1 1248 . 1 1 104 104 LEU HD13 H 1 0.718 0.100 . 1 . . . . 104 LEU HD13 . 15440 1 1249 . 1 1 104 104 LEU HD21 H 1 0.718 0.100 . 1 . . . . 104 LEU HD21 . 15440 1 1250 . 1 1 104 104 LEU HD22 H 1 0.718 0.100 . 1 . . . . 104 LEU HD22 . 15440 1 1251 . 1 1 104 104 LEU HD23 H 1 0.718 0.100 . 1 . . . . 104 LEU HD23 . 15440 1 1252 . 1 1 104 104 LEU CA C 13 52.074 0.100 . 1 . . . . 104 LEU CA . 15440 1 1253 . 1 1 104 104 LEU CB C 13 41.956 0.100 . 1 . . . . 104 LEU CB . 15440 1 1254 . 1 1 104 104 LEU CD1 C 13 24.858 0.100 . 1 . . . . 104 LEU CD1 . 15440 1 1255 . 1 1 104 104 LEU CD2 C 13 24.858 0.100 . 1 . . . . 104 LEU CD2 . 15440 1 1256 . 1 1 104 104 LEU N N 15 121.889 0.100 . 1 . . . . 104 LEU N . 15440 1 1257 . 1 1 105 105 PRO HA H 1 4.306 0.100 . 1 . . . . 105 PRO HA . 15440 1 1258 . 1 1 105 105 PRO HB2 H 1 2.428 0.100 . 2 . . . . 105 PRO HB2 . 15440 1 1259 . 1 1 105 105 PRO HB3 H 1 1.950 0.100 . 2 . . . . 105 PRO HB3 . 15440 1 1260 . 1 1 105 105 PRO HD2 H 1 3.630 0.100 . 2 . . . . 105 PRO HD2 . 15440 1 1261 . 1 1 105 105 PRO HD3 H 1 3.790 0.100 . 2 . . . . 105 PRO HD3 . 15440 1 1262 . 1 1 105 105 PRO HG2 H 1 1.844 0.100 . 2 . . . . 105 PRO HG2 . 15440 1 1263 . 1 1 105 105 PRO HG3 H 1 1.740 0.100 . 2 . . . . 105 PRO HG3 . 15440 1 1264 . 1 1 105 105 PRO C C 13 179.105 0.100 . 1 . . . . 105 PRO C . 15440 1 1265 . 1 1 105 105 PRO CA C 13 66.194 0.100 . 1 . . . . 105 PRO CA . 15440 1 1266 . 1 1 105 105 PRO CB C 13 32.209 0.100 . 1 . . . . 105 PRO CB . 15440 1 1267 . 1 1 105 105 PRO CD C 13 58.300 0.100 . 1 . . . . 105 PRO CD . 15440 1 1268 . 1 1 105 105 PRO CG C 13 31.100 0.100 . 1 . . . . 105 PRO CG . 15440 1 1269 . 1 1 106 106 THR H H 1 8.810 0.100 . 1 . . . . 106 THR H . 15440 1 1270 . 1 1 106 106 THR HA H 1 3.657 0.100 . 1 . . . . 106 THR HA . 15440 1 1271 . 1 1 106 106 THR HB H 1 2.667 0.100 . 1 . . . . 106 THR HB . 15440 1 1272 . 1 1 106 106 THR HG21 H 1 1.140 0.100 . 1 . . . . 106 THR HG21 . 15440 1 1273 . 1 1 106 106 THR HG22 H 1 1.140 0.100 . 1 . . . . 106 THR HG22 . 15440 1 1274 . 1 1 106 106 THR HG23 H 1 1.140 0.100 . 1 . . . . 106 THR HG23 . 15440 1 1275 . 1 1 106 106 THR CA C 13 60.902 0.100 . 1 . . . . 106 THR CA . 15440 1 1276 . 1 1 106 106 THR N N 15 112.919 0.100 . 1 . . . . 106 THR N . 15440 1 1277 . 1 1 107 107 PRO HA H 1 4.600 0.100 . 1 . . . . 107 PRO HA . 15440 1 1278 . 1 1 107 107 PRO HD2 H 1 3.990 0.100 . 2 . . . . 107 PRO HD2 . 15440 1 1279 . 1 1 107 107 PRO HD3 H 1 3.600 0.100 . 2 . . . . 107 PRO HD3 . 15440 1 1280 . 1 1 107 107 PRO HG2 H 1 1.880 0.100 . 1 . . . . 107 PRO HG2 . 15440 1 1281 . 1 1 107 107 PRO HG3 H 1 1.880 0.100 . 1 . . . . 107 PRO HG3 . 15440 1 1282 . 1 1 107 107 PRO CG C 13 31.110 0.100 . 1 . . . . 107 PRO CG . 15440 1 1283 . 1 1 108 108 PRO HA H 1 4.240 0.100 . 1 . . . . 108 PRO HA . 15440 1 1284 . 1 1 108 108 PRO HB2 H 1 2.301 0.100 . 2 . . . . 108 PRO HB2 . 15440 1 1285 . 1 1 108 108 PRO HB3 H 1 1.906 0.100 . 2 . . . . 108 PRO HB3 . 15440 1 1286 . 1 1 108 108 PRO HD2 H 1 3.900 0.100 . 1 . . . . 108 PRO HD2 . 15440 1 1287 . 1 1 108 108 PRO HD3 H 1 3.900 0.100 . 1 . . . . 108 PRO HD3 . 15440 1 1288 . 1 1 108 108 PRO HG2 H 1 2.759 0.100 . 2 . . . . 108 PRO HG2 . 15440 1 1289 . 