data_10131 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 10131 _Entry.Title ; Solution Structure of the N-terminal Pleckstrin Homology Domain Of TAPP2 from Mouse ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2007-04-02 _Entry.Accession_date 2007-04-03 _Entry.Last_release_date 2008-09-02 _Entry.Original_release_date 2008-09-02 _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version production.3.0.2.8 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.Entry_ID 1 H. Li . . . 10131 2 F. Hayashi . . . 10131 3 S. Koshiba . . . 10131 4 M. Inoue . . . 10131 5 T. Kigawa . . . 10131 6 S. Yokoyama . . . 10131 stop_ loop_ _SG_project.SG_project_ID _SG_project.Project_name _SG_project.Full_name_of_center _SG_project.Initial_of_center _SG_project.Entry_ID 1 'Protein 3000 Project' 'Protein Research Group, RIKEN Genomic Sciences Center' 'RIKEN GSC' 10131 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 10131 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 537 10131 '15N chemical shifts' 135 10131 '1H chemical shifts' 847 10131 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 1 . . 2008-09-02 2007-04-02 original author . 10131 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 1V5P 'BMRB Entry Tracking System' 10131 stop_ save_ ############### # Citations # ############### save_citation_1 _Citation.Sf_category citations _Citation.Sf_framecode citation_1 _Citation.Entry_ID 10131 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID . _Citation.Full_citation . _Citation.Title ; Solution Structure of the N-terminal Pleckstrin Homology Domain Of TAPP2 from Mouse ; _Citation.Status 'in preparation' _Citation.Type journal _Citation.Journal_abbrev 'Not known' _Citation.Journal_name_full . _Citation.Journal_volume . _Citation.Journal_issue . _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first . _Citation.Page_last . _Citation.Year . _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.Entry_ID _Citation_author.Citation_ID 1 H. Li . . . 10131 1 2 F. Hayashi . . . 10131 1 3 S. Koshiba . . . 10131 1 4 M. Inoue . . . 10131 1 5 T. Kigawa . . . 10131 1 6 S. Yokoyama . . . 10131 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 10131 _Assembly.ID 1 _Assembly.Name 'pleckstrin homology domain-containing, family A' _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 'pleckstrin homology domain-containing, family A' 1 $entity_1 A . yes native no no . . . 10131 1 stop_ loop_ _Assembly_db_link.Author_supplied _Assembly_db_link.Database_code _Assembly_db_link.Accession_code _Assembly_db_link.Entry_mol_code _Assembly_db_link.Entry_mol_name _Assembly_db_link.Entry_experimental_method _Assembly_db_link.Entry_structure_resolution _Assembly_db_link.Entry_relation_type _Assembly_db_link.Entry_details _Assembly_db_link.Entry_ID _Assembly_db_link.Assembly_ID . PDB 1V5P . . 'solution NMR' . . . 10131 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 10131 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name 'Pleckstrin Homology domain' _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 ; GSSGSSGMPYVDRQNRICGF LDIEDNENSGKFLRRYFILD TQANCLLWYMDNPQNLAVGA GAVGSLQLTYISKVSIATPK QKPKTPFCFVINALSQRYFL QANDQKDLKDWVEALNQASK SGPSSG ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 126 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-11-26 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 no PDB 1V5P . "Solution Structure Of The N-Terminal Pleckstrin Homology Domain Of Tapp2 From Mouse" . . . . . 100.00 126 100.00 100.00 6.42e-87 . . . . 10131 1 2 no DBJ BAC37176 . "unnamed protein product [Mus musculus]" . . . . . 89.68 425 100.00 100.00 6.99e-75 . . . . 10131 1 3 no DBJ BAC40325 . "unnamed protein product [Mus musculus]" . . . . . 89.68 425 100.00 100.00 6.99e-75 . . . . 10131 1 4 no GB AAG15198 . "Tandem PH Domain Containing Protein-2 [Mus musculus]" . . . . . 89.68 425 100.00 100.00 6.99e-75 . . . . 10131 1 5 no GB AAH10215 . "Pleckstrin homology domain-containing, family A (phosphoinositide binding specific) member 2 [Mus musculus]" . . . . . 89.68 425 100.00 100.00 6.99e-75 . . . . 10131 1 6 no GB AAL57436 . "PH domain-containing adaptor PHAD47 [Mus musculus]" . . . . . 89.68 425 100.00 100.00 6.99e-75 . . . . 10131 1 7 no GB EDL32841 . "pleckstrin homology domain-containing, family A (phosphoinositide binding specific) member 2, isoform CRA_a, partial [Mus muscu" . . . . . 92.06 431 99.14 99.14 3.62e-76 . . . . 10131 1 8 no GB EDL32843 . "pleckstrin homology domain-containing, family A (phosphoinositide binding specific) member 2, isoform CRA_c [Mus musculus]" . . . . . 89.68 425 100.00 100.00 6.99e-75 . . . . 10131 1 9 no REF NP_112547 . "pleckstrin homology domain-containing family A member 2 [Mus musculus]" . . . . . 89.68 425 100.00 100.00 6.99e-75 . . . . 10131 1 10 no REF XP_001071937 . "PREDICTED: pleckstrin homology domain-containing family A member 2 [Rattus norvegicus]" . . . . . 89.68 426 100.00 100.00 7.90e-75 . . . . 10131 1 11 no REF XP_002720821 . "PREDICTED: pleckstrin homology domain-containing family A member 2 [Oryctolagus cuniculus]" . . . . . 89.68 425 97.35 100.00 1.79e-73 . . . . 10131 1 12 no REF XP_003412568 . "PREDICTED: pleckstrin homology domain-containing family A member 2 [Loxodonta africana]" . . . . . 89.68 425 98.23 100.00 6.40e-74 . . . . 10131 1 13 no REF XP_003751669 . "PREDICTED: pleckstrin homology domain-containing family A member 2 [Rattus norvegicus]" . . . . . 89.68 425 100.00 100.00 6.01e-75 . . . . 10131 1 14 no SP Q9ERS5 . "RecName: Full=Pleckstrin homology domain-containing family A member 2; Short=PH domain-containing family A member 2; AltName: F" . . . . . 89.68 425 100.00 100.00 6.99e-75 . . . . 10131 1 stop_ loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 . GLY . 10131 1 2 . SER . 10131 1 3 . SER . 10131 1 4 . GLY . 10131 1 5 . SER . 10131 1 6 . SER . 10131 1 7 . GLY . 10131 1 8 . MET . 10131 1 9 . PRO . 10131 1 10 . TYR . 10131 1 11 . VAL . 10131 1 12 . ASP . 10131 1 13 . ARG . 10131 1 14 . GLN . 10131 1 15 . ASN . 10131 1 16 . ARG . 10131 1 17 . ILE . 10131 1 18 . CYS . 10131 1 19 . GLY . 10131 1 20 . PHE . 10131 1 21 . LEU . 10131 1 22 . ASP . 10131 1 23 . ILE . 10131 1 24 . GLU . 10131 1 25 . ASP . 10131 1 26 . ASN . 10131 1 27 . GLU . 10131 1 28 . ASN . 10131 1 29 . SER . 10131 1 30 . GLY . 10131 1 31 . LYS . 10131 1 32 . PHE . 10131 1 33 . LEU . 10131 1 34 . ARG . 10131 1 35 . ARG . 10131 1 36 . TYR . 10131 1 37 . PHE . 10131 1 38 . ILE . 10131 1 39 . LEU . 10131 1 40 . ASP . 10131 1 41 . THR . 10131 1 42 . GLN . 10131 1 43 . ALA . 10131 1 44 . ASN . 10131 1 45 . CYS . 10131 1 46 . LEU . 10131 1 47 . LEU . 10131 1 48 . TRP . 10131 1 49 . TYR . 10131 1 50 . MET . 10131 1 51 . ASP . 10131 1 52 . ASN . 10131 1 53 . PRO . 10131 1 54 . GLN . 10131 1 55 . ASN . 10131 1 56 . LEU . 10131 1 57 . ALA . 10131 1 58 . VAL . 10131 1 59 . GLY . 10131 1 60 . ALA . 10131 1 61 . GLY . 10131 1 62 . ALA . 10131 1 63 . VAL . 10131 1 64 . GLY . 10131 1 65 . SER . 10131 1 66 . LEU . 10131 1 67 . GLN . 10131 1 68 . LEU . 10131 1 69 . THR . 10131 1 70 . TYR . 10131 1 71 . ILE . 10131 1 72 . SER . 10131 1 73 . LYS . 10131 1 74 . VAL . 10131 1 75 . SER . 10131 1 76 . ILE . 10131 1 77 . ALA . 10131 1 78 . THR . 10131 1 79 . PRO . 10131 1 80 . LYS . 10131 1 81 . GLN . 10131 1 82 . LYS . 10131 1 83 . PRO . 10131 1 84 . LYS . 10131 1 85 . THR . 10131 1 86 . PRO . 10131 1 87 . PHE . 10131 1 88 . CYS . 10131 1 89 . PHE . 10131 1 90 . VAL . 10131 1 91 . ILE . 10131 1 92 . ASN . 10131 1 93 . ALA . 10131 1 94 . LEU . 10131 1 95 . SER . 10131 1 96 . GLN . 10131 1 97 . ARG . 10131 1 98 . TYR . 10131 1 99 . PHE . 10131 1 100 . LEU . 10131 1 101 . GLN . 10131 1 102 . ALA . 10131 1 103 . ASN . 10131 1 104 . ASP . 10131 1 105 . GLN . 10131 1 106 . LYS . 10131 1 107 . ASP . 10131 1 108 . LEU . 10131 1 109 . LYS . 10131 1 110 . ASP . 10131 1 111 . TRP . 10131 1 112 . VAL . 10131 1 113 . GLU . 10131 1 114 . ALA . 10131 1 115 . LEU . 10131 1 116 . ASN . 10131 1 117 . GLN . 10131 1 118 . ALA . 10131 1 119 . SER . 10131 1 120 . LYS . 10131 1 121 . SER . 10131 1 122 . GLY . 10131 1 123 . PRO . 10131 1 124 . SER . 10131 1 125 . SER . 10131 1 126 . GLY . 10131 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . GLY 1 1 10131 1 . SER 2 2 10131 1 . SER 3 3 10131 1 . GLY 4 4 10131 1 . SER 5 5 10131 1 . SER 6 6 10131 1 . GLY 7 7 10131 1 . MET 8 8 10131 1 . PRO 9 9 10131 1 . TYR 10 10 10131 1 . VAL 11 11 10131 1 . ASP 12 12 10131 1 . ARG 13 13 10131 1 . GLN 14 14 10131 1 . ASN 15 15 10131 1 . ARG 16 16 10131 1 . ILE 17 17 10131 1 . CYS 18 18 10131 1 . GLY 19 19 10131 1 . PHE 20 20 10131 1 . LEU 21 21 10131 1 . ASP 22 22 10131 1 . ILE 23 23 10131 1 . GLU 24 24 10131 1 . ASP 25 25 10131 1 . ASN 26 26 10131 1 . GLU 27 27 10131 1 . ASN 28 28 10131 1 . SER 29 29 10131 1 . GLY 30 30 10131 1 . LYS 31 31 10131 1 . PHE 32 32 10131 1 . LEU 33 33 10131 1 . ARG 34 34 10131 1 . ARG 35 35 10131 1 . TYR 36 36 10131 1 . PHE 37 37 10131 1 . ILE 38 38 10131 1 . LEU 39 39 10131 1 . ASP 40 40 10131 1 . THR 41 41 10131 1 . GLN 42 42 10131 1 . ALA 43 43 10131 1 . ASN 44 44 10131 1 . CYS 45 45 10131 1 . LEU 46 46 10131 1 . LEU 47 47 10131 1 . TRP 48 48 10131 1 . TYR 49 49 10131 1 . MET 50 50 10131 1 . ASP 51 51 10131 1 . ASN 52 52 10131 1 . PRO 53 53 10131 1 . GLN 54 54 10131 1 . ASN 55 55 10131 1 . LEU 56 56 10131 1 . ALA 57 57 10131 1 . VAL 58 58 10131 1 . GLY 59 59 10131 1 . ALA 60 60 10131 1 . GLY 61 61 10131 1 . ALA 62 62 10131 1 . VAL 63 63 10131 1 . GLY 64 64 10131 1 . SER 65 65 10131 1 . LEU 66 66 10131 1 . GLN 67 67 10131 1 . LEU 68 68 10131 1 . THR 69 69 10131 1 . TYR 70 70 10131 1 . ILE 71 71 10131 1 . SER 72 72 10131 1 . LYS 73 73 10131 1 . VAL 74 74 10131 1 . SER 75 75 10131 1 . ILE 76 76 10131 1 . ALA 77 77 10131 1 . THR 78 78 10131 1 . PRO 79 79 10131 1 . LYS 80 80 10131 1 . GLN 81 81 10131 1 . LYS 82 82 10131 1 . PRO 83 83 10131 1 . LYS 84 84 10131 1 . THR 85 85 10131 1 . PRO 86 86 10131 1 . PHE 87 87 10131 1 . CYS 88 88 10131 1 . PHE 89 89 10131 1 . VAL 90 90 10131 1 . ILE 91 91 10131 1 . ASN 92 92 10131 1 . ALA 93 93 10131 1 . LEU 94 94 10131 1 . SER 95 95 10131 1 . GLN 96 96 10131 1 . ARG 97 97 10131 1 . TYR 98 98 10131 1 . PHE 99 99 10131 1 . LEU 100 100 10131 1 . GLN 101 101 10131 1 . ALA 102 102 10131 1 . ASN 103 103 10131 1 . ASP 104 104 10131 1 . GLN 105 105 10131 1 . LYS 106 106 10131 1 . ASP 107 107 10131 1 . LEU 108 108 10131 1 . LYS 109 109 10131 1 . ASP 110 110 10131 1 . TRP 111 111 10131 1 . VAL 112 112 10131 1 . GLU 113 113 10131 1 . ALA 114 114 10131 1 . LEU 115 115 10131 1 . ASN 116 116 10131 1 . GLN 117 117 10131 1 . ALA 118 118 10131 1 . SER 119 119 10131 1 . LYS 120 120 10131 1 . SER 121 121 10131 1 . GLY 122 122 10131 1 . PRO 123 123 10131 1 . SER 124 124 10131 1 . SER 125 125 10131 1 . GLY 126 126 10131 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 10131 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Subvariant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Cellular_location _Entity_natural_src.Fragment _Entity_natural_src.Fraction _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Plasmid_details _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Dev_stage _Entity_natural_src.Details _Entity_natural_src.Citation_ID _Entity_natural_src.Citation_label _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $entity_1 . 