1 1 108 108 PRO HG3 H 1 2.600 0.100 . 2 . . . . 108 PRO HG3 . 15440 1 1290 . 1 1 108 108 PRO C C 13 176.482 0.100 . 1 . . . . 108 PRO C . 15440 1 1291 . 1 1 108 108 PRO CA C 13 62.200 0.100 . 1 . . . . 108 PRO CA . 15440 1 1292 . 1 1 108 108 PRO CB C 13 32.300 0.100 . 1 . . . . 108 PRO CB . 15440 1 1293 . 1 1 108 108 PRO CD C 13 49.573 0.100 . 1 . . . . 108 PRO CD . 15440 1 1294 . 1 1 108 108 PRO CG C 13 27.881 0.100 . 1 . . . . 108 PRO CG . 15440 1 1295 . 1 1 109 109 ALA H H 1 8.436 0.100 . 1 . . . . 109 ALA H . 15440 1 1296 . 1 1 109 109 ALA HA H 1 3.923 0.100 . 1 . . . . 109 ALA HA . 15440 1 1297 . 1 1 109 109 ALA HB1 H 1 1.355 0.100 . 1 . . . . 109 ALA HB1 . 15440 1 1298 . 1 1 109 109 ALA HB2 H 1 1.355 0.100 . 1 . . . . 109 ALA HB2 . 15440 1 1299 . 1 1 109 109 ALA HB3 H 1 1.355 0.100 . 1 . . . . 109 ALA HB3 . 15440 1 1300 . 1 1 109 109 ALA C C 13 179.798 0.100 . 1 . . . . 109 ALA C . 15440 1 1301 . 1 1 109 109 ALA CA C 13 55.498 0.100 . 1 . . . . 109 ALA CA . 15440 1 1302 . 1 1 109 109 ALA CB C 13 18.667 0.100 . 1 . . . . 109 ALA CB . 15440 1 1303 . 1 1 109 109 ALA N N 15 122.128 0.100 . 1 . . . . 109 ALA N . 15440 1 1304 . 1 1 110 110 ASP H H 1 8.265 0.100 . 1 . . . . 110 ASP H . 15440 1 1305 . 1 1 110 110 ASP HA H 1 4.414 0.100 . 1 . . . . 110 ASP HA . 15440 1 1306 . 1 1 110 110 ASP HB2 H 1 2.662 0.100 . 1 . . . . 110 ASP HB2 . 15440 1 1307 . 1 1 110 110 ASP HB3 H 1 2.662 0.100 . 1 . . . . 110 ASP HB3 . 15440 1 1308 . 1 1 110 110 ASP C C 13 176.354 0.100 . 1 . . . . 110 ASP C . 15440 1 1309 . 1 1 110 110 ASP CA C 13 55.249 0.100 . 1 . . . . 110 ASP CA . 15440 1 1310 . 1 1 110 110 ASP CB C 13 39.963 0.100 . 1 . . . . 110 ASP CB . 15440 1 1311 . 1 1 110 110 ASP N N 15 113.286 0.100 . 1 . . . . 110 ASP N . 15440 1 1312 . 1 1 111 111 ALA H H 1 8.024 0.100 . 1 . . . . 111 ALA H . 15440 1 1313 . 1 1 111 111 ALA HA H 1 4.169 0.100 . 1 . . . . 111 ALA HA . 15440 1 1314 . 1 1 111 111 ALA HB1 H 1 1.089 0.100 . 1 . . . . 111 ALA HB1 . 15440 1 1315 . 1 1 111 111 ALA HB2 H 1 1.089 0.100 . 1 . . . . 111 ALA HB2 . 15440 1 1316 . 1 1 111 111 ALA HB3 H 1 1.089 0.100 . 1 . . . . 111 ALA HB3 . 15440 1 1317 . 1 1 111 111 ALA C C 13 177.625 0.100 . 1 . . . . 111 ALA C . 15440 1 1318 . 1 1 111 111 ALA CA C 13 52.674 0.100 . 1 . . . . 111 ALA CA . 15440 1 1319 . 1 1 111 111 ALA CB C 13 19.054 0.100 . 1 . . . . 111 ALA CB . 15440 1 1320 . 1 1 111 111 ALA N N 15 121.181 0.100 . 1 . . . . 111 ALA N . 15440 1 1321 . 1 1 112 112 TYR H H 1 7.349 0.100 . 1 . . . . 112 TYR H . 15440 1 1322 . 1 1 112 112 TYR HA H 1 3.944 0.100 . 1 . . . . 112 TYR HA . 15440 1 1323 . 1 1 112 112 TYR HB2 H 1 3.107 0.100 . 2 . . . . 112 TYR HB2 . 15440 1 1324 . 1 1 112 112 TYR HB3 H 1 2.427 0.100 . 2 . . . . 112 TYR HB3 . 15440 1 1325 . 1 1 112 112 TYR HD1 H 1 6.760 0.100 . 3 . . . . 112 TYR HD1 . 15440 1 1326 . 1 1 112 112 TYR HD2 H 1 6.760 0.100 . 3 . . . . 112 TYR HD2 . 15440 1 1327 . 1 1 112 112 TYR HE1 H 1 6.380 0.100 . 3 . . . . 112 TYR HE1 . 15440 1 1328 . 1 1 112 112 TYR HE2 H 1 6.380 0.100 . 3 . . . . 112 TYR HE2 . 15440 1 1329 . 1 1 112 112 TYR C C 13 176.422 0.100 . 1 . . . . 112 TYR C . 15440 1 1330 . 1 1 112 112 TYR CA C 13 59.139 0.100 . 