10090 . . . mouse . . Eukaryota Metazoa Mus musculus . . . . . . . . . . . . . . . . . . . . . 10131 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 10131 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_subvariant _Entity_experimental_src.Host_org_organ _Entity_experimental_src.Host_org_tissue _Entity_experimental_src.Host_org_tissue_fraction _Entity_experimental_src.Host_org_cell_line _Entity_experimental_src.Host_org_cell_type _Entity_experimental_src.Host_org_cellular_location _Entity_experimental_src.Host_org_organelle _Entity_experimental_src.Host_org_gene _Entity_experimental_src.Host_org_culture_collection _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Host_org_dev_stage _Entity_experimental_src.Details _Entity_experimental_src.Citation_ID _Entity_experimental_src.Citation_label _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $entity_1 . 'cell free synthesis' . . . . . . . . . . . . . . . . . . . plasmid . . P030212-66 . . . . . . 10131 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 10131 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 'Pleckstrin Homology domain' '[U-13C; U-15N]' . . 1 $entity_1 . . 1.08 . . mM . . . . 10131 1 2 PiNa . . . . . . . 20 . . mM . . . . 10131 1 3 NaCl . . . . . . salt 100 . . mM . . . . 10131 1 4 d-DTT . . . . . . salt 1 . . mM . . . . 10131 1 5 NaN3 . . . . . . . 0.02 . . % . . . . 10131 1 6 H2O . . . . . . solvent 90 . . % . . . . 10131 1 7 D2O . . . . . . solvent 10 . . % . . . . 10131 1 stop_ save_ ####################### # Sample conditions # ####################### save_condition_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode condition_1 _Sample_condition_list.Entry_ID 10131 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 120 0.1 mM 10131 1 pH 6.0 0.05 pH 10131 1 pressure 1 0.001 atm 10131 1 temperature 298 0.1 K 10131 1 stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID 10131 _Software.ID 1 _Software.Name VNMR _Software.Version 6.1c _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Varian . . 10131 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection 10131 1 stop_ save_ save_software_2 _Software.Sf_category software _Software.Sf_framecode software_2 _Software.Entry_ID 10131 _Software.ID 2 _Software.Name NMRPipe _Software.Version 20020425 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, F.' . . 10131 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 10131 2 stop_ save_ save_software_3 _Software.Sf_category software _Software.Sf_framecode software_3 _Software.Entry_ID 10131 _Software.ID 3 _Software.Name NMRView _Software.Version 5.0.4 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Johnson, B. A.' . . 10131 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 10131 3 stop_ save_ save_software_4 _Software.Sf_category software _Software.Sf_framecode software_4 _Software.Entry_ID 10131 _Software.ID 4 _Software.Name Kujira _Software.Version 0.854 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Kobayashi, N.' . . 10131 4 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 10131 4 stop_ save_ save_software_5 _Software.Sf_category software _Software.Sf_framecode software_5 _Software.Entry_ID 10131 _Software.ID 5 _Software.Name CYANA _Software.Version 1.0.7 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Guntert, P.' . . 10131 5 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID refinement 10131 5 'structure solution' 10131 5 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_1 _NMR_spectrometer.Entry_ID 10131 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model INOVA _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 900 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 10131 _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 . 900 . . . 10131 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 10131 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '3D 13C-separated NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $condition_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 10131 1 2 '3D 15N-separated NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $condition_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 10131 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode reference_1 _Chem_shift_reference.Entry_ID 10131 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details ; Chemical shift reference of 1H was based on the proton of water (4.784ppm at 298K) and then those of 15N and 13C were calculated based on their gyromagnetic ratios. ; loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.0 . indirect 0.251449530 . . . . . . . . . 10131 1 H 1 DSS 'methyl protons' . . . . ppm 0.0 . indirect 1.0 . . . . . . . . . 10131 1 N 15 DSS 'methyl protons' . . . . ppm 0.0 . indirect 0.101329118 . . . . . . . . . 10131 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_chemical_shift_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode chemical_shift_1 _Assigned_chem_shift_list.Entry_ID 10131 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $condition_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '3D 13C-separated NOESY' 1 $sample_1 isotropic 10131 1 2 '3D 15N-separated NOESY' 1 $sample_1 isotropic 10131 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 6 6 SER HA H 1 4.469 0.030 . 1 . . . . 6 SER HA . 10131 1 2 . 1 1 6 6 SER HB2 H 1 3.641 0.030 . 2 . . . . 6 SER HB2 . 10131 1 3 . 1 1 6 6 SER HB3 H 1 3.799 0.030 . 2 . . . . 6 SER HB3 . 10131 1 4 . 1 1 6 6 SER C C 13 175.027 0.300 . 1 . . . . 6 SER C . 10131 1 5 . 1 1 6 6 SER CA C 13 58.697 0.300 . 1 . . . . 6 SER CA . 10131 1 6 . 1 1 6 6 SER CB C 13 63.779 0.300 . 1 . . . . 6 SER CB . 10131 1 7 . 1 1 7 7 GLY H H 1 8.400 0.030 . 1 . . . . 7 GLY H . 10131 1 8 . 1 1 7 7 GLY HA2 H 1 3.960 0.030 . 1 . . . . 7 GLY HA2 . 10131 1 9 . 1 1 7 7 GLY HA3 H 1 3.960 0.030 . 1 . . . . 7 GLY HA3 . 10131 1 10 . 1 1 7 7 GLY C C 13 173.797 0.300 . 1 . . . . 7 GLY C . 10131 1 11 . 1 1 7 7 GLY CA C 13 45.236 0.300 . 1 . . . . 7 GLY CA . 10131 1 12 . 1 1 7 7 GLY N N 15 110.545 0.300 . 1 . . . . 7 GLY N . 10131 1 13 . 1 1 8 8 MET H H 1 8.107 0.030 . 1 . . . . 8 MET H . 10131 1 14 . 1 1 8 8 MET HA H 1 4.816 0.030 . 1 . . . . 8 MET HA . 10131 1 15 . 1 1 8 8 MET HB2 H 1 1.990 0.030 . 1 . . . . 8 MET HB2 . 10131 1 16 . 1 1 8 8 MET HB3 H 1 1.990 0.030 . 1 . . . . 8 MET HB3 . 10131 1 17 . 1 1 8 8 MET HG2 H 1 2.534 0.030 . 2 . . . . 8 MET HG2 . 10131 1 18 . 1 1 8 8 MET HG3 H 1 2.606 0.030 . 2 . . . . 8 MET HG3 . 10131 1 19 . 1 1 8 8 MET HE1 H 1 2.101 0.030 . 1 . . . . 8 MET HE . 10131 1 20 . 1 1 8 8 MET HE2 H 1 2.101 0.030 . 1 . . . . 8 MET HE . 10131 1 21 . 1 1 8 8 MET HE3 H 1 2.101 0.030 . 1 . . . . 8 MET HE . 10131 1 22 . 1 1 8 8 MET C C 13 174.305 0.300 . 1 . . . . 8 MET C . 10131 1 23 . 1 1 8 8 MET CA C 13 53.211 0.300 . 1 . . . . 8 MET CA . 10131 1 24 . 1 1 8 8 MET CB C 13 32.564 0.300 . 1 . . . . 8 MET CB . 10131 1 25 . 1 1 8 8 MET CE C 13 17.128 0.300 . 1 . . . . 8 MET CE . 10131 1 26 . 1 1 8 8 MET N N 15 120.825 0.300 . 1 . . . . 8 MET N . 10131 1 27 . 1 1 9 9 PRO HA H 1 4.422 0.030 . 1 . . . . 9 PRO HA . 10131 1 28 . 1 1 9 9 PRO HB2 H 1 2.189 0.030 . 2 . . . . 9 PRO HB2 . 10131 1 29 . 1 1 9 9 PRO HB3 H 1 1.759 0.030 . 2 . . . . 9 PRO HB3 . 10131 1 30 . 1 1 9 9 PRO HG2 H 1 1.933 0.030 . 2 . . . . 9 PRO HG2 . 10131 1 31 . 1 1 9 9 PRO HG3 H 1 1.874 0.030 . 2 . . . . 9 PRO HG3 . 10131 1 32 . 1 1 9 9 PRO HD2 H 1 3.409 0.030 . 2 . . . . 9 PRO HD2 . 10131 1 33 . 1 1 9 9 PRO HD3 H 1 3.548 0.030 . 2 . . . . 9 PRO HD3 . 10131 1 34 . 1 1 9 9 PRO C C 13 176.338 0.300 . 1 . . . . 9 PRO C . 10131 1 35 . 1 1 9 9 PRO CA C 13 63.241 0.300 . 1 . . . . 9 PRO CA . 10131 1 36 . 1 1 9 9 PRO CB C 13 32.142 0.300 . 1 . . . . 9 PRO CB . 10131 1 37 . 1 1 9 9 PRO CG C 13 27.356 0.300 . 1 . . . . 9 PRO CG . 10131 1 38 . 1 1 9 9 PRO CD C 13 50.580 0.300 . 1 . . . . 9 PRO CD . 10131 1 39 . 1 1 10 10 TYR H H 1 8.235 0.030 . 1 . . . . 10 TYR H . 10131 1 40 . 1 1 10 10 TYR HA H 1 4.500 0.030 . 1 . . . . 10 TYR HA . 10131 1 41 . 1 1 10 10 TYR HB2 H 1 3.003 0.030 . 2 . . . . 10 TYR HB2 . 10131 1 42 . 1 1 10 10 TYR HB3 H 1 2.964 0.030 . 2 . . . . 10 TYR HB3 . 10131 1 43 . 1 1 10 10 TYR HD1 H 1 7.082 0.030 . 1 . . . . 10 TYR HD1 . 10131 1 44 . 1 1 10 10 TYR HD2 H 1 7.082 0.030 . 1 . . . . 10 TYR HD2 . 10131 1 45 . 1 1 10 10 TYR HE1 H 1 6.813 0.030 . 1 . . . . 10 TYR HE1 . 10131 1 46 . 1 1 10 10 TYR HE2 H 1 6.813 0.030 . 1 . . . . 10 TYR HE2 . 10131 1 47 . 1 1 10 10 TYR C C 13 175.412 0.300 . 1 . . . . 10 TYR C . 10131 1 48 . 1 1 10 10 TYR CA C 13 58.113 0.300 . 1 . . . . 10 TYR CA . 10131 1 49 . 1 1 10 10 TYR CB C 13 38.840 0.300 . 1 . . . . 10 TYR CB . 10131 1 50 . 1 1 10 10 TYR CD1 C 13 133.104 0.300 . 1 . . . . 10 TYR CD1 . 10131 1 51 . 1 1 10 10 TYR CD2 C 13 133.104 0.300 . 1 . . . . 10 TYR CD2 . 10131 1 52 . 1 1 10 10 TYR CE1 C 13 118.275 0.300 . 1 . . . . 10 TYR CE1 . 10131 1 53 . 1 1 10 10 TYR CE2 C 13 118.275 0.300 . 1 . . . . 10 TYR CE2 . 10131 1 54 . 1 1 10 10 TYR N N 15 120.628 0.300 . 1 . . . . 10 TYR N . 10131 1 55 . 1 1 11 11 VAL H H 1 7.765 0.030 . 1 . . . . 11 VAL H . 10131 1 56 . 1 1 11 11 VAL HA H 1 4.071 0.030 . 1 . . . . 11 VAL HA . 10131 1 57 . 1 1 11 11 VAL HB H 1 1.907 0.030 . 1 . . . . 11 VAL HB . 10131 1 58 . 1 1 11 11 VAL HG11 H 1 0.840 0.030 . 1 . . . . 11 VAL HG1 . 10131 1 59 . 1 1 11 11 VAL HG12 H 1 0.840 0.030 . 1 . . . . 11 VAL HG1 . 10131 1 60 . 1 1 11 11 VAL HG13 H 1 0.840 0.030 . 1 . . . . 11 VAL HG1 . 10131 1 61 . 1 1 11 11 VAL HG21 H 1 0.827 0.030 . 1 . . . . 11 VAL HG2 . 10131 1 62 . 1 1 11 11 VAL HG22 H 1 0.827 0.030 . 1 . . . . 11 VAL HG2 . 10131 1 63 . 1 1 11 11 VAL HG23 H 1 0.827 0.030 . 1 . . . . 11 VAL HG2 . 10131 1 64 . 1 1 11 11 VAL C C 13 175.101 0.300 . 1 . . . . 11 VAL C . 10131 1 65 . 1 1 11 11 VAL CA C 13 61.706 0.300 . 1 . . . . 11 VAL CA . 10131 1 66 . 1 1 11 11 VAL CB C 13 33.351 0.300 . 1 . . . . 11 VAL CB . 10131 1 67 . 1 1 11 11 VAL CG1 C 13 20.447 0.300 . 2 . . . . 11 VAL CG1 . 10131 1 68 . 1 1 11 11 VAL CG2 C 13 21.072 0.300 . 2 . . . . 11 VAL CG2 . 10131 1 69 . 1 1 11 11 VAL N N 15 122.712 0.300 . 1 . . . . 11 VAL N . 10131 1 70 . 1 1 12 12 ASP H H 1 8.287 0.030 . 1 . . . . 12 ASP H . 10131 1 71 . 1 1 12 12 ASP HA H 1 4.507 0.030 . 1 . . . . 12 ASP HA . 10131 1 72 . 1 1 12 12 ASP HB2 H 1 2.753 0.030 . 2 . . . . 12 ASP HB2 . 10131 1 73 . 1 1 12 12 ASP HB3 H 1 2.691 0.030 . 2 . . . . 12 ASP HB3 . 10131 1 74 . 1 1 12 12 ASP C C 13 176.494 0.300 . 1 . . . . 12 ASP C . 10131 1 75 . 1 1 12 12 ASP CA C 13 54.167 0.300 . 1 . . . . 12 ASP CA . 10131 1 76 . 1 1 12 12 ASP CB C 13 41.537 0.300 . 1 . . . . 12 ASP CB . 10131 1 77 . 1 1 12 12 ASP N N 15 124.170 0.300 . 1 . . . . 12 ASP N . 10131 1 78 . 1 1 13 13 ARG H H 1 8.211 0.030 . 1 . . . . 13 ARG H . 10131 1 79 . 1 1 13 13 ARG HA H 1 4.267 0.030 . 1 . . . . 13 ARG HA . 10131 1 80 . 1 1 13 13 ARG HB2 H 1 1.748 0.030 . 2 . . . . 13 ARG HB2 . 10131 1 81 . 1 1 13 13 ARG HB3 H 1 1.856 0.030 . 2 . . . . 13 ARG HB3 . 10131 1 82 . 1 1 13 13 ARG HG2 H 1 1.622 0.030 . 1 . . . . 13 ARG HG2 . 10131 1 83 . 1 1 13 13 ARG HG3 H 1 1.622 0.030 . 1 . . . . 13 ARG HG3 . 10131 1 84 . 1 1 13 13 ARG HD2 H 1 3.172 0.030 . 1 . . . . 13 ARG HD2 . 10131 1 85 . 1 1 13 13 ARG HD3 H 1 3.172 0.030 . 1 . . . . 13 ARG HD3 . 10131 1 86 . 1 1 13 13 ARG C C 13 176.305 0.300 . 