1 . . . . 112 TYR CA . 15440 1 1331 . 1 1 112 112 TYR CB C 13 40.301 0.100 . 1 . . . . 112 TYR CB . 15440 1 1332 . 1 1 112 112 TYR CD1 C 13 132.990 0.100 . 3 . . . . 112 TYR CD1 . 15440 1 1333 . 1 1 112 112 TYR CD2 C 13 132.990 0.100 . 3 . . . . 112 TYR CD2 . 15440 1 1334 . 1 1 112 112 TYR CE1 C 13 118.320 0.100 . 3 . . . . 112 TYR CE1 . 15440 1 1335 . 1 1 112 112 TYR CE2 C 13 118.320 0.100 . 3 . . . . 112 TYR CE2 . 15440 1 1336 . 1 1 112 112 TYR N N 15 116.156 0.100 . 1 . . . . 112 TYR N . 15440 1 1337 . 1 1 113 113 VAL H H 1 8.724 0.100 . 1 . . . . 113 VAL H . 15440 1 1338 . 1 1 113 113 VAL HA H 1 4.150 0.100 . 1 . . . . 113 VAL HA . 15440 1 1339 . 1 1 113 113 VAL HB H 1 1.980 0.100 . 1 . . . . 113 VAL HB . 15440 1 1340 . 1 1 113 113 VAL HG11 H 1 0.902 0.100 . 2 . . . . 113 VAL HG11 . 15440 1 1341 . 1 1 113 113 VAL HG12 H 1 0.902 0.100 . 2 . . . . 113 VAL HG12 . 15440 1 1342 . 1 1 113 113 VAL HG13 H 1 0.902 0.100 . 2 . . . . 113 VAL HG13 . 15440 1 1343 . 1 1 113 113 VAL HG21 H 1 0.680 0.100 . 2 . . . . 113 VAL HG21 . 15440 1 1344 . 1 1 113 113 VAL HG22 H 1 0.680 0.100 . 2 . . . . 113 VAL HG22 . 15440 1 1345 . 1 1 113 113 VAL HG23 H 1 0.680 0.100 . 2 . . . . 113 VAL HG23 . 15440 1 1346 . 1 1 113 113 VAL CA C 13 62.319 0.100 . 1 . . . . 113 VAL CA . 15440 1 1347 . 1 1 113 113 VAL CB C 13 34.067 0.100 . 1 . . . . 113 VAL CB . 15440 1 1348 . 1 1 113 113 VAL CG1 C 13 21.108 0.100 . 1 . . . . 113 VAL CG1 . 15440 1 1349 . 1 1 113 113 VAL CG2 C 13 21.108 0.100 . 1 . . . . 113 VAL CG2 . 15440 1 1350 . 1 1 113 113 VAL N N 15 121.658 0.100 . 1 . . . . 113 VAL N . 15440 1 1351 . 1 1 114 114 ASN H H 1 7.500 0.100 . 1 . . . . 114 ASN H . 15440 1 1352 . 1 1 114 114 ASN HA H 1 4.420 0.100 . 1 . . . . 114 ASN HA . 15440 1 1353 . 1 1 114 114 ASN HB2 H 1 2.901 0.100 . 2 . . . . 114 ASN HB2 . 15440 1 1354 . 1 1 114 114 ASN HB3 H 1 2.857 0.100 . 2 . . . . 114 ASN HB3 . 15440 1 1355 . 1 1 114 114 ASN HD21 H 1 6.913 0.100 . 1 . . . . 114 ASN HD21 . 15440 1 1356 . 1 1 114 114 ASN HD22 H 1 7.720 0.100 . 1 . . . . 114 ASN HD22 . 15440 1 1357 . 1 1 114 114 ASN C C 13 176.024 0.100 . 1 . . . . 114 ASN C . 15440 1 1358 . 1 1 114 114 ASN CA C 13 54.313 0.100 . 1 . . . . 114 ASN CA . 15440 1 1359 . 1 1 114 114 ASN CB C 13 38.792 0.100 . 1 . . . . 114 ASN CB . 15440 1 1360 . 1 1 114 114 ASN CG C 13 176.942 0.100 . 1 . . . . 114 ASN CG . 15440 1 1361 . 1 1 114 114 ASN ND2 N 15 113.050 0.100 . 1 . . . . 114 ASN ND2 . 15440 1 1362 . 1 1 115 115 GLY H H 1 8.652 0.100 . 1 . . . . 115 GLY H . 15440 1 1363 . 1 1 115 115 GLY HA2 H 1 4.301 0.100 . 2 . . . . 115 GLY HA2 . 15440 1 1364 . 1 1 115 115 GLY HA3 H 1 3.581 0.100 . 2 . . . . 115 GLY HA3 . 15440 1 1365 . 1 1 115 115 GLY C C 13 173.979 0.100 . 1 . . . . 115 GLY C . 15440 1 1366 . 1 1 115 115 GLY CA C 13 45.833 0.100 . 1 . . . . 115 GLY CA . 15440 1 1367 . 1 1 115 115 GLY N N 15 102.997 0.100 . 1 . . . . 115 GLY N . 15440 1 1368 . 1 1 116 116 THR H H 1 7.904 0.100 . 1 . . . . 116 THR H . 15440 1 1369 . 1 1 116 116 THR HA H 1 4.323 0.100 . 1 . . . . 116 THR HA . 15440 1 1370 . 1 1 116 116 THR HB H 1 4.136 0.100 . 1 . . . . 116 THR HB . 15440 1 1371 . 1 1 116 116 THR HG21 H 1 1.087 0.100 . 