1 . . . . 13 ARG C . 10131 1 87 . 1 1 13 13 ARG CA C 13 56.523 0.300 . 1 . . . . 13 ARG CA . 10131 1 88 . 1 1 13 13 ARG CB C 13 30.701 0.300 . 1 . . . . 13 ARG CB . 10131 1 89 . 1 1 13 13 ARG CG C 13 27.217 0.300 . 1 . . . . 13 ARG CG . 10131 1 90 . 1 1 13 13 ARG CD C 13 43.461 0.300 . 1 . . . . 13 ARG CD . 10131 1 91 . 1 1 13 13 ARG N N 15 121.438 0.300 . 1 . . . . 13 ARG N . 10131 1 92 . 1 1 14 14 GLN H H 1 8.370 0.030 . 1 . . . . 14 GLN H . 10131 1 93 . 1 1 14 14 GLN HA H 1 4.290 0.030 . 1 . . . . 14 GLN HA . 10131 1 94 . 1 1 14 14 GLN HB2 H 1 2.110 0.030 . 2 . . . . 14 GLN HB2 . 10131 1 95 . 1 1 14 14 GLN HB3 H 1 1.970 0.030 . 2 . . . . 14 GLN HB3 . 10131 1 96 . 1 1 14 14 GLN HG2 H 1 2.310 0.030 . 1 . . . . 14 GLN HG2 . 10131 1 97 . 1 1 14 14 GLN HG3 H 1 2.310 0.030 . 1 . . . . 14 GLN HG3 . 10131 1 98 . 1 1 14 14 GLN HE21 H 1 6.828 0.030 . 2 . . . . 14 GLN HE21 . 10131 1 99 . 1 1 14 14 GLN HE22 H 1 7.580 0.030 . 2 . . . . 14 GLN HE22 . 10131 1 100 . 1 1 14 14 GLN C C 13 175.534 0.300 . 1 . . . . 14 GLN C . 10131 1 101 . 1 1 14 14 GLN CA C 13 55.800 0.300 . 1 . . . . 14 GLN CA . 10131 1 102 . 1 1 14 14 GLN CB C 13 29.355 0.300 . 1 . . . . 14 GLN CB . 10131 1 103 . 1 1 14 14 GLN CG C 13 34.089 0.300 . 1 . . . . 14 GLN CG . 10131 1 104 . 1 1 14 14 GLN N N 15 120.086 0.300 . 1 . . . . 14 GLN N . 10131 1 105 . 1 1 14 14 GLN NE2 N 15 112.360 0.300 . 1 . . . . 14 GLN NE2 . 10131 1 106 . 1 1 15 15 ASN H H 1 8.340 0.030 . 1 . . . . 15 ASN H . 10131 1 107 . 1 1 15 15 ASN HA H 1 4.697 0.030 . 1 . . . . 15 ASN HA . 10131 1 108 . 1 1 15 15 ASN HB2 H 1 2.707 0.030 . 2 . . . . 15 ASN HB2 . 10131 1 109 . 1 1 15 15 ASN HB3 H 1 2.812 0.030 . 2 . . . . 15 ASN HB3 . 10131 1 110 . 1 1 15 15 ASN HD21 H 1 7.568 0.030 . 2 . . . . 15 ASN HD21 . 10131 1 111 . 1 1 15 15 ASN HD22 H 1 6.837 0.030 . 2 . . . . 15 ASN HD22 . 10131 1 112 . 1 1 15 15 ASN C C 13 174.486 0.300 . 1 . . . . 15 ASN C . 10131 1 113 . 1 1 15 15 ASN CA C 13 53.416 0.300 . 1 . . . . 15 ASN CA . 10131 1 114 . 1 1 15 15 ASN CB C 13 39.053 0.300 . 1 . . . . 15 ASN CB . 10131 1 115 . 1 1 15 15 ASN N N 15 118.602 0.300 . 1 . . . . 15 ASN N . 10131 1 116 . 1 1 15 15 ASN ND2 N 15 112.647 0.300 . 1 . . . . 15 ASN ND2 . 10131 1 117 . 1 1 16 16 ARG H H 1 8.150 0.030 . 1 . . . . 16 ARG H . 10131 1 118 . 1 1 16 16 ARG HA H 1 4.560 0.030 . 1 . . . . 16 ARG HA . 10131 1 119 . 1 1 16 16 ARG HB2 H 1 1.805 0.030 . 1 . . . . 16 ARG HB2 . 10131 1 120 . 1 1 16 16 ARG HB3 H 1 1.805 0.030 . 1 . . . . 16 ARG HB3 . 10131 1 121 . 1 1 16 16 ARG HG2 H 1 1.636 0.030 . 1 . . . . 16 ARG HG2 . 10131 1 122 . 1 1 16 16 ARG HG3 H 1 1.636 0.030 . 1 . . . . 16 ARG HG3 . 10131 1 123 . 1 1 16 16 ARG HD2 H 1 3.211 0.030 . 2 . . . . 16 ARG HD2 . 10131 1 124 . 1 1 16 16 ARG HD3 H 1 3.130 0.030 . 2 . . . . 16 ARG HD3 . 10131 1 125 . 1 1 16 16 ARG HE H 1 7.450 0.030 . 1 . . . . 16 ARG HE . 10131 1 126 . 1 1 16 16 ARG C C 13 175.494 0.300 . 1 . . . . 16 ARG C . 10131 1 127 . 1 1 16 16 ARG CA C 13 56.140 0.300 . 1 . . . . 16 ARG CA . 10131 1 128 . 1 1 16 16 ARG CB C 13 31.226 0.300 . 1 . . . . 16 ARG CB . 10131 1 129 . 1 1 16 16 ARG CG C 13 27.217 0.300 . 1 . . . . 16 ARG CG . 10131 1 130 . 1 1 16 16 ARG CD C 13 43.430 0.300 . 1 . . . . 16 ARG CD . 10131 1 131 . 1 1 16 16 ARG N N 15 121.286 0.300 . 1 . . . . 16 ARG N . 10131 1 132 . 1 1 16 16 ARG NE N 15 84.670 0.300 . 1 . . . . 16 ARG NE . 10131 1 133 . 1 1 17 17 ILE H H 1 8.100 0.030 . 1 . . . . 17 ILE H . 10131 1 134 . 1 1 17 17 ILE HA H 1 4.110 0.030 . 1 . . . . 17 ILE HA . 10131 1 135 . 1 1 17 17 ILE HB H 1 1.470 0.030 . 1 . . . . 17 ILE HB . 10131 1 136 . 1 1 17 17 ILE HG12 H 1 0.450 0.030 . 2 . . . . 17 ILE HG12 . 10131 1 137 . 1 1 17 17 ILE HG13 H 1 1.044 0.030 . 2 . . . . 17 ILE HG13 . 10131 1 138 . 1 1 17 17 ILE HG21 H 1 -0.179 0.030 . 1 . . . . 17 ILE HG2 . 10131 1 139 . 1 1 17 17 ILE HG22 H 1 -0.179 0.030 . 1 . . . . 17 ILE HG2 . 10131 1 140 . 1 1 17 17 ILE HG23 H 1 -0.179 0.030 . 1 . . . . 17 ILE HG2 . 10131 1 141 . 1 1 17 17 ILE HD11 H 1 0.122 0.030 . 1 . . . . 17 ILE HD1 . 10131 1 142 . 1 1 17 17 ILE HD12 H 1 0.122 0.030 . 1 . . . . 17 ILE HD1 . 10131 1 143 . 1 1 17 17 ILE HD13 H 1 0.122 0.030 . 1 . . . . 17 ILE HD1 . 10131 1 144 . 1 1 17 17 ILE C C 13 172.757 0.300 . 1 . . . . 17 ILE C . 10131 1 145 . 1 1 17 17 ILE CA C 13 60.660 0.300 . 1 . . . . 17 ILE CA . 10131 1 146 . 1 1 17 17 ILE CB C 13 37.824 0.300 . 1 . . . . 17 ILE CB . 10131 1 147 . 1 1 17 17 ILE CG1 C 13 27.564 0.300 . 1 . . . . 17 ILE CG1 . 10131 1 148 . 1 1 17 17 ILE CG2 C 13 15.424 0.300 . 1 . . . . 17 ILE CG2 . 10131 1 149 . 1 1 17 17 ILE CD1 C 13 12.386 0.300 . 1 . . . . 17 ILE CD1 . 10131 1 150 . 1 1 17 17 ILE N N 15 123.161 0.300 . 1 . . . . 17 ILE N . 10131 1 151 . 1 1 18 18 CYS H H 1 7.714 0.030 . 1 . . . . 18 CYS H . 10131 1 152 . 1 1 18 18 CYS HA H 1 5.754 0.030 . 1 . . . . 18 CYS HA . 10131 1 153 . 1 1 18 18 CYS HB2 H 1 3.218 0.030 . 2 . . . . 18 CYS HB2 . 10131 1 154 . 1 1 18 18 CYS HB3 H 1 2.919 0.030 . 2 . . . . 18 CYS HB3 . 10131 1 155 . 1 1 18 18 CYS C C 13 173.822 0.300 . 1 . . . . 18 CYS C . 10131 1 156 . 1 1 18 18 CYS CA C 13 54.859 0.300 . 1 . . . . 18 CYS CA . 10131 1 157 . 1 1 18 18 CYS CB C 13 31.827 0.300 . 1 . . . . 18 CYS CB . 10131 1 158 . 1 1 18 18 CYS N N 15 119.258 0.300 . 1 . . . . 18 CYS N . 10131 1 159 . 1 1 19 19 GLY H H 1 8.470 0.030 . 1 . . . . 19 GLY H . 10131 1 160 . 1 1 19 19 GLY HA2 H 1 3.668 0.030 . 2 . . . . 19 GLY HA2 . 10131 1 161 . 1 1 19 19 GLY HA3 H 1 4.816 0.030 . 2 . . . . 19 GLY HA3 . 10131 1 162 . 1 1 19 19 GLY C C 13 171.928 0.300 . 1 . . . . 19 GLY C . 10131 1 163 . 1 1 19 19 GLY CA C 13 45.038 0.300 . 1 . . . . 19 GLY CA . 10131 1 164 . 1 1 19 19 GLY N N 15 107.148 0.300 . 1 . . . . 19 GLY N . 10131 1 165 . 1 1 20 20 PHE H H 1 8.870 0.030 . 1 . . . . 20 PHE H . 10131 1 166 . 1 1 20 20 PHE HA H 1 5.470 0.030 . 1 . . . . 20 PHE HA . 10131 1 167 . 1 1 20 20 PHE HB2 H 1 3.064 0.030 . 2 . . . . 20 PHE HB2 . 10131 1 168 . 1 1 20 20 PHE HB3 H 1 3.002 0.030 . 2 . . . . 20 PHE HB3 . 10131 1 169 . 1 1 20 20 PHE HD1 H 1 7.434 0.030 . 1 . . . . 20 PHE HD1 . 10131 1 170 . 1 1 20 20 PHE HD2 H 1 7.434 0.030 . 1 . . . . 20 PHE HD2 . 10131 1 171 . 1 1 20 20 PHE HE1 H 1 7.595 0.030 . 1 . . . . 20 PHE HE1 . 10131 1 172 . 1 1 20 20 PHE HE2 H 1 7.595 0.030 . 1 . . . . 20 PHE HE2 . 10131 1 173 . 1 1 20 20 PHE HZ H 1 7.711 0.030 . 1 . . . . 20 PHE HZ . 10131 1 174 . 1 1 20 20 PHE C C 13 177.018 0.300 . 1 . . . . 20 PHE C . 10131 1 175 . 1 1 20 20 PHE CA C 13 59.424 0.300 . 1 . . . . 20 PHE CA . 10131 1 176 . 1 1 20 20 PHE CB C 13 40.797 0.300 . 1 . . . . 20 PHE CB . 10131 1 177 . 1 1 20 20 PHE CD1 C 13 132.688 0.300 . 1 . . . . 20 PHE CD1 . 10131 1 178 . 1 1 20 20 PHE CD2 C 13 132.688 0.300 . 1 . . . . 20 PHE CD2 . 10131 1 179 . 1 1 20 20 PHE CE1 C 13 131.854 0.300 . 1 . . . . 20 PHE CE1 . 10131 1 180 . 1 1 20 20 PHE CE2 C 13 131.854 0.300 . 1 . . . . 20 PHE CE2 . 10131 1 181 . 1 1 20 20 PHE CZ C 13 130.658 0.300 . 1 . . . . 20 PHE CZ . 10131 1 182 . 1 1 20 20 PHE N N 15 117.970 0.300 . 1 . . . . 20 PHE N . 10131 1 183 . 1 1 21 21 LEU H H 1 9.311 0.030 . 1 . . . . 21 LEU H . 10131 1 184 . 1 1 21 21 LEU HA H 1 4.543 0.030 . 1 . . . . 21 LEU HA . 10131 1 185 . 1 1 21 21 LEU HB2 H 1 1.066 0.030 . 2 . . . . 21 LEU HB2 . 10131 1 186 . 1 1 21 21 LEU HB3 H 1 0.555 0.030 . 2 . . . . 21 LEU HB3 . 10131 1 187 . 1 1 21 21 LEU HG H 1 0.770 0.030 . 1 . . . . 21 LEU HG . 10131 1 188 . 1 1 21 21 LEU HD11 H 1 -1.336 0.030 . 1 . . . . 21 LEU HD1 . 10131 1 189 . 1 1 21 21 LEU HD12 H 1 -1.336 0.030 . 1 . . . . 21 LEU HD1 . 10131 1 190 . 1 1 21 21 LEU HD13 H 1 -1.336 0.030 . 1 . . . . 21 LEU HD1 . 10131 1 191 . 1 1 21 21 LEU HD21 H 1 0.579 0.030 . 1 . . . . 21 LEU HD2 . 10131 1 192 . 1 1 21 21 LEU HD22 H 1 0.579 0.030 . 1 . . . . 21 LEU HD2 . 10131 1 193 . 1 1 21 21 LEU HD23 H 1 0.579 0.030 . 1 . . . . 21 LEU HD2 . 10131 1 194 . 1 1 21 21 LEU C C 13 174.830 0.300 . 1 . . . . 21 LEU C . 10131 1 195 . 1 1 21 21 LEU CA C 13 54.373 0.300 . 1 . . . . 21 LEU CA . 10131 1 196 . 1 1 21 21 LEU CB C 13 47.212 0.300 . 1 . . . . 21 LEU CB . 10131 1 197 . 1 1 21 21 LEU CG C 13 26.223 0.300 . 1 . . . . 21 LEU CG . 10131 1 198 . 1 1 21 21 LEU CD1 C 13 23.356 0.300 . 2 . . . . 21 LEU CD1 . 10131 1 199 . 1 1 21 21 LEU CD2 C 13 24.627 0.300 . 2 . . . . 21 LEU CD2 . 10131 1 200 . 1 1 21 21 LEU N N 15 121.886 0.300 . 1 . . . . 21 LEU N . 10131 1 201 . 1 1 22 22 ASP H H 1 7.826 0.030 . 1 . . . . 22 ASP H . 10131 1 202 . 1 1 22 22 ASP HA H 1 5.922 0.030 . 1 . . . . 22 ASP HA . 10131 1 203 . 1 1 22 22 ASP HB2 H 1 2.485 0.030 . 2 . . . . 22 ASP HB2 . 10131 1 204 . 1 1 22 22 ASP HB3 H 1 2.395 0.030 . 2 . . . . 22 ASP HB3 . 10131 1 205 . 1 1 22 22 ASP C C 13 174.936 0.300 . 1 . . . . 22 ASP C . 10131 1 206 . 1 1 22 22 ASP CA C 13 52.327 0.300 . 1 . . . . 22 ASP CA . 10131 1 207 . 1 1 22 22 ASP CB C 13 42.693 0.300 . 1 . . . . 22 ASP CB . 10131 1 208 . 1 1 22 22 ASP N N 15 118.711 0.300 . 1 . . . . 22 ASP N . 10131 1 209 . 1 1 23 23 ILE H H 1 9.688 0.030 . 1 . . . . 23 ILE H . 10131 1 210 . 1 1 23 23 ILE HA H 1 5.170 0.030 . 1 . . . . 23 ILE HA . 10131 1 211 . 1 1 23 23 ILE HB H 1 1.375 0.030 . 1 . . . . 23 ILE HB . 10131 1 212 . 1 1 23 23 ILE HG12 H 1 1.116 0.030 . 2 . . . . 23 ILE HG12 . 10131 1 213 . 1 1 23 23 ILE HG13 H 1 1.479 0.030 . 2 . . . . 23 ILE HG13 . 10131 1 214 . 1 1 23 23 ILE HG21 H 1 0.888 0.030 . 1 . . . . 23 ILE HG2 . 10131 1 215 . 1 1 23 23 ILE HG22 H 1 0.888 0.030 . 1 . . . . 23 ILE HG2 . 10131 1 216 . 1 1 23 23 ILE HG23 H 1 0.888 0.030 . 1 . . . . 23 ILE HG2 . 10131 1 217 . 1 1 23 23 ILE HD11 H 1 0.288 0.030 . 1 . . . . 23 ILE HD1 . 10131 1 218 . 1 1 23 23 ILE HD12 H 1 0.288 0.030 . 1 . . . . 23 ILE HD1 . 10131 1 219 . 1 1 23 23 ILE HD13 H 1 0.288 0.030 . 1 . . . . 23 ILE HD1 . 10131 1 220 . 1 1 23 23 ILE C C 13 174.010 0.300 . 1 . . . . 23 ILE C . 10131 1 221 . 1 1 23 23 ILE CA C 13 58.169 0.300 . 1 . . . . 23 ILE CA . 10131 1 222 . 1 1 23 23 ILE CB C 13 41.873 0.300 . 1 . . . . 23 ILE CB . 10131 1 223 . 1 1 23 23 ILE CG1 C 13 28.813 0.300 . 1 . . . . 23 ILE CG1 . 10131 1 224 . 1 1 23 23 ILE CG2 C 13 14.027 0.300 . 1 . . . . 23 ILE CG2 . 10131 1 225 . 1 1 23 23 ILE CD1 C 13 13.266 0.300 . 1 . . . . 23 ILE CD1 . 10131 1 226 . 1 1 23 23 ILE N N 15 122.103 0.300 . 1 . . . . 23 ILE N . 10131 1 227 . 1 1 24 24 GLU H H 1 8.608 0.030 . 1 . . . . 24 GLU H . 10131 1 228 . 1 1 24 24 GLU HA H 1 3.604 0.030 . 1 . . . . 24 GLU HA . 10131 1 229 . 1 1 24 24 GLU HB2 H 1 1.950 0.030 . 2 . . . . 24 GLU HB2 . 10131 1 230 . 1 1 24 24 GLU HB3 H 1 1.072 0.030 . 2 . . . . 24 GLU HB3 . 10131 1 231 . 1 1 24 24 GLU HG2 H 1 1.235 0.030 . 2 . . . . 24 GLU HG2 . 10131 1 232 . 1 1 24 24 GLU HG3 H 1 1.981 0.030 . 2 . . . . 24 GLU HG3 . 10131 1 233 . 1 1 24 24 GLU C C 13 176.420 0.300 . 1 . . . . 24 GLU C . 10131 1 234 . 1 1 24 24 GLU CA C 13 56.758 0.300 . 1 . . . . 24 GLU CA . 10131 1 235 . 1 1 24 24 GLU CB C 13 29.997 0.300 . 1 . . . . 24 GLU CB . 10131 1 236 . 1 1 24 24 GLU CG C 13 36.588 0.300 . 1 . . . . 24 GLU CG . 10131 1 237 . 1 1 24 24 GLU N N 15 130.868 0.300 . 1 . . . . 24 GLU N . 10131 1 238 . 1 1 25 25 ASP H H 1 8.620 0.030 . 1 . . . . 25 ASP H . 10131 1 239 . 1 1 25 25 ASP HA H 1 4.390 0.030 . 1 . . . . 25 ASP HA . 10131 1 240 . 1 1 25 25 ASP HB2 H 1 2.957 0.030 . 2 . . . . 25 ASP HB2 . 10131 1 241 . 1 1 25 25 ASP HB3 H 1 2.518 0.030 . 