1 . . . . 116 THR HG21 . 15440 1 1372 . 1 1 116 116 THR HG22 H 1 1.087 0.100 . 1 . . . . 116 THR HG22 . 15440 1 1373 . 1 1 116 116 THR HG23 H 1 1.087 0.100 . 1 . . . . 116 THR HG23 . 15440 1 1374 . 1 1 116 116 THR C C 13 172.513 0.100 . 1 . . . . 116 THR C . 15440 1 1375 . 1 1 116 116 THR CA C 13 60.197 0.100 . 1 . . . . 116 THR CA . 15440 1 1376 . 1 1 116 116 THR CB C 13 73.498 0.100 . 1 . . . . 116 THR CB . 15440 1 1377 . 1 1 116 116 THR CG2 C 13 22.550 0.100 . 1 . . . . 116 THR CG2 . 15440 1 1378 . 1 1 116 116 THR N N 15 109.931 0.100 . 1 . . . . 116 THR N . 15440 1 1379 . 1 1 117 117 VAL H H 1 8.266 0.100 . 1 . . . . 117 VAL H . 15440 1 1380 . 1 1 117 117 VAL HA H 1 4.351 0.100 . 1 . . . . 117 VAL HA . 15440 1 1381 . 1 1 117 117 VAL HB H 1 1.822 0.100 . 1 . . . . 117 VAL HB . 15440 1 1382 . 1 1 117 117 VAL HG11 H 1 0.372 0.100 . 2 . . . . 117 VAL HG11 . 15440 1 1383 . 1 1 117 117 VAL HG12 H 1 0.372 0.100 . 2 . . . . 117 VAL HG12 . 15440 1 1384 . 1 1 117 117 VAL HG13 H 1 0.372 0.100 . 2 . . . . 117 VAL HG13 . 15440 1 1385 . 1 1 117 117 VAL HG21 H 1 0.204 0.100 . 2 . . . . 117 VAL HG21 . 15440 1 1386 . 1 1 117 117 VAL HG22 H 1 0.204 0.100 . 2 . . . . 117 VAL HG22 . 15440 1 1387 . 1 1 117 117 VAL HG23 H 1 0.204 0.100 . 2 . . . . 117 VAL HG23 . 15440 1 1388 . 1 1 117 117 VAL C C 13 171.444 0.100 . 1 . . . . 117 VAL C . 15440 1 1389 . 1 1 117 117 VAL CA C 13 59.852 0.100 . 1 . . . . 117 VAL CA . 15440 1 1390 . 1 1 117 117 VAL CB C 13 34.544 0.100 . 1 . . . . 117 VAL CB . 15440 1 1391 . 1 1 117 117 VAL CG1 C 13 21.108 0.100 . 2 . . . . 117 VAL CG1 . 15440 1 1392 . 1 1 117 117 VAL CG2 C 13 20.826 0.100 . 2 . . . . 117 VAL CG2 . 15440 1 1393 . 1 1 117 117 VAL N N 15 117.829 0.100 . 1 . . . . 117 VAL N . 15440 1 1394 . 1 1 118 118 GLU H H 1 8.145 0.100 . 1 . . . . 118 GLU H . 15440 1 1395 . 1 1 118 118 GLU HA H 1 5.226 0.100 . 1 . . . . 118 GLU HA . 15440 1 1396 . 1 1 118 118 GLU HB2 H 1 1.770 0.100 . 2 . . . . 118 GLU HB2 . 15440 1 1397 . 1 1 118 118 GLU HB3 H 1 1.720 0.100 . 2 . . . . 118 GLU HB3 . 15440 1 1398 . 1 1 118 118 GLU HG2 H 1 1.929 0.100 . 1 . . . . 118 GLU HG2 . 15440 1 1399 . 1 1 118 118 GLU HG3 H 1 1.929 0.100 . 1 . . . . 118 GLU HG3 . 15440 1 1400 . 1 1 118 118 GLU C C 13 174.932 0.100 . 1 . . . . 118 GLU C . 15440 1 1401 . 1 1 118 118 GLU CA C 13 54.315 0.100 . 1 . . . . 118 GLU CA . 15440 1 1402 . 1 1 118 118 GLU CB C 13 32.795 0.100 . 1 . . . . 118 GLU CB . 15440 1 1403 . 1 1 118 118 GLU CG C 13 37.202 0.100 . 1 . . . . 118 GLU CG . 15440 1 1404 . 1 1 118 118 GLU N N 15 126.443 0.100 . 1 . . . . 118 GLU N . 15440 1 1405 . 1 1 119 119 LEU H H 1 8.484 0.100 . 1 . . . . 119 LEU H . 15440 1 1406 . 1 1 119 119 LEU HA H 1 4.550 0.100 . 1 . . . . 119 LEU HA . 15440 1 1407 . 1 1 119 119 LEU HB2 H 1 1.563 0.100 . 1 . . . . 119 LEU HB2 . 15440 1 1408 . 1 1 119 119 LEU HB3 H 1 1.563 0.100 . 1 . . . . 119 LEU HB3 . 15440 1 1409 . 1 1 119 119 LEU HD11 H 1 1.020 0.100 . 2 . . . . 119 LEU HD11 . 15440 1 1410 . 1 1 119 119 LEU HD12 H 1 1.020 0.100 . 2 . . . . 119 LEU HD12 . 15440 1 1411 . 1 1 119 119 LEU HD13 H 1 1.020 0.100 . 2 . . . . 119 LEU HD13 . 15440 1 1412 . 1 1 119 119 LEU HD21 H 1 0.807 0.100 . 