2 . . . . 25 ASP HB3 . 10131 1 242 . 1 1 25 25 ASP C C 13 176.657 0.300 . 1 . . . . 25 ASP C . 10131 1 243 . 1 1 25 25 ASP CA C 13 54.338 0.300 . 1 . . . . 25 ASP CA . 10131 1 244 . 1 1 25 25 ASP CB C 13 41.616 0.300 . 1 . . . . 25 ASP CB . 10131 1 245 . 1 1 25 25 ASP N N 15 126.959 0.300 . 1 . . . . 25 ASP N . 10131 1 246 . 1 1 26 26 ASN H H 1 8.378 0.030 . 1 . . . . 26 ASN H . 10131 1 247 . 1 1 26 26 ASN HA H 1 4.519 0.030 . 1 . . . . 26 ASN HA . 10131 1 248 . 1 1 26 26 ASN HB2 H 1 2.855 0.030 . 1 . . . . 26 ASN HB2 . 10131 1 249 . 1 1 26 26 ASN HB3 H 1 2.855 0.030 . 1 . . . . 26 ASN HB3 . 10131 1 250 . 1 1 26 26 ASN HD21 H 1 7.665 0.030 . 2 . . . . 26 ASN HD21 . 10131 1 251 . 1 1 26 26 ASN HD22 H 1 6.896 0.030 . 2 . . . . 26 ASN HD22 . 10131 1 252 . 1 1 26 26 ASN C C 13 175.674 0.300 . 1 . . . . 26 ASN C . 10131 1 253 . 1 1 26 26 ASN CA C 13 54.889 0.300 . 1 . . . . 26 ASN CA . 10131 1 254 . 1 1 26 26 ASN CB C 13 38.971 0.300 . 1 . . . . 26 ASN CB . 10131 1 255 . 1 1 26 26 ASN N N 15 122.030 0.300 . 1 . . . . 26 ASN N . 10131 1 256 . 1 1 26 26 ASN ND2 N 15 113.194 0.300 . 1 . . . . 26 ASN ND2 . 10131 1 257 . 1 1 27 27 GLU H H 1 8.510 0.030 . 1 . . . . 27 GLU H . 10131 1 258 . 1 1 27 27 GLU HA H 1 4.200 0.030 . 1 . . . . 27 GLU HA . 10131 1 259 . 1 1 27 27 GLU HB2 H 1 2.070 0.030 . 2 . . . . 27 GLU HB2 . 10131 1 260 . 1 1 27 27 GLU HB3 H 1 1.970 0.030 . 2 . . . . 27 GLU HB3 . 10131 1 261 . 1 1 27 27 GLU HG2 H 1 2.270 0.030 . 2 . . . . 27 GLU HG2 . 10131 1 262 . 1 1 27 27 GLU HG3 H 1 2.190 0.030 . 2 . . . . 27 GLU HG3 . 10131 1 263 . 1 1 27 27 GLU C C 13 176.371 0.300 . 1 . . . . 27 GLU C . 10131 1 264 . 1 1 27 27 GLU CA C 13 57.142 0.300 . 1 . . . . 27 GLU CA . 10131 1 265 . 1 1 27 27 GLU CB C 13 30.395 0.300 . 1 . . . . 27 GLU CB . 10131 1 266 . 1 1 27 27 GLU CG C 13 36.588 0.300 . 1 . . . . 27 GLU CG . 10131 1 267 . 1 1 27 27 GLU N N 15 118.906 0.300 . 1 . . . . 27 GLU N . 10131 1 268 . 1 1 28 28 ASN H H 1 7.919 0.030 . 1 . . . . 28 ASN H . 10131 1 269 . 1 1 28 28 ASN HA H 1 4.650 0.030 . 1 . . . . 28 ASN HA . 10131 1 270 . 1 1 28 28 ASN HB2 H 1 2.649 0.030 . 1 . . . . 28 ASN HB2 . 10131 1 271 . 1 1 28 28 ASN HB3 H 1 2.649 0.030 . 1 . . . . 28 ASN HB3 . 10131 1 272 . 1 1 28 28 ASN HD21 H 1 7.847 0.030 . 2 . . . . 28 ASN HD21 . 10131 1 273 . 1 1 28 28 ASN HD22 H 1 6.919 0.030 . 2 . . . . 28 ASN HD22 . 10131 1 274 . 1 1 28 28 ASN C C 13 173.330 0.300 . 1 . . . . 28 ASN C . 10131 1 275 . 1 1 28 28 ASN CA C 13 53.121 0.300 . 1 . . . . 28 ASN CA . 10131 1 276 . 1 1 28 28 ASN CB C 13 39.299 0.300 . 1 . . . . 28 ASN CB . 10131 1 277 . 1 1 28 28 ASN N N 15 118.798 0.300 . 1 . . . . 28 ASN N . 10131 1 278 . 1 1 28 28 ASN ND2 N 15 115.116 0.300 . 1 . . . . 28 ASN ND2 . 10131 1 279 . 1 1 29 29 SER H H 1 8.191 0.030 . 1 . . . . 29 SER H . 10131 1 280 . 1 1 29 29 SER HA H 1 4.140 0.030 . 1 . . . . 29 SER HA . 10131 1 281 . 1 1 29 29 SER HB2 H 1 3.817 0.030 . 2 . . . . 29 SER HB2 . 10131 1 282 . 1 1 29 29 SER HB3 H 1 3.780 0.030 . 2 . . . . 29 SER HB3 . 10131 1 283 . 1 1 29 29 SER C C 13 176.329 0.300 . 1 . . . . 29 SER C . 10131 1 284 . 1 1 29 29 SER CA C 13 59.948 0.300 . 1 . . . . 29 SER CA . 10131 1 285 . 1 1 29 29 SER CB C 13 63.500 0.300 . 1 . . . . 29 SER CB . 10131 1 286 . 1 1 29 29 SER N N 15 115.724 0.300 . 1 . . . . 29 SER N . 10131 1 287 . 1 1 30 30 GLY H H 1 9.582 0.030 . 1 . . . . 30 GLY H . 10131 1 288 . 1 1 30 30 GLY HA2 H 1 3.579 0.030 . 2 . . . . 30 GLY HA2 . 10131 1 289 . 1 1 30 30 GLY HA3 H 1 4.110 0.030 . 2 . . . . 30 GLY HA3 . 10131 1 290 . 1 1 30 30 GLY C C 13 173.264 0.300 . 1 . . . . 30 GLY C . 10131 1 291 . 1 1 30 30 GLY CA C 13 45.421 0.300 . 1 . . . . 30 GLY CA . 10131 1 292 . 1 1 30 30 GLY N N 15 113.600 0.300 . 1 . . . . 30 GLY N . 10131 1 293 . 1 1 31 31 LYS H H 1 7.940 0.030 . 1 . . . . 31 LYS H . 10131 1 294 . 1 1 31 31 LYS HA H 1 4.580 0.030 . 1 . . . . 31 LYS HA . 10131 1 295 . 1 1 31 31 LYS HB2 H 1 1.890 0.030 . 2 . . . . 31 LYS HB2 . 10131 1 296 . 1 1 31 31 LYS HB3 H 1 1.770 0.030 . 2 . . . . 31 LYS HB3 . 10131 1 297 . 1 1 31 31 LYS HG2 H 1 1.283 0.030 . 2 . . . . 31 LYS HG2 . 10131 1 298 . 1 1 31 31 LYS HG3 H 1 1.380 0.030 . 2 . . . . 31 LYS HG3 . 10131 1 299 . 1 1 31 31 LYS HD2 H 1 1.660 0.030 . 1 . . . . 31 LYS HD2 . 10131 1 300 . 1 1 31 31 LYS HD3 H 1 1.660 0.030 . 1 . . . . 31 LYS HD3 . 10131 1 301 . 1 1 31 31 LYS C C 13 174.395 0.300 . 1 . . . . 31 LYS C . 10131 1 302 . 1 1 31 31 LYS CA C 13 54.918 0.300 . 1 . . . . 31 LYS CA . 10131 1 303 . 1 1 31 31 LYS CB C 13 33.033 0.300 . 1 . . . . 31 LYS CB . 10131 1 304 . 1 1 31 31 LYS CG C 13 24.903 0.300 . 1 . . . . 31 LYS CG . 10131 1 305 . 1 1 31 31 LYS CD C 13 29.022 0.300 . 1 . . . . 31 LYS CD . 10131 1 306 . 1 1 31 31 LYS CE C 13 42.350 0.300 . 1 . . . . 31 LYS CE . 10131 1 307 . 1 1 31 31 LYS N N 15 121.604 0.300 . 1 . . . . 31 LYS N . 10131 1 308 . 1 1 32 32 PHE H H 1 8.790 0.030 . 1 . . . . 32 PHE H . 10131 1 309 . 1 1 32 32 PHE HA H 1 4.785 0.030 . 1 . . . . 32 PHE HA . 10131 1 310 . 1 1 32 32 PHE HB2 H 1 2.610 0.030 . 2 . . . . 32 PHE HB2 . 10131 1 311 . 1 1 32 32 PHE HB3 H 1 2.930 0.030 . 2 . . . . 32 PHE HB3 . 10131 1 312 . 1 1 32 32 PHE HD1 H 1 6.920 0.030 . 1 . . . . 32 PHE HD1 . 10131 1 313 . 1 1 32 32 PHE HD2 H 1 6.920 0.030 . 1 . . . . 32 PHE HD2 . 10131 1 314 . 1 1 32 32 PHE HE1 H 1 6.978 0.030 . 1 . . . . 32 PHE HE1 . 10131 1 315 . 1 1 32 32 PHE HE2 H 1 6.978 0.030 . 1 . . . . 32 PHE HE2 . 10131 1 316 . 1 1 32 32 PHE HZ H 1 6.877 0.030 . 1 . . . . 32 PHE HZ . 10131 1 317 . 1 1 32 32 PHE C C 13 175.608 0.300 . 1 . . . . 32 PHE C . 10131 1 318 . 1 1 32 32 PHE CA C 13 57.510 0.300 . 1 . . . . 32 PHE CA . 10131 1 319 . 1 1 32 32 PHE CB C 13 41.623 0.300 . 1 . . . . 32 PHE CB . 10131 1 320 . 1 1 32 32 PHE CD1 C 13 131.405 0.300 . 1 . . . . 32 PHE CD1 . 10131 1 321 . 1 1 32 32 PHE CD2 C 13 131.405 0.300 . 1 . . . . 32 PHE CD2 . 10131 1 322 . 1 1 32 32 PHE CE1 C 13 131.067 0.300 . 1 . . . . 32 PHE CE1 . 10131 1 323 . 1 1 32 32 PHE CE2 C 13 131.067 0.300 . 1 . . . . 32 PHE CE2 . 10131 1 324 . 1 1 32 32 PHE CZ C 13 129.183 0.300 . 1 . . . . 32 PHE CZ . 10131 1 325 . 1 1 32 32 PHE N N 15 122.759 0.300 . 1 . . . . 32 PHE N . 10131 1 326 . 1 1 33 33 LEU H H 1 9.228 0.030 . 1 . . . . 33 LEU H . 10131 1 327 . 1 1 33 33 LEU HA H 1 4.690 0.030 . 1 . . . . 33 LEU HA . 10131 1 328 . 1 1 33 33 LEU HB2 H 1 1.880 0.030 . 2 . . . . 33 LEU HB2 . 10131 1 329 . 1 1 33 33 LEU HB3 H 1 1.241 0.030 . 2 . . . . 33 LEU HB3 . 10131 1 330 . 1 1 33 33 LEU HG H 1 1.660 0.030 . 1 . . . . 33 LEU HG . 10131 1 331 . 1 1 33 33 LEU HD11 H 1 0.941 0.030 . 1 . . . . 33 LEU HD1 . 10131 1 332 . 1 1 33 33 LEU HD12 H 1 0.941 0.030 . 1 . . . . 33 LEU HD1 . 10131 1 333 . 1 1 33 33 LEU HD13 H 1 0.941 0.030 . 1 . . . . 33 LEU HD1 . 10131 1 334 . 1 1 33 33 LEU HD21 H 1 0.890 0.030 . 1 . . . . 33 LEU HD2 . 10131 1 335 . 1 1 33 33 LEU HD22 H 1 0.890 0.030 . 1 . . . . 33 LEU HD2 . 10131 1 336 . 1 1 33 33 LEU HD23 H 1 0.890 0.030 . 1 . . . . 33 LEU HD2 . 10131 1 337 . 1 1 33 33 LEU C C 13 175.551 0.300 . 1 . . . . 33 LEU C . 10131 1 338 . 1 1 33 33 LEU CA C 13 53.136 0.300 . 1 . . . . 33 LEU CA . 10131 1 339 . 1 1 33 33 LEU CB C 13 43.675 0.300 . 1 . . . . 33 LEU CB . 10131 1 340 . 1 1 33 33 LEU CG C 13 26.939 0.300 . 1 . . . . 33 LEU CG . 10131 1 341 . 1 1 33 33 LEU CD1 C 13 25.419 0.300 . 2 . . . . 33 LEU CD1 . 10131 1 342 . 1 1 33 33 LEU CD2 C 13 23.038 0.300 . 2 . . . . 33 LEU CD2 . 10131 1 343 . 1 1 33 33 LEU N N 15 124.224 0.300 . 1 . . . . 33 LEU N . 10131 1 344 . 1 1 34 34 ARG H H 1 8.823 0.030 . 1 . . . . 34 ARG H . 10131 1 345 . 1 1 34 34 ARG HA H 1 5.140 0.030 . 1 . . . . 34 ARG HA . 10131 1 346 . 1 1 34 34 ARG HB2 H 1 1.970 0.030 . 2 . . . . 34 ARG HB2 . 10131 1 347 . 1 1 34 34 ARG HB3 H 1 1.782 0.030 . 2 . . . . 34 ARG HB3 . 10131 1 348 . 1 1 34 34 ARG HG2 H 1 1.600 0.030 . 2 . . . . 34 ARG HG2 . 10131 1 349 . 1 1 34 34 ARG HG3 H 1 1.660 0.030 . 2 . . . . 34 ARG HG3 . 10131 1 350 . 1 1 34 34 ARG HD2 H 1 3.152 0.030 . 2 . . . . 34 ARG HD2 . 10131 1 351 . 1 1 34 34 ARG HD3 H 1 3.061 0.030 . 2 . . . . 34 ARG HD3 . 10131 1 352 . 1 1 34 34 ARG HE H 1 7.280 0.030 . 1 . . . . 34 ARG HE . 10131 1 353 . 1 1 34 34 ARG C C 13 177.829 0.300 . 1 . . . . 34 ARG C . 10131 1 354 . 1 1 34 34 ARG CA C 13 57.128 0.300 . 1 . . . . 34 ARG CA . 10131 1 355 . 1 1 34 34 ARG CB C 13 30.301 0.300 . 1 . . . . 34 ARG CB . 10131 1 356 . 1 1 34 34 ARG CG C 13 27.595 0.300 . 1 . . . . 34 ARG CG . 10131 1 357 . 1 1 34 34 ARG CD C 13 43.738 0.300 . 1 . . . . 34 ARG CD . 10131 1 358 . 1 1 34 34 ARG N N 15 125.745 0.300 . 1 . . . . 34 ARG N . 10131 1 359 . 1 1 34 34 ARG NE N 15 84.773 0.300 . 1 . . . . 34 ARG NE . 10131 1 360 . 1 1 35 35 ARG H H 1 9.625 0.030 . 1 . . . . 35 ARG H . 10131 1 361 . 1 1 35 35 ARG HA H 1 5.132 0.030 . 1 . . . . 35 ARG HA . 10131 1 362 . 1 1 35 35 ARG HB2 H 1 1.780 0.030 . 1 . . . . 35 ARG HB2 . 10131 1 363 . 1 1 35 35 ARG HB3 H 1 1.780 0.030 . 1 . . . . 35 ARG HB3 . 10131 1 364 . 1 1 35 35 ARG HG2 H 1 1.470 0.030 . 2 . . . . 35 ARG HG2 . 10131 1 365 . 1 1 35 35 ARG HG3 H 1 1.567 0.030 . 2 . . . . 35 ARG HG3 . 10131 1 366 . 1 1 35 35 ARG HD2 H 1 3.720 0.030 . 2 . . . . 35 ARG HD2 . 10131 1 367 . 1 1 35 35 ARG HD3 H 1 2.790 0.030 . 2 . . . . 35 ARG HD3 . 10131 1 368 . 1 1 35 35 ARG HE H 1 7.850 0.030 . 1 . . . . 35 ARG HE . 10131 1 369 . 1 1 35 35 ARG C C 13 172.051 0.300 . 1 . . . . 35 ARG C . 10131 1 370 . 1 1 35 35 ARG CA C 13 53.394 0.300 . 1 . . . . 35 ARG CA . 10131 1 371 . 1 1 35 35 ARG CB C 13 34.250 0.300 . 1 . . . . 35 ARG CB . 10131 1 372 . 1 1 35 35 ARG CG C 13 28.328 0.300 . 1 . . . . 35 ARG CG . 10131 1 373 . 1 1 35 35 ARG CD C 13 43.947 0.300 . 1 . . . . 35 ARG CD . 10131 1 374 . 1 1 35 35 ARG N N 15 131.171 0.300 . 1 . . . . 35 ARG N . 10131 1 375 . 1 1 35 35 ARG NE N 15 85.218 0.300 . 1 . . . . 35 ARG NE . 10131 1 376 . 1 1 36 36 TYR H H 1 8.760 0.030 . 1 . . . . 36 TYR H . 10131 1 377 . 1 1 36 36 TYR HA H 1 4.371 0.030 . 1 . . . . 36 TYR HA . 10131 1 378 . 1 1 36 36 TYR HB2 H 1 2.582 0.030 . 2 . . . . 36 TYR HB2 . 10131 1 379 . 1 1 36 36 TYR HB3 H 1 1.982 0.030 . 2 . . . . 36 TYR HB3 . 10131 1 380 . 1 1 36 36 TYR HD1 H 1 5.740 0.030 . 1 . . . . 36 TYR HD1 . 10131 1 381 . 1 1 36 36 TYR HD2 H 1 5.740 0.030 . 1 . . . . 36 TYR HD2 . 10131 1 382 . 1 1 36 36 TYR HE1 H 1 6.510 0.030 . 1 . . . . 36 TYR HE1 . 10131 1 383 . 1 1 36 36 TYR HE2 H 1 6.510 0.030 . 1 . . . . 36 TYR HE2 . 10131 1 384 . 1 1 36 36 TYR C C 13 174.428 0.300 . 1 . . . . 36 TYR C . 10131 1 385 . 1 1 36 36 TYR CA C 13 58.169 0.300 . 1 . . . . 36 TYR CA . 10131 1 386 . 1 1 36 36 TYR CB C 13 40.267 0.300 . 1 . . . . 36 TYR CB . 10131 1 387 . 1 1 36 36 TYR CD1 C 13 132.609 0.300 . 1 . . . . 36 TYR CD1 . 10131 1 388 . 1 1 36 36 TYR CD2 C 13 132.609 0.300 . 1 . . . . 36 TYR CD2 . 10131 1 389 . 1 1 36 36 TYR CE1 C 13 117.271 0.300 . 1 . . . . 36 TYR CE1 . 10131 1 390 . 1 1 36 36 TYR CE2 C 13 117.271 0.300 . 1 . . . . 36 TYR CE2 . 10131 1 391 . 1 1 36 36 TYR N N 15 122.113 0.300 . 1 . . . . 36 TYR N . 10131 1 392 . 1 1 37 37 PHE H H 1 8.970 0.030 . 1 . . . . 37 PHE H . 10131 1 393 . 1 1 37 37 PHE HA H 1 5.431 0.030 . 1 . . . . 37 PHE HA . 10131 1 394 . 1 1 37 37 PHE HB2 H 1 2.911 0.030 . 2 . . . . 37 PHE HB2 . 10131 1 395 . 1 1 37 37 PHE HB3 H 1 2.559 0.030 . 2 . . . . 37 PHE HB3 . 10131 1 396 . 1 1 37 37 PHE HD1 H 1 6.866 0.030 . 1 . . . . 