2 . . . . 119 LEU HD21 . 15440 1 1413 . 1 1 119 119 LEU HD22 H 1 0.807 0.100 . 2 . . . . 119 LEU HD22 . 15440 1 1414 . 1 1 119 119 LEU HD23 H 1 0.807 0.100 . 2 . . . . 119 LEU HD23 . 15440 1 1415 . 1 1 119 119 LEU HG H 1 1.170 0.100 . 1 . . . . 119 LEU HG . 15440 1 1416 . 1 1 119 119 LEU C C 13 174.154 0.100 . 1 . . . . 119 LEU C . 15440 1 1417 . 1 1 119 119 LEU CA C 13 53.920 0.100 . 1 . . . . 119 LEU CA . 15440 1 1418 . 1 1 119 119 LEU CB C 13 45.731 0.100 . 1 . . . . 119 LEU CB . 15440 1 1419 . 1 1 119 119 LEU CD1 C 13 24.831 0.100 . 2 . . . . 119 LEU CD1 . 15440 1 1420 . 1 1 119 119 LEU CD2 C 13 26.200 0.100 . 2 . . . . 119 LEU CD2 . 15440 1 1421 . 1 1 119 119 LEU CG C 13 26.420 0.100 . 1 . . . . 119 LEU CG . 15440 1 1422 . 1 1 119 119 LEU N N 15 125.533 0.100 . 1 . . . . 119 LEU N . 15440 1 1423 . 1 1 120 120 THR H H 1 7.952 0.100 . 1 . . . . 120 THR H . 15440 1 1424 . 1 1 120 120 THR HA H 1 5.387 0.100 . 1 . . . . 120 THR HA . 15440 1 1425 . 1 1 120 120 THR HB H 1 3.824 0.100 . 1 . . . . 120 THR HB . 15440 1 1426 . 1 1 120 120 THR HG21 H 1 0.981 0.100 . 1 . . . . 120 THR HG21 . 15440 1 1427 . 1 1 120 120 THR HG22 H 1 0.981 0.100 . 1 . . . . 120 THR HG22 . 15440 1 1428 . 1 1 120 120 THR HG23 H 1 0.981 0.100 . 1 . . . . 120 THR HG23 . 15440 1 1429 . 1 1 120 120 THR C C 13 174.170 0.100 . 1 . . . . 120 THR C . 15440 1 1430 . 1 1 120 120 THR CA C 13 61.130 0.100 . 1 . . . . 120 THR CA . 15440 1 1431 . 1 1 120 120 THR CB C 13 70.421 0.100 . 1 . . . . 120 THR CB . 15440 1 1432 . 1 1 120 120 THR CG2 C 13 20.806 0.100 . 1 . . . . 120 THR CG2 . 15440 1 1433 . 1 1 120 120 THR N N 15 115.436 0.100 . 1 . . . . 120 THR N . 15440 1 1434 . 1 1 121 121 LEU H H 1 9.015 0.100 . 1 . . . . 121 LEU H . 15440 1 1435 . 1 1 121 121 LEU HA H 1 5.033 0.100 . 1 . . . . 121 LEU HA . 15440 1 1436 . 1 1 121 121 LEU HB2 H 1 1.639 0.100 . 1 . . . . 121 LEU HB2 . 15440 1 1437 . 1 1 121 121 LEU HB3 H 1 1.639 0.100 . 1 . . . . 121 LEU HB3 . 15440 1 1438 . 1 1 121 121 LEU HD11 H 1 0.761 0.100 . 2 . . . . 121 LEU HD11 . 15440 1 1439 . 1 1 121 121 LEU HD12 H 1 0.761 0.100 . 2 . . . . 121 LEU HD12 . 15440 1 1440 . 1 1 121 121 LEU HD13 H 1 0.761 0.100 . 2 . . . . 121 LEU HD13 . 15440 1 1441 . 1 1 121 121 LEU HD21 H 1 0.760 0.100 . 2 . . . . 121 LEU HD21 . 15440 1 1442 . 1 1 121 121 LEU HD22 H 1 0.760 0.100 . 2 . . . . 121 LEU HD22 . 15440 1 1443 . 1 1 121 121 LEU HD23 H 1 0.760 0.100 . 2 . . . . 121 LEU HD23 . 15440 1 1444 . 1 1 121 121 LEU HG H 1 1.320 0.100 . 1 . . . . 121 LEU HG . 15440 1 1445 . 1 1 121 121 LEU CA C 13 51.972 0.100 . 1 . . . . 121 LEU CA . 15440 1 1446 . 1 1 121 121 LEU CB C 13 46.202 0.100 . 1 . . . . 121 LEU CB . 15440 1 1447 . 1 1 121 121 LEU CD1 C 13 24.900 0.100 . 2 . . . . 121 LEU CD1 . 15440 1 1448 . 1 1 121 121 LEU CD2 C 13 25.480 0.100 . 2 . . . . 121 LEU CD2 . 15440 1 1449 . 1 1 121 121 LEU CG C 13 27.300 0.100 . 1 . . . . 121 LEU CG . 15440 1 1450 . 1 1 121 121 LEU N N 15 126.196 0.100 . 1 . . . . 121 LEU N . 15440 1 1451 . 1 1 122 122 PRO HA H 1 5.295 0.100 . 1 . . . . 122 PRO HA . 15440 1 1452 . 1 1 122 122 PRO HB2 H 1 2.240 0.100 . 2 . . . . 122 PRO HB2 . 15440 1 1453 . 1 1 122 122 PRO HB3 H 1 1.740 0.100 . 