37 PHE HD1 . 10131 1 397 . 1 1 37 37 PHE HD2 H 1 6.866 0.030 . 1 . . . . 37 PHE HD2 . 10131 1 398 . 1 1 37 37 PHE HE1 H 1 6.203 0.030 . 1 . . . . 37 PHE HE1 . 10131 1 399 . 1 1 37 37 PHE HE2 H 1 6.203 0.030 . 1 . . . . 37 PHE HE2 . 10131 1 400 . 1 1 37 37 PHE HZ H 1 5.870 0.030 . 1 . . . . 37 PHE HZ . 10131 1 401 . 1 1 37 37 PHE C C 13 175.288 0.300 . 1 . . . . 37 PHE C . 10131 1 402 . 1 1 37 37 PHE CA C 13 57.271 0.300 . 1 . . . . 37 PHE CA . 10131 1 403 . 1 1 37 37 PHE CB C 13 43.368 0.300 . 1 . . . . 37 PHE CB . 10131 1 404 . 1 1 37 37 PHE CD1 C 13 131.256 0.300 . 1 . . . . 37 PHE CD1 . 10131 1 405 . 1 1 37 37 PHE CD2 C 13 131.256 0.300 . 1 . . . . 37 PHE CD2 . 10131 1 406 . 1 1 37 37 PHE CE1 C 13 131.139 0.300 . 1 . . . . 37 PHE CE1 . 10131 1 407 . 1 1 37 37 PHE CE2 C 13 131.139 0.300 . 1 . . . . 37 PHE CE2 . 10131 1 408 . 1 1 37 37 PHE CZ C 13 128.230 0.300 . 1 . . . . 37 PHE CZ . 10131 1 409 . 1 1 37 37 PHE N N 15 128.914 0.300 . 1 . . . . 37 PHE N . 10131 1 410 . 1 1 38 38 ILE H H 1 9.490 0.030 . 1 . . . . 38 ILE H . 10131 1 411 . 1 1 38 38 ILE HA H 1 4.630 0.030 . 1 . . . . 38 ILE HA . 10131 1 412 . 1 1 38 38 ILE HB H 1 1.970 0.030 . 1 . . . . 38 ILE HB . 10131 1 413 . 1 1 38 38 ILE HG12 H 1 1.262 0.030 . 2 . . . . 38 ILE HG12 . 10131 1 414 . 1 1 38 38 ILE HG13 H 1 1.861 0.030 . 2 . . . . 38 ILE HG13 . 10131 1 415 . 1 1 38 38 ILE HG21 H 1 0.974 0.030 . 1 . . . . 38 ILE HG2 . 10131 1 416 . 1 1 38 38 ILE HG22 H 1 0.974 0.030 . 1 . . . . 38 ILE HG2 . 10131 1 417 . 1 1 38 38 ILE HG23 H 1 0.974 0.030 . 1 . . . . 38 ILE HG2 . 10131 1 418 . 1 1 38 38 ILE HD11 H 1 0.997 0.030 . 1 . . . . 38 ILE HD1 . 10131 1 419 . 1 1 38 38 ILE HD12 H 1 0.997 0.030 . 1 . . . . 38 ILE HD1 . 10131 1 420 . 1 1 38 38 ILE HD13 H 1 0.997 0.030 . 1 . . . . 38 ILE HD1 . 10131 1 421 . 1 1 38 38 ILE C C 13 174.715 0.300 . 1 . . . . 38 ILE C . 10131 1 422 . 1 1 38 38 ILE CA C 13 61.788 0.300 . 1 . . . . 38 ILE CA . 10131 1 423 . 1 1 38 38 ILE CB C 13 43.416 0.300 . 1 . . . . 38 ILE CB . 10131 1 424 . 1 1 38 38 ILE CG1 C 13 28.122 0.300 . 1 . . . . 38 ILE CG1 . 10131 1 425 . 1 1 38 38 ILE CG2 C 13 16.975 0.300 . 1 . . . . 38 ILE CG2 . 10131 1 426 . 1 1 38 38 ILE CD1 C 13 14.358 0.300 . 1 . . . . 38 ILE CD1 . 10131 1 427 . 1 1 38 38 ILE N N 15 117.677 0.300 . 1 . . . . 38 ILE N . 10131 1 428 . 1 1 39 39 LEU H H 1 8.740 0.030 . 1 . . . . 39 LEU H . 10131 1 429 . 1 1 39 39 LEU HA H 1 4.854 0.030 . 1 . . . . 39 LEU HA . 10131 1 430 . 1 1 39 39 LEU HB2 H 1 2.266 0.030 . 2 . . . . 39 LEU HB2 . 10131 1 431 . 1 1 39 39 LEU HB3 H 1 1.467 0.030 . 2 . . . . 39 LEU HB3 . 10131 1 432 . 1 1 39 39 LEU HG H 1 1.590 0.030 . 1 . . . . 39 LEU HG . 10131 1 433 . 1 1 39 39 LEU HD11 H 1 0.904 0.030 . 1 . . . . 39 LEU HD1 . 10131 1 434 . 1 1 39 39 LEU HD12 H 1 0.904 0.030 . 1 . . . . 39 LEU HD1 . 10131 1 435 . 1 1 39 39 LEU HD13 H 1 0.904 0.030 . 1 . . . . 39 LEU HD1 . 10131 1 436 . 1 1 39 39 LEU HD21 H 1 0.790 0.030 . 1 . . . . 39 LEU HD2 . 10131 1 437 . 1 1 39 39 LEU HD22 H 1 0.790 0.030 . 1 . . . . 39 LEU HD2 . 10131 1 438 . 1 1 39 39 LEU HD23 H 1 0.790 0.030 . 1 . . . . 39 LEU HD2 . 10131 1 439 . 1 1 39 39 LEU C C 13 173.658 0.300 . 1 . . . . 39 LEU C . 10131 1 440 . 1 1 39 39 LEU CA C 13 54.835 0.300 . 1 . . . . 39 LEU CA . 10131 1 441 . 1 1 39 39 LEU CB C 13 42.597 0.300 . 1 . . . . 39 LEU CB . 10131 1 442 . 1 1 39 39 LEU CG C 13 28.466 0.300 . 1 . . . . 39 LEU CG . 10131 1 443 . 1 1 39 39 LEU CD1 C 13 26.041 0.300 . 2 . . . . 39 LEU CD1 . 10131 1 444 . 1 1 39 39 LEU CD2 C 13 25.837 0.300 . 2 . . . . 39 LEU CD2 . 10131 1 445 . 1 1 39 39 LEU N N 15 129.729 0.300 . 1 . . . . 39 LEU N . 10131 1 446 . 1 1 40 40 ASP H H 1 8.760 0.030 . 1 . . . . 40 ASP H . 10131 1 447 . 1 1 40 40 ASP HA H 1 5.026 0.030 . 1 . . . . 40 ASP HA . 10131 1 448 . 1 1 40 40 ASP HB2 H 1 3.353 0.030 . 2 . . . . 40 ASP HB2 . 10131 1 449 . 1 1 40 40 ASP HB3 H 1 2.389 0.030 . 2 . . . . 40 ASP HB3 . 10131 1 450 . 1 1 40 40 ASP C C 13 176.748 0.300 . 1 . . . . 40 ASP C . 10131 1 451 . 1 1 40 40 ASP CA C 13 52.651 0.300 . 1 . . . . 40 ASP CA . 10131 1 452 . 1 1 40 40 ASP CB C 13 42.383 0.300 . 1 . . . . 40 ASP CB . 10131 1 453 . 1 1 40 40 ASP N N 15 128.394 0.300 . 1 . . . . 40 ASP N . 10131 1 454 . 1 1 41 41 THR H H 1 8.367 0.030 . 1 . . . . 41 THR H . 10131 1 455 . 1 1 41 41 THR HA H 1 4.041 0.030 . 1 . . . . 41 THR HA . 10131 1 456 . 1 1 41 41 THR HB H 1 4.417 0.030 . 1 . . . . 41 THR HB . 10131 1 457 . 1 1 41 41 THR HG21 H 1 1.247 0.030 . 1 . . . . 41 THR HG2 . 10131 1 458 . 1 1 41 41 THR HG22 H 1 1.247 0.030 . 1 . . . . 41 THR HG2 . 10131 1 459 . 1 1 41 41 THR HG23 H 1 1.247 0.030 . 1 . . . . 41 THR HG2 . 10131 1 460 . 1 1 41 41 THR C C 13 176.690 0.300 . 1 . . . . 41 THR C . 10131 1 461 . 1 1 41 41 THR CA C 13 64.596 0.300 . 1 . . . . 41 THR CA . 10131 1 462 . 1 1 41 41 THR CB C 13 68.215 0.300 . 1 . . . . 41 THR CB . 10131 1 463 . 1 1 41 41 THR CG2 C 13 22.496 0.300 . 1 . . . . 41 THR CG2 . 10131 1 464 . 1 1 41 41 THR N N 15 116.499 0.300 . 1 . . . . 41 THR N . 10131 1 465 . 1 1 42 42 GLN H H 1 8.549 0.030 . 1 . . . . 42 GLN H . 10131 1 466 . 1 1 42 42 GLN HA H 1 4.240 0.030 . 1 . . . . 42 GLN HA . 10131 1 467 . 1 1 42 42 GLN HB2 H 1 2.217 0.030 . 1 . . . . 42 GLN HB2 . 10131 1 468 . 1 1 42 42 GLN HB3 H 1 2.217 0.030 . 1 . . . . 42 GLN HB3 . 10131 1 469 . 1 1 42 42 GLN HG2 H 1 2.443 0.030 . 2 . . . . 42 GLN HG2 . 10131 1 470 . 1 1 42 42 GLN HG3 H 1 2.394 0.030 . 2 . . . . 42 GLN HG3 . 10131 1 471 . 1 1 42 42 GLN HE21 H 1 7.584 0.030 . 2 . . . . 42 GLN HE21 . 10131 1 472 . 1 1 42 42 GLN HE22 H 1 6.837 0.030 . 2 . . . . 42 GLN HE22 . 10131 1 473 . 1 1 42 42 GLN C C 13 177.239 0.300 . 1 . . . . 42 GLN C . 10131 1 474 . 1 1 42 42 GLN CA C 13 58.614 0.300 . 1 . . . . 42 GLN CA . 10131 1 475 . 1 1 42 42 GLN CB C 13 28.391 0.300 . 1 . . . . 42 GLN CB . 10131 1 476 . 1 1 42 42 GLN CG C 13 34.436 0.300 . 1 . . . . 42 GLN CG . 10131 1 477 . 1 1 42 42 GLN N N 15 123.150 0.300 . 1 . . . . 42 GLN N . 10131 1 478 . 1 1 42 42 GLN NE2 N 15 112.359 0.300 . 1 . . . . 42 GLN NE2 . 10131 1 479 . 1 1 43 43 ALA H H 1 7.961 0.030 . 1 . . . . 43 ALA H . 10131 1 480 . 1 1 43 43 ALA HA H 1 4.320 0.030 . 1 . . . . 43 ALA HA . 10131 1 481 . 1 1 43 43 ALA HB1 H 1 1.352 0.030 . 1 . . . . 43 ALA HB . 10131 1 482 . 1 1 43 43 ALA HB2 H 1 1.352 0.030 . 1 . . . . 43 ALA HB . 10131 1 483 . 1 1 43 43 ALA HB3 H 1 1.352 0.030 . 1 . . . . 43 ALA HB . 10131 1 484 . 1 1 43 43 ALA C C 13 177.043 0.300 . 1 . . . . 43 ALA C . 10131 1 485 . 1 1 43 43 ALA CA C 13 51.652 0.300 . 1 . . . . 43 ALA CA . 10131 1 486 . 1 1 43 43 ALA CB C 13 19.105 0.300 . 1 . . . . 43 ALA CB . 10131 1 487 . 1 1 43 43 ALA N N 15 120.605 0.300 . 1 . . . . 43 ALA N . 10131 1 488 . 1 1 44 44 ASN H H 1 7.980 0.030 . 1 . . . . 44 ASN H . 10131 1 489 . 1 1 44 44 ASN HA H 1 4.398 0.030 . 1 . . . . 44 ASN HA . 10131 1 490 . 1 1 44 44 ASN HB2 H 1 3.357 0.030 . 2 . . . . 44 ASN HB2 . 10131 1 491 . 1 1 44 44 ASN HB3 H 1 2.556 0.030 . 2 . . . . 44 ASN HB3 . 10131 1 492 . 1 1 44 44 ASN HD21 H 1 7.577 0.030 . 2 . . . . 44 ASN HD21 . 10131 1 493 . 1 1 44 44 ASN HD22 H 1 6.674 0.030 . 2 . . . . 44 ASN HD22 . 10131 1 494 . 1 1 44 44 ASN C C 13 175.043 0.300 . 1 . . . . 44 ASN C . 10131 1 495 . 1 1 44 44 ASN CA C 13 53.819 0.300 . 1 . . . . 44 ASN CA . 10131 1 496 . 1 1 44 44 ASN CB C 13 37.982 0.300 . 1 . . . . 44 ASN CB . 10131 1 497 . 1 1 44 44 ASN N N 15 116.724 0.300 . 1 . . . . 44 ASN N . 10131 1 498 . 1 1 44 44 ASN ND2 N 15 110.195 0.300 . 1 . . . . 44 ASN ND2 . 10131 1 499 . 1 1 45 45 CYS H H 1 8.371 0.030 . 1 . . . . 45 CYS H . 10131 1 500 . 1 1 45 45 CYS HA H 1 5.280 0.030 . 1 . . . . 45 CYS HA . 10131 1 501 . 1 1 45 45 CYS HB2 H 1 2.727 0.030 . 2 . . . . 45 CYS HB2 . 10131 1 502 . 1 1 45 45 CYS HB3 H 1 2.549 0.030 . 2 . . . . 45 CYS HB3 . 10131 1 503 . 1 1 45 45 CYS C C 13 171.428 0.300 . 1 . . . . 45 CYS C . 10131 1 504 . 1 1 45 45 CYS CA C 13 57.672 0.300 . 1 . . . . 45 CYS CA . 10131 1 505 . 1 1 45 45 CYS CB C 13 32.036 0.300 . 1 . . . . 45 CYS CB . 10131 1 506 . 1 1 45 45 CYS N N 15 113.948 0.300 . 1 . . . . 45 CYS N . 10131 1 507 . 1 1 46 46 LEU H H 1 8.980 0.030 . 1 . . . . 46 LEU H . 10131 1 508 . 1 1 46 46 LEU HA H 1 5.209 0.030 . 1 . . . . 46 LEU HA . 10131 1 509 . 1 1 46 46 LEU HB2 H 1 1.297 0.030 . 2 . . . . 46 LEU HB2 . 10131 1 510 . 1 1 46 46 LEU HB3 H 1 2.272 0.030 . 2 . . . . 46 LEU HB3 . 10131 1 511 . 1 1 46 46 LEU HG H 1 1.900 0.030 . 1 . . . . 46 LEU HG . 10131 1 512 . 1 1 46 46 LEU HD11 H 1 0.770 0.030 . 1 . . . . 46 LEU HD1 . 10131 1 513 . 1 1 46 46 LEU HD12 H 1 0.770 0.030 . 1 . . . . 46 LEU HD1 . 10131 1 514 . 1 1 46 46 LEU HD13 H 1 0.770 0.030 . 1 . . . . 46 LEU HD1 . 10131 1 515 . 1 1 46 46 LEU HD21 H 1 1.298 0.030 . 1 . . . . 46 LEU HD2 . 10131 1 516 . 1 1 46 46 LEU HD22 H 1 1.298 0.030 . 1 . . . . 46 LEU HD2 . 10131 1 517 . 1 1 46 46 LEU HD23 H 1 1.298 0.030 . 1 . . . . 46 LEU HD2 . 10131 1 518 . 1 1 46 46 LEU C C 13 174.084 0.300 . 1 . . . . 46 LEU C . 10131 1 519 . 1 1 46 46 LEU CA C 13 54.050 0.300 . 1 . . . . 46 LEU CA . 10131 1 520 . 1 1 46 46 LEU CB C 13 45.131 0.300 . 1 . . . . 46 LEU CB . 10131 1 521 . 1 1 46 46 LEU CG C 13 27.495 0.300 . 1 . . . . 46 LEU CG . 10131 1 522 . 1 1 46 46 LEU CD1 C 13 25.500 0.300 . 2 . . . . 46 LEU CD1 . 10131 1 523 . 1 1 46 46 LEU CD2 C 13 24.431 0.300 . 2 . . . . 46 LEU CD2 . 10131 1 524 . 1 1 46 46 LEU N N 15 125.448 0.300 . 1 . . . . 46 LEU N . 10131 1 525 . 1 1 47 47 LEU H H 1 9.220 0.030 . 1 . . . . 47 LEU H . 10131 1 526 . 1 1 47 47 LEU HA H 1 4.920 0.030 . 1 . . . . 47 LEU HA . 10131 1 527 . 1 1 47 47 LEU HB2 H 1 1.928 0.030 . 2 . . . . 47 LEU HB2 . 10131 1 528 . 1 1 47 47 LEU HB3 H 1 1.401 0.030 . 2 . . . . 47 LEU HB3 . 10131 1 529 . 1 1 47 47 LEU HG H 1 1.628 0.030 . 1 . . . . 47 LEU HG . 10131 1 530 . 1 1 47 47 LEU HD11 H 1 1.059 0.030 . 1 . . . . 47 LEU HD1 . 10131 1 531 . 1 1 47 47 LEU HD12 H 1 1.059 0.030 . 1 . . . . 47 LEU HD1 . 10131 1 532 . 1 1 47 47 LEU HD13 H 1 1.059 0.030 . 1 . . . . 47 LEU HD1 . 10131 1 533 . 1 1 47 47 LEU HD21 H 1 0.834 0.030 . 1 . . . . 47 LEU HD2 . 10131 1 534 . 1 1 47 47 LEU HD22 H 1 0.834 0.030 . 1 . . . . 47 LEU HD2 . 10131 1 535 . 1 1 47 47 LEU HD23 H 1 0.834 0.030 . 1 . . . . 47 LEU HD2 . 10131 1 536 . 1 1 47 47 LEU C C 13 176.223 0.300 . 1 . . . . 47 LEU C . 10131 1 537 . 1 1 47 47 LEU CA C 13 54.255 0.300 . 1 . . . . 47 LEU CA . 10131 1 538 . 1 1 47 47 LEU CB C 13 47.000 0.300 . 1 . . . . 47 LEU CB . 10131 1 539 . 1 1 47 47 LEU CG C 13 27.608 0.300 . 1 . . . . 47 LEU CG . 10131 1 540 . 1 1 47 47 LEU CD1 C 13 26.627 0.300 . 2 . . . . 47 LEU CD1 . 10131 1 541 . 1 1 47 47 LEU CD2 C 13 24.699 0.300 . 2 . . . . 47 LEU CD2 . 10131 1 542 . 1 1 47 47 LEU N N 15 127.766 0.300 . 1 . . . . 47 LEU N . 10131 1 543 . 1 1 48 48 TRP H H 1 7.953 0.030 . 1 . . . . 48 TRP H . 10131 1 544 . 1 1 48 48 TRP HA H 1 5.840 0.030 . 1 . . . . 48 TRP HA . 10131 1 545 . 1 1 48 48 TRP HB2 H 1 1.800 0.030 . 2 . . . . 48 TRP HB2 . 10131 1 546 . 1 1 48 48 TRP HB3 H 1 1.658 0.030 . 2 . . . . 48 TRP HB3 . 10131 1 547 . 1 1 48 48 TRP HD1 H 1 6.176 0.030 . 1 . . . . 48 TRP HD1 . 10131 1 548 . 1 1 48 48 TRP HE1 H 1 10.053 0.030 . 1 . . . . 48 TRP HE1 . 10131 1 549 . 1 1 48 48 TRP HE3 H 1 6.801 0.030 . 1 . . . . 48 TRP HE3 . 10131 1 550 . 1 1 48 48 TRP HZ2 H 1 7.218 0.030 . 1 . . . . 48 TRP HZ2 . 10131 1 551 . 1 1 48 48 TRP HZ3 H 1 6.461 0.030 . 1 . . . . 48 TRP HZ3 . 10131 1 552 . 1 1 48 48 TRP HH2 H 1 6.491 0.030 . 1 . . . . 48 TRP HH2 . 10131 1 553 . 1 1 48 48 TRP C C 13 174.887 0.300 . 1 . . . . 48 TRP C . 10131 1 554 . 1 1 48 48 TRP CA C 13 55.654 0.300 . 1 . . . . 48 TRP CA . 10131 1 555 . 1 1 48 48 TRP CB C 13 30.639 0.300 . 1 . . . . 48 TRP CB . 10131 1 556 . 1 1 48 48 TRP CD1 C 13 125.047 0.300 . 1 . . . . 48 TRP CD1 . 10131 1 557 . 1 1 48 48 TRP CE3 C 13 122.120 0.300 . 1 . . . . 48 TRP CE3 . 10131 1 558 . 1 1 48 48 TRP CZ2 C 13 113.885 0.300 . 1 . . . . 48 TRP CZ2 . 10131 1 559 . 1 1 48 48 TRP CZ3 C 13 120.647 0.300 . 1 . . . . 48 TRP CZ3 . 10131 1 560 . 1 1 48 48 TRP CH2 C 13 123.758 0.300 . 1 . . . . 48 TRP CH2 . 10131 1 561 . 1 1 48 48 TRP N N 15 115.454 0.300 . 1 . . . . 48 TRP N . 10131 1 562 . 1 1 48 48 TRP NE1 N 15 127.052 0.300 . 1 . . . . 48 TRP NE1 . 10131 1 563 . 1 1 49 49 TYR H H 1 9.299 0.030 . 1 . . . . 49 TYR H . 10131 1 564 . 1 1 49 49 TYR HA H 1 4.713 0.030 . 1 . . . . 49 TYR HA . 10131 1 565 . 1 1 49 49 TYR HB2 H 1 3.431 0.030 . 2 . . . . 49 TYR HB2 . 10131 1 566 . 1 1 49 49 TYR HB3 H 1 3.148 0.030 . 2 . . . . 49 TYR HB3 . 10131 1 567 . 1 1 49 49 TYR HD1 H 1 7.102 0.030 . 1 . . . . 49 TYR HD1 . 10131 1 568 . 1 1 49 49 TYR HD2 H 1 7.102 0.030 . 1 . . . . 49 TYR HD2 . 10131 1 569 . 1 1 49 49 TYR HE1 H 1 6.711 0.030 . 1 . . . . 49 TYR HE1 . 10131 1 570 . 1 1 49 49 TYR HE2 H 1 6.711 0.030 . 1 . . . . 49 TYR HE2 . 10131 1 571 . 1 1 49 49 TYR C C 13 176.666 0.300 . 1 . . . . 49 TYR C . 10131 1 572 . 1 1 49 49 TYR CA C 13 57.524 0.300 . 1 . . . . 49 TYR CA . 10131 1 573 . 1 1 49 49 TYR CB C 13 45.081 0.300 . 1 . . . . 49 TYR CB . 10131 1 574 . 1 1 49 49 TYR CD1 C 13 132.825 0.300 . 1 . . . . 49 TYR CD1 . 10131 1 575 . 1 1 49 49 TYR CD2 C 13 132.825 0.300 . 1 . . . . 49 TYR CD2 . 10131 1 576 . 1 1 49 49 TYR CE1 C 13 118.736 0.300 . 1 . . . . 49 TYR CE1 . 10131 1 577 . 1 1 49 49 TYR CE2 C 13 118.736 0.300 . 1 . . . . 49 TYR CE2 . 10131 1 578 . 1 1 49 49 TYR N N 15 117.414 0.300 . 1 . . . . 49 TYR N . 10131 1 579 . 1 1 50 50 MET H H 1 9.390 0.030 . 1 . . . . 50 MET H . 10131 1 580 . 1 1 50 50 MET HA H 1 4.617 0.030 . 1 . . . . 50 MET HA . 10131 1 581 . 1 1 50 50 MET HB2 H 1 2.300 0.030 . 2 . . . . 50 MET HB2 . 10131 1 582 . 1 1 50 50 MET HB3 H 1 2.022 0.030 . 2 . . . . 50 MET HB3 . 10131 1 583 . 1 1 50 50 MET HG2 H 1 2.690 0.030 . 2 . . . . 50 MET HG2 . 10131 1 584 . 1 1 50 50 MET HG3 H 1 2.900 0.030 . 2 . . . . 50 MET HG3 . 10131 1 585 . 1 1 50 50 MET HE1 H 1 2.200 0.030 . 1 . . . . 50 MET HE . 10131 1 586 . 1 1 50 50 MET HE2 H 1 2.200 0.030 . 1 . . . . 50 MET HE . 10131 1 587 . 1 1 50 50 MET HE3 H 1 2.200 0.030 . 1 . . . . 50 MET HE . 10131 1 588 . 1 1 50 50 MET C C 13 175.461 0.300 . 1 . . . . 50 MET C . 10131 1 589 . 1 1 50 50 MET CA C 13 56.435 0.300 . 1 . . . . 50 MET CA . 10131 1 590 . 1 1 50 50 MET CB C 13 31.383 0.300 . 1 . . . . 50 MET CB . 10131 1 591 . 1 1 50 50 MET CG C 13 32.215 0.300 . 1 . . . . 50 MET CG . 10131 1 592 . 1 1 50 50 MET CE C 13 16.418 0.300 . 1 . . . . 50 MET CE . 10131 1 593 . 1 1 50 50 MET N N 15 117.999 0.300 . 1 . . . . 50 MET N . 10131 1 594 . 1 1 51 51 ASP H H 1 7.771 0.030 . 1 . . . . 51 ASP H . 10131 1 595 . 1 1 51 51 ASP HA H 1 4.682 0.030 . 1 . . . . 51 ASP HA . 10131 1 596 . 1 1 51 51 ASP HB2 H 1 2.742 0.030 . 2 . . . . 51 ASP HB2 . 10131 1 597 . 1 1 51 51 ASP HB3 H 1 2.267 0.030 . 2 . . . . 51 ASP HB3 . 10131 1 598 . 1 1 51 51 ASP C C 13 173.298 0.300 . 1 . . . . 51 ASP C . 10131 1 599 . 1 1 51 51 ASP CA C 13 51.016 0.300 . 1 . . . . 51 ASP CA . 10131 1 600 . 1 1 51 51 ASP CB C 13 43.264 0.300 . 1 . . . . 51 ASP CB . 10131 1 601 . 1 1 51 51 ASP N N 15 113.226 0.300 . 1 . . . . 51 ASP N . 10131 1 602 . 1 1 52 52 ASN H H 1 9.380 0.030 . 1 . . . . 52 ASN H . 10131 1 603 . 1 1 52 52 ASN HA H 1 2.640 0.030 . 1 . . . . 52 ASN HA . 10131 1 604 . 1 1 52 52 ASN HB2 H 1 1.913 0.030 . 2 . . . . 52 ASN HB2 . 10131 1 605 . 1 1 52 52 ASN HB3 H 1 2.491 0.030 . 2 . . . . 52 ASN HB3 . 10131 1 606 . 1 1 52 52 ASN HD21 H 1 7.530 0.030 . 2 . . . . 52 ASN HD21 . 10131 1 607 . 1 1 52 52 ASN HD22 H 1 6.830 0.030 . 2 . . . . 52 ASN HD22 . 10131 1 608 . 1 1 52 52 ASN C C 13 175.928 0.300 . 1 . . . . 52 ASN C . 10131 1 609 . 1 1 52 52 ASN CA C 13 51.077 0.300 . 1 . . . . 52 ASN CA . 10131 1 610 . 1 1 52 52 ASN CB C 13 38.536 0.300 . 1 . . . . 52 ASN CB . 10131 1 611 . 1 1 52 52 ASN N N 15 120.875 0.300 . 1 . . . . 52 ASN N . 10131 1 612 . 1 1 52 52 ASN ND2 N 15 112.580 0.300 . 1 . . . . 52 ASN ND2 . 10131 1 613 . 1 1 53 53 PRO HA H 1 3.800 0.030 . 1 . . . . 53 PRO HA . 10131 1 614 . 1 1 53 53 PRO HB2 H 1 1.773 0.030 . 2 . . . . 53 PRO HB2 . 10131 1 615 . 1 1 53 53 PRO HB3 H 1 1.648 0.030 . 2 . . . . 53 PRO HB3 . 10131 1 616 . 1 1 53 53 PRO HG2 H 1 1.380 0.030 . 2 . . . . 53 PRO HG2 . 10131 1 617 . 1 1 53 53 PRO HG3 H 1 0.672 0.030 . 2 . . . . 53 PRO HG3 . 10131 1 618 . 1 1 53 53 PRO HD2 H 1 3.161 0.030 . 2 . . . . 53 PRO HD2 . 10131 1 619 . 1 1 53 53 PRO HD3 H 1 3.110 0.030 . 2 . . . . 53 PRO HD3 . 10131 1 620 . 1 1 53 53 PRO C C 13 178.042 0.300 . 1 . . . . 53 PRO C . 10131 1 621 . 1 1 53 53 PRO CA C 13 64.568 0.300 . 1 . . . . 53 PRO CA . 10131 1 622 . 1 1 53 53 PRO CB C 13 31.898 0.300 . 1 . . . . 53 PRO CB . 10131 1 623 . 1 1 53 53 PRO CG C 13 26.176 0.300 . 1 . . . . 53 PRO CG . 10131 1 624 . 1 1 53 53 PRO CD C 13 51.791 0.300 . 1 . . . . 53 PRO CD . 10131 1 625 . 1 1 54 54 GLN H H 1 7.899 0.030 . 1 . . . . 54 GLN H . 10131 1 626 . 1 1 54 54 GLN HA H 1 3.988 0.030 . 1 . . . . 54 GLN HA . 10131 1 627 . 1 1 54 54 GLN HB2 H 1 1.810 0.030 . 2 . . . . 54 GLN HB2 . 10131 1 628 . 1 1 54 54 GLN HB3 H 1 1.694 0.030 . 2 . . . . 54 GLN HB3 . 10131 1 629 . 1 1 54 54 GLN HG2 H 1 2.279 0.030 . 2 . . . . 54 GLN HG2 . 10131 1 630 . 1 1 54 54 GLN HG3 H 1 2.213 0.030 . 2 . . . . 54 GLN HG3 . 10131 1 631 . 1 1 54 54 GLN HE21 H 1 7.463 0.030 . 2 . . . . 54 GLN HE21 . 10131 1 632 . 1 1 54 54 GLN HE22 H 1 6.824 0.030 . 2 . . . . 54 GLN HE22 . 10131 1 633 . 1 1 54 54 GLN C C 13 176.576 0.300 . 1 . . . . 54 GLN C . 10131 1 634 . 1 1 54 54 GLN CA C 13 57.819 0.300 . 1 . . . . 54 GLN CA . 10131 1 635 . 1 1 54 54 GLN CB C 13 28.750 0.300 . 1 . . . . 54 GLN CB . 10131 1 636 . 1 1 54 54 GLN CG C 13 34.089 0.300 . 1 . . . . 54 GLN CG . 10131 1 637 . 1 1 54 54 GLN N N 15 116.705 0.300 . 1 . . . . 54 GLN N . 10131 1 638 . 1 1 54 54 GLN NE2 N 15 112.069 0.300 . 1 . . . . 54 GLN NE2 . 10131 1 639 . 1 1 55 55 ASN H H 1 8.300 0.030 . 1 . . . . 55 ASN H . 10131 1 640 . 1 1 55 55 ASN HA H 1 4.770 0.030 . 1 . . . . 55 ASN HA . 10131 1 641 . 1 1 55 55 ASN HB2 H 1 2.549 0.030 . 2 . . . . 55 ASN HB2 . 10131 1 642 . 1 1 55 55 ASN HB3 H 1 2.960 0.030 . 2 . . . . 55 ASN HB3 . 10131 1 643 . 1 1 55 55 ASN HD21 H 1 7.600 0.030 . 2 . . . . 55 ASN HD21 . 10131 1 644 . 1 1 55 55 ASN HD22 H 1 6.837 0.030 . 2 . . . . 55 ASN HD22 . 10131 1 645 . 1 1 55 55 ASN C C 13 174.871 0.300 . 1 . . . . 55 ASN C . 10131 1 646 . 1 1 55 55 ASN CA C 13 52.430 0.300 . 1 . . . . 55 ASN CA . 10131 1 647 . 1 1 55 55 ASN CB C 13 39.470 0.300 . 1 . . . . 55 ASN CB . 10131 1 648 . 1 1 55 55 ASN N N 15 115.650 0.300 . 1 . . . . 55 ASN N . 10131 1 649 . 1 1 55 55 ASN ND2 N 15 111.788 0.300 . 1 . . . . 55 ASN ND2 . 10131 1 650 . 1 1 56 56 LEU H H 1 7.095 0.030 . 1 . . . . 56 LEU H . 10131 1 651 . 1 1 56 56 LEU HA H 1 4.510 0.030 . 1 . . . . 56 LEU HA . 10131 1 652 . 1 1 56 56 LEU HB2 H 1 1.690 0.030 . 2 . . . . 56 LEU HB2 . 10131 1 653 . 1 1 56 56 LEU HB3 H 1 1.559 0.030 . 2 . . . . 56 LEU HB3 . 10131 1 654 . 1 1 56 56 LEU HG H 1 1.480 0.030 . 1 . . . . 56 LEU HG . 10131 1 655 . 1 1 56 56 LEU HD11 H 1 0.890 0.030 . 1 . . . . 56 LEU HD1 . 10131 1 656 . 1 1 56 56 LEU HD12 H 1 0.890 0.030 . 1 . . . . 56 LEU HD1 . 10131 1 657 . 1 1 56 56 LEU HD13 H 1 0.890 0.030 . 1 . . . . 56 LEU HD1 . 10131 1 658 . 1 1 56 56 LEU HD21 H 1 0.860 0.030 . 1 . . . . 56 LEU HD2 . 10131 1 659 . 1 1 56 56 LEU HD22 H 1 0.860 0.030 . 1 . . . . 56 LEU HD2 . 10131 1 660 . 1 1 56 56 LEU HD23 H 1 0.860 0.030 . 1 . . . . 56 LEU HD2 . 10131 1 661 . 1 1 56 56 LEU C C 13 175.887 0.300 . 1 . . . . 56 LEU C . 10131 1 662 . 1 1 56 56 LEU CA C 13 53.181 0.300 . 1 . . . . 56 LEU CA . 10131 1 663 . 1 1 56 56 LEU CB C 13 44.222 0.300 . 1 . . . . 56 LEU CB . 10131 1 664 . 1 1 56 56 LEU CG C 13 26.119 0.300 . 1 . . . . 56 LEU CG . 10131 1 665 . 1 1 56 56 LEU CD1 C 13 26.058 0.300 . 2 . . . . 56 LEU CD1 . 10131 1 666 . 1 1 56 56 LEU CD2 C 13 23.114 0.300 . 2 . . . . 56 LEU CD2 . 10131 1 667 . 1 1 56 56 LEU N N 15 120.103 0.300 . 1 . . . . 56 LEU N . 10131 1 668 . 1 1 57 57 ALA H H 1 8.224 0.030 . 1 . . . . 57 ALA H . 10131 1 669 . 1 1 57 57 ALA HA H 1 4.216 0.030 . 1 . . . . 57 ALA HA . 10131 1 670 . 1 1 57 57 ALA HB1 H 1 1.380 0.030 . 1 . . . . 57 ALA HB . 10131 1 671 . 1 1 57 57 ALA HB2 H 1 1.380 0.030 . 1 . . . . 57 ALA HB . 10131 1 672 . 1 1 57 57 ALA HB3 H 1 1.380 0.030 . 1 . . . . 57 ALA HB . 10131 1 673 . 1 1 57 57 ALA C C 13 178.502 0.300 . 1 . . . . 57 ALA C . 10131 1 674 . 1 1 57 57 ALA CA C 13 52.267 0.300 . 1 . . . . 57 ALA CA . 10131 1 675 . 1 1 57 57 ALA CB C 13 19.088 0.300 . 1 . . . . 57 ALA CB . 10131 1 676 . 1 1 57 57 ALA N N 15 122.693 0.300 . 1 . . . . 57 ALA N . 10131 1 677 . 1 1 58 58 VAL H H 1 8.294 0.030 . 1 . . . . 58 VAL H . 10131 1 678 . 1 1 58 58 VAL HA H 1 3.820 0.030 . 1 . . . . 58 VAL HA . 10131 1 679 . 1 1 58 58 VAL HB H 1 1.980 0.030 . 1 . . . . 58 VAL HB . 10131 1 680 . 1 1 58 58 VAL HG11 H 1 1.038 0.030 . 1 . . . . 58 VAL HG1 . 10131 1 681 . 1 1 58 58 VAL HG12 H 1 1.038 0.030 . 1 . . . . 58 VAL HG1 . 10131 1 682 . 1 1 58 58 VAL HG13 H 1 1.038 0.030 . 1 . . . . 58 VAL HG1 . 10131 1 683 . 1 1 58 58 VAL HG21 H 1 0.933 0.030 . 1 . . . . 58 VAL HG2 . 10131 1 684 . 1 1 58 58 VAL HG22 H 1 0.933 0.030 . 1 . . . . 58 VAL HG2 . 10131 1 685 . 1 1 58 58 VAL HG23 H 1 0.933 0.030 . 1 . . . . 58 VAL HG2 . 10131 1 686 . 1 1 58 58 VAL C C 13 177.625 0.300 . 1 . . . . 58 VAL C . 10131 1 687 . 1 1 58 58 VAL CA C 13 64.165 0.300 . 1 . . . . 58 VAL CA . 10131 1 688 . 1 1 58 58 VAL CB C 13 31.755 0.300 . 1 . . . . 58 VAL CB . 10131 1 689 . 1 1 58 58 VAL CG1 C 13 21.589 0.300 . 2 . . . . 58 VAL CG1 . 10131 1 690 . 1 1 58 58 VAL CG2 C 13 20.801 0.300 . 2 . . . . 58 VAL CG2 . 10131 1 691 . 1 1 58 58 VAL N N 15 121.485 0.300 . 1 . . . . 58 VAL N . 10131 1 692 . 1 1 59 59 GLY H H 1 8.839 0.030 . 1 . . . . 59 GLY H . 10131 1 693 . 1 1 59 59 GLY HA2 H 1 4.110 0.030 . 2 . . . . 59 GLY HA2 . 10131 1 694 . 1 1 59 59 GLY HA3 H 1 3.746 0.030 . 2 . . . . 59 GLY HA3 . 10131 1 695 . 1 1 59 59 GLY C C 13 174.461 0.300 . 1 . . . . 59 GLY C . 10131 1 696 . 1 1 59 59 GLY CA C 13 45.171 0.300 . 1 . . . . 59 GLY CA . 10131 1 697 . 1 1 59 59 GLY N N 15 114.715 0.300 . 1 . . . . 59 GLY N . 10131 1 698 . 1 1 60 60 ALA H H 1 7.668 0.030 . 1 . . . . 60 ALA H . 10131 1 699 . 1 1 60 60 ALA HA H 1 4.259 0.030 . 1 . . . . 60 ALA HA . 10131 1 700 . 1 1 60 60 ALA HB1 H 1 1.522 0.030 . 1 . . . . 60 ALA HB . 10131 1 701 . 1 1 60 60 ALA HB2 H 1 1.522 0.030 . 1 . . . . 60 ALA HB . 10131 1 702 . 1 1 60 60 ALA HB3 H 1 1.522 0.030 . 1 . . . . 60 ALA HB . 10131 1 703 . 1 1 60 60 ALA C C 13 177.977 0.300 . 1 . . . . 60 ALA C . 10131 1 704 . 1 1 60 60 ALA CA C 13 53.122 0.300 . 1 . . . . 60 ALA CA . 10131 1 705 . 1 1 60 60 ALA CB C 13 20.217 0.300 . 1 . . . . 60 ALA CB . 10131 1 706 . 1 1 60 60 ALA N N 15 123.383 0.300 . 