2 . . . . 122 PRO HB3 . 15440 1 1454 . 1 1 122 122 PRO HD2 H 1 3.792 0.100 . 2 . . . . 122 PRO HD2 . 15440 1 1455 . 1 1 122 122 PRO HD3 H 1 3.733 0.100 . 2 . . . . 122 PRO HD3 . 15440 1 1456 . 1 1 122 122 PRO HG2 H 1 2.101 0.100 . 2 . . . . 122 PRO HG2 . 15440 1 1457 . 1 1 122 122 PRO HG3 H 1 2.005 0.100 . 2 . . . . 122 PRO HG3 . 15440 1 1458 . 1 1 122 122 PRO C C 13 176.460 0.100 . 1 . . . . 122 PRO C . 15440 1 1459 . 1 1 122 122 PRO CA C 13 61.022 0.100 . 1 . . . . 122 PRO CA . 15440 1 1460 . 1 1 122 122 PRO CB C 13 31.966 0.100 . 1 . . . . 122 PRO CB . 15440 1 1461 . 1 1 122 122 PRO CD C 13 51.622 0.100 . 1 . . . . 122 PRO CD . 15440 1 1462 . 1 1 122 122 PRO CG C 13 26.438 0.100 . 1 . . . . 122 PRO CG . 15440 1 1463 . 1 1 123 123 ILE H H 1 8.652 0.100 . 1 . . . . 123 ILE H . 15440 1 1464 . 1 1 123 123 ILE HA H 1 4.158 0.100 . 1 . . . . 123 ILE HA . 15440 1 1465 . 1 1 123 123 ILE HB H 1 1.690 0.100 . 1 . . . . 123 ILE HB . 15440 1 1466 . 1 1 123 123 ILE HD11 H 1 0.680 0.100 . 1 . . . . 123 ILE HD11 . 15440 1 1467 . 1 1 123 123 ILE HD12 H 1 0.680 0.100 . 1 . . . . 123 ILE HD12 . 15440 1 1468 . 1 1 123 123 ILE HD13 H 1 0.680 0.100 . 1 . . . . 123 ILE HD13 . 15440 1 1469 . 1 1 123 123 ILE HG12 H 1 1.340 0.100 . 2 . . . . 123 ILE HG12 . 15440 1 1470 . 1 1 123 123 ILE HG13 H 1 1.168 0.100 . 2 . . . . 123 ILE HG13 . 15440 1 1471 . 1 1 123 123 ILE HG21 H 1 0.439 0.100 . 1 . . . . 123 ILE HG21 . 15440 1 1472 . 1 1 123 123 ILE HG22 H 1 0.439 0.100 . 1 . . . . 123 ILE HG22 . 15440 1 1473 . 1 1 123 123 ILE HG23 H 1 0.439 0.100 . 1 . . . . 123 ILE HG23 . 15440 1 1474 . 1 1 123 123 ILE C C 13 173.236 0.100 . 1 . . . . 123 ILE C . 15440 1 1475 . 1 1 123 123 ILE CA C 13 59.145 0.100 . 1 . . . . 123 ILE CA . 15440 1 1476 . 1 1 123 123 ILE CB C 13 38.182 0.100 . 1 . . . . 123 ILE CB . 15440 1 1477 . 1 1 123 123 ILE CD1 C 13 11.100 0.100 . 1 . . . . 123 ILE CD1 . 15440 1 1478 . 1 1 123 123 ILE CG1 C 13 30.995 0.100 . 1 . . . . 123 ILE CG1 . 15440 1 1479 . 1 1 123 123 ILE CG2 C 13 17.884 0.100 . 1 . . . . 123 ILE CG2 . 15440 1 1480 . 1 1 123 123 ILE N N 15 121.659 0.100 . 1 . . . . 123 ILE N . 15440 1 1481 . 1 1 124 124 ASP H H 1 8.340 0.100 . 1 . . . . 124 ASP H . 15440 1 1482 . 1 1 124 124 ASP HA H 1 5.037 0.100 . 1 . . . . 124 ASP HA . 15440 1 1483 . 1 1 124 124 ASP HB2 H 1 2.454 0.100 . 1 . . . . 124 ASP HB2 . 15440 1 1484 . 1 1 124 124 ASP HB3 H 1 2.454 0.100 . 1 . . . . 124 ASP HB3 . 15440 1 1485 . 1 1 124 124 ASP C C 13 174.227 0.100 . 1 . . . . 124 ASP C . 15440 1 1486 . 1 1 124 124 ASP CA C 13 52.664 0.100 . 1 . . . . 124 ASP CA . 15440 1 1487 . 1 1 124 124 ASP CB C 13 44.311 0.100 . 1 . . . . 124 ASP CB . 15440 1 1488 . 1 1 124 124 ASP N N 15 124.516 0.100 . 1 . . . . 124 ASP N . 15440 1 1489 . 1 1 125 125 PHE H H 1 8.914 0.100 . 1 . . . . 125 PHE H . 15440 1 1490 . 1 1 125 125 PHE HA H 1 4.460 0.100 . 1 . . . . 125 PHE HA . 15440 1 1491 . 1 1 125 125 PHE HB2 H 1 2.779 0.100 . 2 . . . . 125 PHE HB2 . 15440 1 1492 . 1 1 125 125 PHE HB3 H 1 2.661 0.100 . 2 . . . . 125 PHE HB3 . 15440 1 1493 . 1 1 125 125 PHE HD1 H 1 6.600 0.100 . 3 . . . . 125 PHE HD1 . 15440 1 1494 . 1 1 125 125 PHE HD2 H 1 6.600 0.100 . 