1 . . . . 60 ALA N . 10131 1 707 . 1 1 61 61 GLY H H 1 8.455 0.030 . 1 . . . . 61 GLY H . 10131 1 708 . 1 1 61 61 GLY HA2 H 1 3.749 0.030 . 2 . . . . 61 GLY HA2 . 10131 1 709 . 1 1 61 61 GLY HA3 H 1 4.334 0.030 . 2 . . . . 61 GLY HA3 . 10131 1 710 . 1 1 61 61 GLY C C 13 173.199 0.300 . 1 . . . . 61 GLY C . 10131 1 711 . 1 1 61 61 GLY CA C 13 44.346 0.300 . 1 . . . . 61 GLY CA . 10131 1 712 . 1 1 61 61 GLY N N 15 108.681 0.300 . 1 . . . . 61 GLY N . 10131 1 713 . 1 1 62 62 ALA H H 1 8.247 0.030 . 1 . . . . 62 ALA H . 10131 1 714 . 1 1 62 62 ALA HA H 1 3.351 0.030 . 1 . . . . 62 ALA HA . 10131 1 715 . 1 1 62 62 ALA HB1 H 1 0.838 0.030 . 1 . . . . 62 ALA HB . 10131 1 716 . 1 1 62 62 ALA HB2 H 1 0.838 0.030 . 1 . . . . 62 ALA HB . 10131 1 717 . 1 1 62 62 ALA HB3 H 1 0.838 0.030 . 1 . . . . 62 ALA HB . 10131 1 718 . 1 1 62 62 ALA C C 13 178.698 0.300 . 1 . . . . 62 ALA C . 10131 1 719 . 1 1 62 62 ALA CA C 13 52.784 0.300 . 1 . . . . 62 ALA CA . 10131 1 720 . 1 1 62 62 ALA CB C 13 18.060 0.300 . 1 . . . . 62 ALA CB . 10131 1 721 . 1 1 62 62 ALA N N 15 123.706 0.300 . 1 . . . . 62 ALA N . 10131 1 722 . 1 1 63 63 VAL H H 1 8.710 0.030 . 1 . . . . 63 VAL H . 10131 1 723 . 1 1 63 63 VAL HA H 1 4.150 0.030 . 1 . . . . 63 VAL HA . 10131 1 724 . 1 1 63 63 VAL HB H 1 2.180 0.030 . 1 . . . . 63 VAL HB . 10131 1 725 . 1 1 63 63 VAL HG11 H 1 0.980 0.030 . 1 . . . . 63 VAL HG1 . 10131 1 726 . 1 1 63 63 VAL HG12 H 1 0.980 0.030 . 1 . . . . 63 VAL HG1 . 10131 1 727 . 1 1 63 63 VAL HG13 H 1 0.980 0.030 . 1 . . . . 63 VAL HG1 . 10131 1 728 . 1 1 63 63 VAL HG21 H 1 0.752 0.030 . 1 . . . . 63 VAL HG2 . 10131 1 729 . 1 1 63 63 VAL HG22 H 1 0.752 0.030 . 1 . . . . 63 VAL HG2 . 10131 1 730 . 1 1 63 63 VAL HG23 H 1 0.752 0.030 . 1 . . . . 63 VAL HG2 . 10131 1 731 . 1 1 63 63 VAL C C 13 175.387 0.300 . 1 . . . . 63 VAL C . 10131 1 732 . 1 1 63 63 VAL CA C 13 61.441 0.300 . 1 . . . . 63 VAL CA . 10131 1 733 . 1 1 63 63 VAL CB C 13 32.108 0.300 . 1 . . . . 63 VAL CB . 10131 1 734 . 1 1 63 63 VAL CG1 C 13 22.118 0.300 . 2 . . . . 63 VAL CG1 . 10131 1 735 . 1 1 63 63 VAL CG2 C 13 20.000 0.300 . 2 . . . . 63 VAL CG2 . 10131 1 736 . 1 1 63 63 VAL N N 15 116.765 0.300 . 1 . . . . 63 VAL N . 10131 1 737 . 1 1 64 64 GLY H H 1 6.843 0.030 . 1 . . . . 64 GLY H . 10131 1 738 . 1 1 64 64 GLY HA2 H 1 3.463 0.030 . 2 . . . . 64 GLY HA2 . 10131 1 739 . 1 1 64 64 GLY HA3 H 1 1.820 0.030 . 2 . . . . 64 GLY HA3 . 10131 1 740 . 1 1 64 64 GLY C C 13 169.584 0.300 . 1 . . . . 64 GLY C . 10131 1 741 . 1 1 64 64 GLY CA C 13 43.608 0.300 . 1 . . . . 64 GLY CA . 10131 1 742 . 1 1 64 64 GLY N N 15 110.261 0.300 . 1 . . . . 64 GLY N . 10131 1 743 . 1 1 65 65 SER H H 1 6.950 0.030 . 1 . . . . 65 SER H . 10131 1 744 . 1 1 65 65 SER HA H 1 4.800 0.030 . 1 . . . . 65 SER HA . 10131 1 745 . 1 1 65 65 SER HB2 H 1 3.490 0.030 . 2 . . . . 65 SER HB2 . 10131 1 746 . 1 1 65 65 SER HB3 H 1 3.375 0.030 . 2 . . . . 65 SER HB3 . 10131 1 747 . 1 1 65 65 SER C C 13 172.895 0.300 . 1 . . . . 65 SER C . 10131 1 748 . 1 1 65 65 SER CA C 13 57.023 0.300 . 1 . . . . 65 SER CA . 10131 1 749 . 1 1 65 65 SER CB C 13 65.528 0.300 . 1 . . . . 65 SER CB . 10131 1 750 . 1 1 65 65 SER N N 15 110.607 0.300 . 1 . . . . 65 SER N . 10131 1 751 . 1 1 66 66 LEU H H 1 9.087 0.030 . 1 . . . . 66 LEU H . 10131 1 752 . 1 1 66 66 LEU HA H 1 4.800 0.030 . 1 . . . . 66 LEU HA . 10131 1 753 . 1 1 66 66 LEU HB2 H 1 1.830 0.030 . 2 . . . . 66 LEU HB2 . 10131 1 754 . 1 1 66 66 LEU HB3 H 1 1.570 0.030 . 2 . . . . 66 LEU HB3 . 10131 1 755 . 1 1 66 66 LEU HD11 H 1 0.729 0.030 . 1 . . . . 66 LEU HD1 . 10131 1 756 . 1 1 66 66 LEU HD12 H 1 0.729 0.030 . 1 . . . . 66 LEU HD1 . 10131 1 757 . 1 1 66 66 LEU HD13 H 1 0.729 0.030 . 1 . . . . 66 LEU HD1 . 10131 1 758 . 1 1 66 66 LEU HD21 H 1 0.990 0.030 . 1 . . . . 66 LEU HD2 . 10131 1 759 . 1 1 66 66 LEU HD22 H 1 0.990 0.030 . 1 . . . . 66 LEU HD2 . 10131 1 760 . 1 1 66 66 LEU HD23 H 1 0.990 0.030 . 1 . . . . 66 LEU HD2 . 10131 1 761 . 1 1 66 66 LEU C C 13 175.288 0.300 . 1 . . . . 66 LEU C . 10131 1 762 . 1 1 66 66 LEU CA C 13 53.696 0.300 . 1 . . . . 66 LEU CA . 10131 1 763 . 1 1 66 66 LEU CB C 13 46.275 0.300 . 1 . . . . 66 LEU CB . 10131 1 764 . 1 1 66 66 LEU CG C 13 26.800 0.300 . 1 . . . . 66 LEU CG . 10131 1 765 . 1 1 66 66 LEU CD1 C 13 26.162 0.300 . 2 . . . . 66 LEU CD1 . 10131 1 766 . 1 1 66 66 LEU CD2 C 13 23.955 0.300 . 2 . . . . 66 LEU CD2 . 10131 1 767 . 1 1 66 66 LEU N N 15 123.940 0.300 . 1 . . . . 66 LEU N . 10131 1 768 . 1 1 67 67 GLN H H 1 8.719 0.030 . 1 . . . . 67 GLN H . 10131 1 769 . 1 1 67 67 GLN HA H 1 4.620 0.030 . 1 . . . . 67 GLN HA . 10131 1 770 . 1 1 67 67 GLN HB2 H 1 1.936 0.030 . 2 . . . . 67 GLN HB2 . 10131 1 771 . 1 1 67 67 GLN HB3 H 1 1.720 0.030 . 2 . . . . 67 GLN HB3 . 10131 1 772 . 1 1 67 67 GLN HG2 H 1 2.414 0.030 . 2 . . . . 67 GLN HG2 . 10131 1 773 . 1 1 67 67 GLN HG3 H 1 2.298 0.030 . 2 . . . . 67 GLN HG3 . 10131 1 774 . 1 1 67 67 GLN HE21 H 1 7.275 0.030 . 2 . . . . 67 GLN HE21 . 10131 1 775 . 1 1 67 67 GLN HE22 H 1 6.804 0.030 . 2 . . . . 67 GLN HE22 . 10131 1 776 . 1 1 67 67 GLN C C 13 177.780 0.300 . 1 . . . . 67 GLN C . 10131 1 777 . 1 1 67 67 GLN CA C 13 56.450 0.300 . 1 . . . . 67 GLN CA . 10131 1 778 . 1 1 67 67 GLN CB C 13 28.918 0.300 . 1 . . . . 67 GLN CB . 10131 1 779 . 1 1 67 67 GLN CG C 13 34.367 0.300 . 1 . . . . 67 GLN CG . 10131 1 780 . 1 1 67 67 GLN N N 15 127.115 0.300 . 1 . . . . 67 GLN N . 10131 1 781 . 1 1 67 67 GLN NE2 N 15 111.550 0.300 . 1 . . . . 67 GLN NE2 . 10131 1 782 . 1 1 68 68 LEU H H 1 8.175 0.030 . 1 . . . . 68 LEU H . 10131 1 783 . 1 1 68 68 LEU HA H 1 3.909 0.030 . 1 . . . . 68 LEU HA . 10131 1 784 . 1 1 68 68 LEU HB2 H 1 1.340 0.030 . 2 . . . . 68 LEU HB2 . 10131 1 785 . 1 1 68 68 LEU HB3 H 1 1.814 0.030 . 2 . . . . 68 LEU HB3 . 10131 1 786 . 1 1 68 68 LEU HG H 1 1.389 0.030 . 1 . . . . 68 LEU HG . 10131 1 787 . 1 1 68 68 LEU HD11 H 1 0.834 0.030 . 1 . . . . 68 LEU HD1 . 10131 1 788 . 1 1 68 68 LEU HD12 H 1 0.834 0.030 . 1 . . . . 68 LEU HD1 . 10131 1 789 . 1 1 68 68 LEU HD13 H 1 0.834 0.030 . 1 . . . . 68 LEU HD1 . 10131 1 790 . 1 1 68 68 LEU HD21 H 1 0.764 0.030 . 1 . . . . 68 LEU HD2 . 10131 1 791 . 1 1 68 68 LEU HD22 H 1 0.764 0.030 . 1 . . . . 68 LEU HD2 . 10131 1 792 . 1 1 68 68 LEU HD23 H 1 0.764 0.030 . 1 . . . . 68 LEU HD2 . 10131 1 793 . 1 1 68 68 LEU C C 13 178.657 0.300 . 1 . . . . 68 LEU C . 10131 1 794 . 1 1 68 68 LEU CA C 13 57.775 0.300 . 1 . . . . 68 LEU CA . 10131 1 795 . 1 1 68 68 LEU CB C 13 40.338 0.300 . 1 . . . . 68 LEU CB . 10131 1 796 . 1 1 68 68 LEU CG C 13 27.425 0.300 . 1 . . . . 68 LEU CG . 10131 1 797 . 1 1 68 68 LEU CD1 C 13 26.174 0.300 . 2 . . . . 68 LEU CD1 . 10131 1 798 . 1 1 68 68 LEU CD2 C 13 23.049 0.300 . 2 . . . . 68 LEU CD2 . 10131 1 799 . 1 1 68 68 LEU N N 15 124.192 0.300 . 1 . . . . 68 LEU N . 10131 1 800 . 1 1 69 69 THR H H 1 7.617 0.030 . 1 . . . . 69 THR H . 10131 1 801 . 1 1 69 69 THR HA H 1 4.190 0.030 . 1 . . . . 69 THR HA . 10131 1 802 . 1 1 69 69 THR HB H 1 4.091 0.030 . 1 . . . . 69 THR HB . 10131 1 803 . 1 1 69 69 THR HG21 H 1 1.171 0.030 . 1 . . . . 69 THR HG2 . 10131 1 804 . 1 1 69 69 THR HG22 H 1 1.171 0.030 . 1 . . . . 69 THR HG2 . 10131 1 805 . 1 1 69 69 THR HG23 H 1 1.171 0.030 . 1 . . . . 69 THR HG2 . 10131 1 806 . 1 1 69 69 THR C C 13 175.355 0.300 . 1 . . . . 69 THR C . 10131 1 807 . 1 1 69 69 THR CA C 13 63.193 0.300 . 1 . . . . 69 THR CA . 10131 1 808 . 1 1 69 69 THR CB C 13 69.083 0.300 . 1 . . . . 69 THR CB . 10131 1 809 . 1 1 69 69 THR CG2 C 13 22.369 0.300 . 1 . . . . 69 THR CG2 . 10131 1 810 . 1 1 69 69 THR N N 15 107.314 0.300 . 1 . . . . 69 THR N . 10131 1 811 . 1 1 70 70 TYR H H 1 7.572 0.030 . 1 . . . . 70 TYR H . 10131 1 812 . 1 1 70 70 TYR HA H 1 4.842 0.030 . 1 . . . . 70 TYR HA . 10131 1 813 . 1 1 70 70 TYR HB2 H 1 3.510 0.030 . 2 . . . . 70 TYR HB2 . 10131 1 814 . 1 1 70 70 TYR HB3 H 1 3.191 0.030 . 2 . . . . 70 TYR HB3 . 10131 1 815 . 1 1 70 70 TYR HD1 H 1 7.188 0.030 . 1 . . . . 70 TYR HD1 . 10131 1 816 . 1 1 70 70 TYR HD2 H 1 7.188 0.030 . 1 . . . . 70 TYR HD2 . 10131 1 817 . 1 1 70 70 TYR HE1 H 1 6.880 0.030 . 1 . . . . 70 TYR HE1 . 10131 1 818 . 1 1 70 70 TYR HE2 H 1 6.880 0.030 . 1 . . . . 70 TYR HE2 . 10131 1 819 . 1 1 70 70 TYR C C 13 176.239 0.300 . 1 . . . . 70 TYR C . 10131 1 820 . 1 1 70 70 TYR CA C 13 56.272 0.300 . 1 . . . . 70 TYR CA . 10131 1 821 . 1 1 70 70 TYR CB C 13 37.921 0.300 . 1 . . . . 70 TYR CB . 10131 1 822 . 1 1 70 70 TYR CD1 C 13 131.943 0.300 . 1 . . . . 70 TYR CD1 . 10131 1 823 . 1 1 70 70 TYR CD2 C 13 131.943 0.300 . 1 . . . . 70 TYR CD2 . 10131 1 824 . 1 1 70 70 TYR CE1 C 13 118.420 0.300 . 1 . . . . 70 TYR CE1 . 10131 1 825 . 1 1 70 70 TYR CE2 C 13 118.420 0.300 . 1 . . . . 70 TYR CE2 . 10131 1 826 . 1 1 70 70 TYR N N 15 118.052 0.300 . 1 . . . . 70 TYR N . 10131 1 827 . 1 1 71 71 ILE H H 1 7.540 0.030 . 1 . . . . 71 ILE H . 10131 1 828 . 1 1 71 71 ILE HA H 1 4.125 0.030 . 1 . . . . 71 ILE HA . 10131 1 829 . 1 1 71 71 ILE HB H 1 2.110 0.030 . 1 . . . . 71 ILE HB . 10131 1 830 . 1 1 71 71 ILE HG12 H 1 1.929 0.030 . 2 . . . . 71 ILE HG12 . 10131 1 831 . 1 1 71 71 ILE HG13 H 1 0.840 0.030 . 2 . . . . 71 ILE HG13 . 10131 1 832 . 1 1 71 71 ILE HG21 H 1 0.839 0.030 . 1 . . . . 71 ILE HG2 . 10131 1 833 . 1 1 71 71 ILE HG22 H 1 0.839 0.030 . 1 . . . . 71 ILE HG2 . 10131 1 834 . 1 1 71 71 ILE HG23 H 1 0.839 0.030 . 1 . . . . 71 ILE HG2 . 10131 1 835 . 1 1 71 71 ILE HD11 H 1 0.892 0.030 . 1 . . . . 71 ILE HD1 . 10131 1 836 . 1 1 71 71 ILE HD12 H 1 0.892 0.030 . 1 . . . . 71 ILE HD1 . 10131 1 837 . 1 1 71 71 ILE HD13 H 1 0.892 0.030 . 1 . . . . 71 ILE HD1 . 10131 1 838 . 1 1 71 71 ILE C C 13 175.584 0.300 . 1 . . . . 71 ILE C . 10131 1 839 . 1 1 71 71 ILE CA C 13 63.237 0.300 . 1 . . . . 71 ILE CA . 10131 1 840 . 1 1 71 71 ILE CB C 13 38.258 0.300 . 1 . . . . 71 ILE CB . 10131 1 841 . 1 1 71 71 ILE CG1 C 13 28.189 0.300 . 1 . . . . 71 ILE CG1 . 10131 1 842 . 1 1 71 71 ILE CG2 C 13 17.460 0.300 . 1 . . . . 71 ILE CG2 . 10131 1 843 . 1 1 71 71 ILE CD1 C 13 14.313 0.300 . 1 . . . . 71 ILE CD1 . 10131 1 844 . 1 1 71 71 ILE N N 15 119.527 0.300 . 1 . . . . 71 ILE N . 10131 1 845 . 1 1 72 72 SER H H 1 9.141 0.030 . 1 . . . . 72 SER H . 10131 1 846 . 1 1 72 72 SER HA H 1 4.662 0.030 . 1 . . . . 72 SER HA . 10131 1 847 . 1 1 72 72 SER HB2 H 1 3.885 0.030 . 2 . . . . 72 SER HB2 . 10131 1 848 . 1 1 72 72 SER HB3 H 1 3.860 0.030 . 2 . . . . 72 SER HB3 . 10131 1 849 . 1 1 72 72 SER C C 13 174.846 0.300 . 1 . . . . 72 SER C . 10131 1 850 . 1 1 72 72 SER CA C 13 58.805 0.300 . 1 . . . . 72 SER CA . 10131 1 851 . 1 1 72 72 SER CB C 13 64.112 0.300 . 1 . . . . 72 SER CB . 10131 1 852 . 1 1 72 72 SER N N 15 123.157 0.300 . 1 . . . . 72 SER N . 10131 1 853 . 1 1 73 73 LYS H H 1 7.662 0.030 . 1 . . . . 73 LYS H . 10131 1 854 . 1 1 73 73 LYS HA H 1 4.510 0.030 . 1 . . . . 73 LYS HA . 10131 1 855 . 1 1 73 73 LYS HB2 H 1 1.940 0.030 . 2 . . . . 73 LYS HB2 . 10131 1 856 . 1 1 73 73 LYS HB3 H 1 1.763 0.030 . 2 . . . . 73 LYS HB3 . 10131 1 857 . 1 1 73 73 LYS HG2 H 1 1.365 0.030 . 2 . . . . 73 LYS HG2 . 10131 1 858 . 1 1 73 73 LYS HG3 H 1 1.437 0.030 . 2 . . . . 73 LYS HG3 . 10131 1 859 . 1 1 73 73 LYS HD2 H 1 1.674 0.030 . 1 . . . . 73 LYS HD2 . 10131 1 860 . 1 1 73 73 LYS HD3 H 1 1.674 0.030 . 1 . . . . 73 LYS HD3 . 10131 1 861 . 1 1 73 73 LYS HE2 H 1 2.974 0.030 . 