3 . . . . 125 PHE HD2 . 15440 1 1495 . 1 1 125 125 PHE HE1 H 1 7.020 0.100 . 3 . . . . 125 PHE HE1 . 15440 1 1496 . 1 1 125 125 PHE HE2 H 1 7.020 0.100 . 3 . . . . 125 PHE HE2 . 15440 1 1497 . 1 1 125 125 PHE HZ H 1 6.890 0.100 . 1 . . . . 125 PHE HZ . 15440 1 1498 . 1 1 125 125 PHE C C 13 174.694 0.100 . 1 . . . . 125 PHE C . 15440 1 1499 . 1 1 125 125 PHE CA C 13 58.074 0.100 . 1 . . . . 125 PHE CA . 15440 1 1500 . 1 1 125 125 PHE CB C 13 38.551 0.100 . 1 . . . . 125 PHE CB . 15440 1 1501 . 1 1 125 125 PHE CD1 C 13 131.740 0.100 . 3 . . . . 125 PHE CD1 . 15440 1 1502 . 1 1 125 125 PHE CD2 C 13 131.740 0.100 . 3 . . . . 125 PHE CD2 . 15440 1 1503 . 1 1 125 125 PHE CZ C 13 127.990 0.100 . 1 . . . . 125 PHE CZ . 15440 1 1504 . 1 1 125 125 PHE N N 15 122.030 0.100 . 1 . . . . 125 PHE N . 15440 1 1505 . 1 1 126 126 SER H H 1 8.675 0.100 . 1 . . . . 126 SER H . 15440 1 1506 . 1 1 126 126 SER HA H 1 5.001 0.100 . 1 . . . . 126 SER HA . 15440 1 1507 . 1 1 126 126 SER HB2 H 1 3.793 0.100 . 1 . . . . 126 SER HB2 . 15440 1 1508 . 1 1 126 126 SER HB3 H 1 3.793 0.100 . 1 . . . . 126 SER HB3 . 15440 1 1509 . 1 1 126 126 SER C C 13 174.233 0.100 . 1 . . . . 126 SER C . 15440 1 1510 . 1 1 126 126 SER CA C 13 56.901 0.100 . 1 . . . . 126 SER CA . 15440 1 1511 . 1 1 126 126 SER CB C 13 65.366 0.100 . 1 . . . . 126 SER CB . 15440 1 1512 . 1 1 126 126 SER N N 15 118.548 0.300 . 1 . . . . 126 SER N . 15440 1 1513 . 1 1 127 127 LEU H H 1 8.748 0.100 . 1 . . . . 127 LEU H . 15440 1 1514 . 1 1 127 127 LEU HA H 1 4.219 0.100 . 1 . . . . 127 LEU HA . 15440 1 1515 . 1 1 127 127 LEU HB2 H 1 1.535 0.100 . 2 . . . . 127 LEU HB2 . 15440 1 1516 . 1 1 127 127 LEU HB3 H 1 1.417 0.100 . 2 . . . . 127 LEU HB3 . 15440 1 1517 . 1 1 127 127 LEU HD11 H 1 0.638 0.100 . 2 . . . . 127 LEU HD11 . 15440 1 1518 . 1 1 127 127 LEU HD12 H 1 0.638 0.100 . 2 . . . . 127 LEU HD12 . 15440 1 1519 . 1 1 127 127 LEU HD13 H 1 0.638 0.100 . 2 . . . . 127 LEU HD13 . 15440 1 1520 . 1 1 127 127 LEU HD21 H 1 0.475 0.100 . 2 . . . . 127 LEU HD21 . 15440 1 1521 . 1 1 127 127 LEU HD22 H 1 0.475 0.100 . 2 . . . . 127 LEU HD22 . 15440 1 1522 . 1 1 127 127 LEU HD23 H 1 0.475 0.100 . 2 . . . . 127 LEU HD23 . 15440 1 1523 . 1 1 127 127 LEU HG H 1 1.255 0.100 . 1 . . . . 127 LEU HG . 15440 1 1524 . 1 1 127 127 LEU C C 13 177.411 0.300 . 1 . . . . 127 LEU C . 15440 1 1525 . 1 1 127 127 LEU CA C 13 55.367 0.300 . 1 . . . . 127 LEU CA . 15440 1 1526 . 1 1 127 127 LEU CB C 13 42.187 0.300 . 1 . . . . 127 LEU CB . 15440 1 1527 . 1 1 127 127 LEU CD1 C 13 25.500 0.300 . 2 . . . . 127 LEU CD1 . 15440 1 1528 . 1 1 127 127 LEU CD2 C 13 23.608 0.300 . 2 . . . . 127 LEU CD2 . 15440 1 1529 . 1 1 127 127 LEU CG C 13 24.858 0.300 . 1 . . . . 127 LEU CG . 15440 1 1530 . 1 1 127 127 LEU N N 15 126.202 0.300 . 1 . . . . 127 LEU N . 15440 1 1531 . 1 1 128 128 ARG H H 1 8.290 0.100 . 1 . . . . 128 ARG H . 15440 1 1532 . 1 1 128 128 ARG HA H 1 4.255 0.100 . 1 . . . . 128 ARG HA . 15440 1 1533 . 1 1 128 128 ARG HB2 H 1 1.743 0.100 . 1 . . . . 128 ARG HB2 . 15440 1 1534 . 1 1 128 128 ARG HB3 H 1 1.743 0.100 . 1 . . . . 128 ARG HB3 . 15440 1 1535 . 1 1 128 128 ARG HD2 H 1 3.244 0.100 . 2 . . . . 128 ARG HD2 . 15440 1 1536 . 1 1 128 128 ARG HD3 H 1 3.132 0.100 . 2 . . . . 128 ARG HD3 . 15440 1 1537 . 1 1 128 128 ARG HG2 H 1 1.590 0.100 . 2 . . . . 128 ARG HG2 . 15440 1 1538 . 1 1 128 128 ARG HG3 H 1 1.545 0.100 . 2 . . . . 128 ARG HG3 . 15440 1 1539 . 1 1 128 128 ARG C C 13 177.294 0.300 . 1 . . . . 128 ARG C . 15440 1 1540 . 1 1 128 128 ARG CA C 13 56.809 0.300 . 1 . . . . 128 ARG CA . 15440 1 1541 . 1 1 128 128 ARG CB C 13 30.534 0.300 . 1 . . . . 128 ARG CB . 15440 1 1542 . 1 1 128 128 ARG CD C 13 43.309 0.300 . 1 . . . . 128 ARG CD . 15440 1 1543 . 1 1 128 128 ARG CG C 13 26.938 0.300 . 1 . . . . 128 ARG CG . 15440 1 1544 . 1 1 128 128 ARG N N 15 120.702 0.300 . 1 . . . . 128 ARG N . 15440 1 1545 . 1 1 129 129 GLY H H 1 8.362 0.100 . 1 . . . . 129 GLY H . 15440 1 1546 . 1 1 129 129 GLY HA2 H 1 3.908 0.100 . 2 . . . . 129 GLY HA2 . 15440 1 1547 . 1 1 129 129 GLY HA3 H 1 3.707 0.100 . 2 . . . . 129 GLY HA3 . 15440 1 1548 . 1 1 129 129 GLY C C 13 173.825 0.300 . 1 . . . . 129 GLY C . 15440 1 1549 . 1 1 129 129 GLY CA C 13 45.368 0.300 . 1 . . . . 129 GLY CA . 15440 1 1550 . 1 1 129 129 GLY N N 15 110.176 0.300 . 1 . . . . 129 GLY N . 15440 1 1551 . 1 1 130 130 ALA H H 1 8.072 0.100 . 1 . . . . 130 ALA H . 15440 1 1552 . 1 1 130 130 ALA HA H 1 4.282 0.100 . 1 . . . . 130 ALA HA . 15440 1 1553 . 1 1 130 130 ALA HB1 H 1 1.327 0.100 . 1 . . . . 130 ALA HB1 . 15440 1 1554 . 1 1 130 130 ALA HB2 H 1 1.327 0.100 . 1 . . . . 130 ALA HB2 . 15440 1 1555 . 1 1 130 130 ALA HB3 H 1 1.327 0.100 . 1 . . . . 130 ALA HB3 . 15440 1 1556 . 1 1 130 130 ALA C C 13 177.728 0.300 . 1 . . . . 130 ALA C . 15440 1 1557 . 1 1 130 130 ALA CA C 13 52.555 0.300 . 1 . . . . 130 ALA CA . 15440 1 1558 . 1 1 130 130 ALA CB C 13 19.404 0.300 . 1 . . . . 130 ALA CB . 15440 1 1559 . 1 1 130 130 ALA N N 15 123.204 0.300 . 1 . . . . 130 ALA N . 15440 1 1560 . 1 1 131 131 GLY H H 1 8.218 0.100 . 1 . . . . 131 GLY H . 15440 1 1561 . 1 1 131 131 GLY HA2 H 1 3.868 0.100 . 2 . . . . 131 GLY HA2 . 15440 1 1562 . 1 1 131 131 GLY HA3 H 1 3.705 0.100 . 2 . . . . 131 GLY HA3 . 15440 1 1563 . 1 1 131 131 GLY C C 13 173.026 0.300 . 1 . . . . 131 GLY C . 15440 1 1564 . 1 1 131 131 GLY CA C 13 45.246 0.300 . 1 . . . . 131 GLY CA . 15440 1 1565 . 1 1 131 131 GLY N N 15 107.778 0.300 . 1 . . . . 131 GLY N . 15440 1 1566 . 1 1 132 132 PHE H H 1 7.614 0.100 . 1 . . . . 132 PHE H . 15440 1 1567 . 1 1 132 132 PHE HA H 1 4.413 0.100 . 1 . . . . 132 PHE HA . 15440 1 1568 . 1 1 132 132 PHE HB2 H 1 3.138 0.100 . 2 . . . . 132 PHE HB2 . 15440 1 1569 . 1 1 132 132 PHE HB3 H 1 2.838 0.100 . 2 . . . . 132 PHE HB3 . 15440 1 1570 . 1 1 132 132 PHE HD1 H 1 7.142 0.100 . 3 . . . . 132 PHE HD1 . 15440 1 1571 . 1 1 132 132 PHE HD2 H 1 7.142 0.100 . 3 . . . . 132 PHE HD2 . 15440 1 1572 . 1 1 132 132 PHE HE1 H 1 6.750 0.100 . 3 . . . . 132 PHE HE1 . 15440 1 1573 . 1 1 132 132 PHE HE2 H 1 6.750 0.100 . 3 . . . . 132 PHE HE2 . 15440 1 1574 . 1 1 132 132 PHE CA C 13 58.961 0.300 . 1 . . . . 132 PHE CA . 15440 1 1575 . 1 1 132 132 PHE CB C 13 40.432 0.300 . 1 . . . . 132 PHE CB . 15440 1 1576 . 1 1 132 132 PHE N N 15 124.647 0.300 . 1 . . . . 132 PHE N . 15440 1 stop_ save_