1 . . . . 73 LYS HE2 . 10131 1 862 . 1 1 73 73 LYS HE3 H 1 2.974 0.030 . 1 . . . . 73 LYS HE3 . 10131 1 863 . 1 1 73 73 LYS C C 13 173.969 0.300 . 1 . . . . 73 LYS C . 10131 1 864 . 1 1 73 73 LYS CA C 13 57.023 0.300 . 1 . . . . 73 LYS CA . 10131 1 865 . 1 1 73 73 LYS CB C 13 35.760 0.300 . 1 . . . . 73 LYS CB . 10131 1 866 . 1 1 73 73 LYS CG C 13 24.718 0.300 . 1 . . . . 73 LYS CG . 10131 1 867 . 1 1 73 73 LYS CD C 13 29.230 0.300 . 1 . . . . 73 LYS CD . 10131 1 868 . 1 1 73 73 LYS CE C 13 42.072 0.300 . 1 . . . . 73 LYS CE . 10131 1 869 . 1 1 73 73 LYS N N 15 120.653 0.300 . 1 . . . . 73 LYS N . 10131 1 870 . 1 1 74 74 VAL H H 1 8.769 0.030 . 1 . . . . 74 VAL H . 10131 1 871 . 1 1 74 74 VAL HA H 1 5.160 0.030 . 1 . . . . 74 VAL HA . 10131 1 872 . 1 1 74 74 VAL HB H 1 2.083 0.030 . 1 . . . . 74 VAL HB . 10131 1 873 . 1 1 74 74 VAL HG11 H 1 1.024 0.030 . 1 . . . . 74 VAL HG1 . 10131 1 874 . 1 1 74 74 VAL HG12 H 1 1.024 0.030 . 1 . . . . 74 VAL HG1 . 10131 1 875 . 1 1 74 74 VAL HG13 H 1 1.024 0.030 . 1 . . . . 74 VAL HG1 . 10131 1 876 . 1 1 74 74 VAL HG21 H 1 0.989 0.030 . 1 . . . . 74 VAL HG2 . 10131 1 877 . 1 1 74 74 VAL HG22 H 1 0.989 0.030 . 1 . . . . 74 VAL HG2 . 10131 1 878 . 1 1 74 74 VAL HG23 H 1 0.989 0.030 . 1 . . . . 74 VAL HG2 . 10131 1 879 . 1 1 74 74 VAL C C 13 175.297 0.300 . 1 . . . . 74 VAL C . 10131 1 880 . 1 1 74 74 VAL CA C 13 61.472 0.300 . 1 . . . . 74 VAL CA . 10131 1 881 . 1 1 74 74 VAL CB C 13 33.070 0.300 . 1 . . . . 74 VAL CB . 10131 1 882 . 1 1 74 74 VAL CG1 C 13 22.484 0.300 . 1 . . . . 74 VAL CG1 . 10131 1 883 . 1 1 74 74 VAL CG2 C 13 22.484 0.300 . 1 . . . . 74 VAL CG2 . 10131 1 884 . 1 1 74 74 VAL N N 15 126.556 0.300 . 1 . . . . 74 VAL N . 10131 1 885 . 1 1 75 75 SER H H 1 8.835 0.030 . 1 . . . . 75 SER H . 10131 1 886 . 1 1 75 75 SER HA H 1 4.950 0.030 . 1 . . . . 75 SER HA . 10131 1 887 . 1 1 75 75 SER HB2 H 1 3.802 0.030 . 2 . . . . 75 SER HB2 . 10131 1 888 . 1 1 75 75 SER HB3 H 1 3.741 0.030 . 2 . . . . 75 SER HB3 . 10131 1 889 . 1 1 75 75 SER C C 13 172.904 0.300 . 1 . . . . 75 SER C . 10131 1 890 . 1 1 75 75 SER CA C 13 56.641 0.300 . 1 . . . . 75 SER CA . 10131 1 891 . 1 1 75 75 SER CB C 13 66.132 0.300 . 1 . . . . 75 SER CB . 10131 1 892 . 1 1 75 75 SER N N 15 120.102 0.300 . 1 . . . . 75 SER N . 10131 1 893 . 1 1 76 76 ILE H H 1 8.808 0.030 . 1 . . . . 76 ILE H . 10131 1 894 . 1 1 76 76 ILE HA H 1 4.186 0.030 . 1 . . . . 76 ILE HA . 10131 1 895 . 1 1 76 76 ILE HB H 1 1.889 0.030 . 1 . . . . 76 ILE HB . 10131 1 896 . 1 1 76 76 ILE HG12 H 1 1.745 0.030 . 2 . . . . 76 ILE HG12 . 10131 1 897 . 1 1 76 76 ILE HG13 H 1 1.142 0.030 . 2 . . . . 76 ILE HG13 . 10131 1 898 . 1 1 76 76 ILE HG21 H 1 1.186 0.030 . 1 . . . . 76 ILE HG2 . 10131 1 899 . 1 1 76 76 ILE HG22 H 1 1.186 0.030 . 1 . . . . 76 ILE HG2 . 10131 1 900 . 1 1 76 76 ILE HG23 H 1 1.186 0.030 . 1 . . . . 76 ILE HG2 . 10131 1 901 . 1 1 76 76 ILE HD11 H 1 0.966 0.030 . 1 . . . . 76 ILE HD1 . 10131 1 902 . 1 1 76 76 ILE HD12 H 1 0.966 0.030 . 1 . . . . 76 ILE HD1 . 10131 1 903 . 1 1 76 76 ILE HD13 H 1 0.966 0.030 . 1 . . . . 76 ILE HD1 . 10131 1 904 . 1 1 76 76 ILE C C 13 176.559 0.300 . 1 . . . . 76 ILE C . 10131 1 905 . 1 1 76 76 ILE CA C 13 63.119 0.300 . 1 . . . . 76 ILE CA . 10131 1 906 . 1 1 76 76 ILE CB C 13 38.442 0.300 . 1 . . . . 76 ILE CB . 10131 1 907 . 1 1 76 76 ILE CG1 C 13 29.230 0.300 . 1 . . . . 76 ILE CG1 . 10131 1 908 . 1 1 76 76 ILE CG2 C 13 17.734 0.300 . 1 . . . . 76 ILE CG2 . 10131 1 909 . 1 1 76 76 ILE CD1 C 13 13.100 0.300 . 1 . . . . 76 ILE CD1 . 10131 1 910 . 1 1 76 76 ILE N N 15 123.432 0.300 . 1 . . . . 76 ILE N . 10131 1 911 . 1 1 77 77 ALA H H 1 8.525 0.030 . 1 . . . . 77 ALA H . 10131 1 912 . 1 1 77 77 ALA HA H 1 4.550 0.030 . 1 . . . . 77 ALA HA . 10131 1 913 . 1 1 77 77 ALA HB1 H 1 1.329 0.030 . 1 . . . . 77 ALA HB . 10131 1 914 . 1 1 77 77 ALA HB2 H 1 1.329 0.030 . 1 . . . . 77 ALA HB . 10131 1 915 . 1 1 77 77 ALA HB3 H 1 1.329 0.030 . 1 . . . . 77 ALA HB . 10131 1 916 . 1 1 77 77 ALA C C 13 177.043 0.300 . 1 . . . . 77 ALA C . 10131 1 917 . 1 1 77 77 ALA CA C 13 52.282 0.300 . 1 . . . . 77 ALA CA . 10131 1 918 . 1 1 77 77 ALA CB C 13 19.649 0.300 . 1 . . . . 77 ALA CB . 10131 1 919 . 1 1 77 77 ALA N N 15 131.018 0.300 . 1 . . . . 77 ALA N . 10131 1 920 . 1 1 78 78 THR H H 1 8.538 0.030 . 1 . . . . 78 THR H . 10131 1 921 . 1 1 78 78 THR HA H 1 4.754 0.030 . 1 . . . . 78 THR HA . 10131 1 922 . 1 1 78 78 THR HB H 1 4.590 0.030 . 1 . . . . 78 THR HB . 10131 1 923 . 1 1 78 78 THR HG21 H 1 1.330 0.030 . 1 . . . . 78 THR HG2 . 10131 1 924 . 1 1 78 78 THR HG22 H 1 1.330 0.030 . 1 . . . . 78 THR HG2 . 10131 1 925 . 1 1 78 78 THR HG23 H 1 1.330 0.030 . 1 . . . . 78 THR HG2 . 10131 1 926 . 1 1 78 78 THR C C 13 174.125 0.300 . 1 . . . . 78 THR C . 10131 1 927 . 1 1 78 78 THR CA C 13 59.765 0.300 . 1 . . . . 78 THR CA . 10131 1 928 . 1 1 78 78 THR CB C 13 68.790 0.300 . 1 . . . . 78 THR CB . 10131 1 929 . 1 1 78 78 THR CG2 C 13 22.100 0.300 . 1 . . . . 78 THR CG2 . 10131 1 930 . 1 1 78 78 THR N N 15 114.371 0.300 . 1 . . . . 78 THR N . 10131 1 931 . 1 1 79 79 PRO HA H 1 4.227 0.030 . 1 . . . . 79 PRO HA . 10131 1 932 . 1 1 79 79 PRO HB2 H 1 2.336 0.030 . 2 . . . . 79 PRO HB2 . 10131 1 933 . 1 1 79 79 PRO HB3 H 1 1.881 0.030 . 2 . . . . 79 PRO HB3 . 10131 1 934 . 1 1 79 79 PRO HG2 H 1 1.970 0.030 . 2 . . . . 79 PRO HG2 . 10131 1 935 . 1 1 79 79 PRO HG3 H 1 2.110 0.030 . 2 . . . . 79 PRO HG3 . 10131 1 936 . 1 1 79 79 PRO HD2 H 1 3.901 0.030 . 2 . . . . 79 PRO HD2 . 10131 1 937 . 1 1 79 79 PRO HD3 H 1 3.830 0.030 . 2 . . . . 79 PRO HD3 . 10131 1 938 . 1 1 79 79 PRO C C 13 177.977 0.300 . 1 . . . . 79 PRO C . 10131 1 939 . 1 1 79 79 PRO CA C 13 64.698 0.300 . 1 . . . . 79 PRO CA . 10131 1 940 . 1 1 79 79 PRO CB C 13 31.920 0.300 . 1 . . . . 79 PRO CB . 10131 1 941 . 1 1 79 79 PRO CG C 13 27.842 0.300 . 1 . . . . 79 PRO CG . 10131 1 942 . 1 1 79 79 PRO CD C 13 50.888 0.300 . 1 . . . . 79 PRO CD . 10131 1 943 . 1 1 80 80 LYS H H 1 7.679 0.030 . 1 . . . . 80 LYS H . 10131 1 944 . 1 1 80 80 LYS HA H 1 4.070 0.030 . 1 . . . . 80 LYS HA . 10131 1 945 . 1 1 80 80 LYS HB2 H 1 1.762 0.030 . 1 . . . . 80 LYS HB2 . 10131 1 946 . 1 1 80 80 LYS HB3 H 1 1.762 0.030 . 1 . . . . 80 LYS HB3 . 10131 1 947 . 1 1 80 80 LYS HG2 H 1 1.450 0.030 . 2 . . . . 80 LYS HG2 . 10131 1 948 . 1 1 80 80 LYS HG3 H 1 1.400 0.030 . 2 . . . . 80 LYS HG3 . 10131 1 949 . 1 1 80 80 LYS C C 13 177.772 0.300 . 1 . . . . 80 LYS C . 10131 1 950 . 1 1 80 80 LYS CA C 13 57.690 0.300 . 1 . . . . 80 LYS CA . 10131 1 951 . 1 1 80 80 LYS CB C 13 32.548 0.300 . 1 . . . . 80 LYS CB . 10131 1 952 . 1 1 80 80 LYS CG C 13 25.204 0.300 . 1 . . . . 80 LYS CG . 10131 1 953 . 1 1 80 80 LYS CD C 13 28.952 0.300 . 1 . . . . 80 LYS CD . 10131 1 954 . 1 1 80 80 LYS CE C 13 42.142 0.300 . 1 . . . . 80 LYS CE . 10131 1 955 . 1 1 80 80 LYS N N 15 115.656 0.300 . 1 . . . . 80 LYS N . 10131 1 956 . 1 1 81 81 GLN H H 1 7.778 0.030 . 1 . . . . 81 GLN H . 10131 1 957 . 1 1 81 81 GLN HA H 1 4.150 0.030 . 1 . . . . 81 GLN HA . 10131 1 958 . 1 1 81 81 GLN HB2 H 1 2.050 0.030 . 2 . . . . 81 GLN HB2 . 10131 1 959 . 1 1 81 81 GLN HB3 H 1 2.269 0.030 . 2 . . . . 81 GLN HB3 . 10131 1 960 . 1 1 81 81 GLN HG2 H 1 2.408 0.030 . 1 . . . . 81 GLN HG2 . 10131 1 961 . 1 1 81 81 GLN HG3 H 1 2.408 0.030 . 1 . . . . 81 GLN HG3 . 10131 1 962 . 1 1 81 81 GLN HE21 H 1 7.644 0.030 . 2 . . . . 81 GLN HE21 . 10131 1 963 . 1 1 81 81 GLN HE22 H 1 6.718 0.030 . 2 . . . . 81 GLN HE22 . 10131 1 964 . 1 1 81 81 GLN C C 13 175.911 0.300 . 1 . . . . 81 GLN C . 10131 1 965 . 1 1 81 81 GLN CA C 13 57.215 0.300 . 1 . . . . 81 GLN CA . 10131 1 966 . 1 1 81 81 GLN CB C 13 29.580 0.300 . 1 . . . . 81 GLN CB . 10131 1 967 . 1 1 81 81 GLN CG C 13 34.783 0.300 . 1 . . . . 81 GLN CG . 10131 1 968 . 1 1 81 81 GLN N N 15 117.500 0.300 . 1 . . . . 81 GLN N . 10131 1 969 . 1 1 81 81 GLN NE2 N 15 111.077 0.300 . 1 . . . . 81 GLN NE2 . 10131 1 970 . 1 1 82 82 LYS H H 1 7.795 0.030 . 1 . . . . 82 LYS H . 10131 1 971 . 1 1 82 82 LYS HA H 1 4.440 0.030 . 1 . . . . 82 LYS HA . 10131 1 972 . 1 1 82 82 LYS HB2 H 1 1.752 0.030 . 2 . . . . 82 LYS HB2 . 10131 1 973 . 1 1 82 82 LYS HB3 H 1 1.580 0.030 . 2 . . . . 82 LYS HB3 . 10131 1 974 . 1 1 82 82 LYS HG2 H 1 1.330 0.030 . 2 . . . . 82 LYS HG2 . 10131 1 975 . 1 1 82 82 LYS HG3 H 1 1.102 0.030 . 2 . . . . 82 LYS HG3 . 10131 1 976 . 1 1 82 82 LYS HD2 H 1 1.511 0.030 . 2 . . . . 82 LYS HD2 . 10131 1 977 . 1 1 82 82 LYS HD3 H 1 1.528 0.030 . 2 . . . . 82 LYS HD3 . 10131 1 978 . 1 1 82 82 LYS HE2 H 1 2.334 0.030 . 2 . . . . 82 LYS HE2 . 10131 1 979 . 1 1 82 82 LYS HE3 H 1 2.460 0.030 . 2 . . . . 82 LYS HE3 . 10131 1 980 . 1 1 82 82 LYS C C 13 173.027 0.300 . 1 . . . . 82 LYS C . 10131 1 981 . 1 1 82 82 LYS CA C 13 53.387 0.300 . 1 . . . . 82 LYS CA . 10131 1 982 . 1 1 82 82 LYS CB C 13 32.258 0.300 . 1 . . . . 82 LYS CB . 10131 1 983 . 1 1 82 82 LYS CG C 13 24.423 0.300 . 1 . . . . 82 LYS CG . 10131 1 984 . 1 1 82 82 LYS CD C 13 28.893 0.300 . 1 . . . . 82 LYS CD . 10131 1 985 . 1 1 82 82 LYS CE C 13 41.595 0.300 . 1 . . . . 82 LYS CE . 10131 1 986 . 1 1 82 82 LYS N N 15 116.967 0.300 . 1 . . . . 82 LYS N . 10131 1 987 . 1 1 83 83 PRO HA H 1 4.458 0.030 . 1 . . . . 83 PRO HA . 10131 1 988 . 1 1 83 83 PRO HB2 H 1 2.231 0.030 . 2 . . . . 83 PRO HB2 . 10131 1 989 . 1 1 83 83 PRO HB3 H 1 2.005 0.030 . 2 . . . . 83 PRO HB3 . 10131 1 990 . 1 1 83 83 PRO HG2 H 1 1.929 0.030 . 2 . . . . 83 PRO HG2 . 10131 1 991 . 1 1 83 83 PRO HG3 H 1 1.875 0.030 . 2 . . . . 83 PRO HG3 . 10131 1 992 . 1 1 83 83 PRO HD2 H 1 3.411 0.030 . 2 . . . . 83 PRO HD2 . 10131 1 993 . 1 1 83 83 PRO HD3 H 1 3.550 0.030 . 2 . . . . 83 PRO HD3 . 10131 1 994 . 1 1 83 83 PRO C C 13 178.092 0.300 . 1 . . . . 83 PRO C . 10131 1 995 . 1 1 83 83 PRO CA C 13 63.801 0.300 . 1 . . . . 83 PRO CA . 10131 1 996 . 1 1 83 83 PRO CB C 13 32.409 0.300 . 1 . . . . 83 PRO CB . 10131 1 997 . 1 1 83 83 PRO CG C 13 27.147 0.300 . 1 . . . . 83 PRO CG . 10131 1 998 . 1 1 83 83 PRO CD C 13 50.541 0.300 . 1 . . . . 83 PRO CD . 10131 1 999 . 1 1 84 84 LYS H H 1 8.766 0.030 . 1 . . . . 84 LYS H . 10131 1 1000 . 1 1 84 84 LYS HA H 1 4.142 0.030 . 1 . . . . 84 LYS HA . 10131 1 1001 . 1 1 84 84 LYS HB2 H 1 1.900 0.030 . 2 . . . . 84 LYS HB2 . 10131 1 1002 . 1 1 84 84 LYS HB3 H 1 1.760 0.030 . 2 . . . . 84 LYS HB3 . 10131 1 1003 . 1 1 84 84 LYS HG2 H 1 1.400 0.030 . 2 . . . . 84 LYS HG2 . 10131 1 1004 . 1 1 84 84 LYS HG3 H 1 1.351 0.030 . 2 . . . . 84 LYS HG3 . 10131 1 1005 . 1 1 84 84 LYS HD2 H 1 1.639 0.030 . 1 . . . . 84 LYS HD2 . 10131 1 1006 . 1 1 84 84 LYS HD3 H 1 1.639 0.030 . 1 . . . . 84 LYS HD3 . 10131 1 1007 . 1 1 84 84 LYS HE2 H 1 2.956 0.030 . 1 . . . . 84 LYS HE2 . 10131 1 1008 . 1 1 84 84 LYS HE3 H 1 2.956 0.030 . 1 . . . . 84 LYS HE3 . 10131 1 1009 . 1 1 84 84 LYS C C 13 176.067 0.300 . 1 . . . . 84 LYS C . 10131 1 1010 . 1 1 84 84 LYS CA C 13 56.685 0.300 . 1 . . . . 84 LYS CA . 10131 1 1011 . 1 1 84 84 LYS CB C 13 32.353 0.300 . 1 . . . . 84 LYS CB . 10131 1 1012 . 1 1 84 84 LYS CG C 13 25.204 0.300 . 1 . . . . 84 LYS CG . 10131 1 1013 . 1 1 84 84 LYS CD C 13 29.022 0.300 . 1 . . . . 84 LYS CD . 10131 1 1014 . 1 1 84 84 LYS CE C 13 42.142 0.300 . 1 . . . . 84 LYS CE . 10131 1 1015 . 1 1 84 84 LYS N N 15 118.692 0.300 . 1 . . . . 84 LYS N . 10131 1 1016 . 1 1 85 85 THR H H 1 7.249 0.030 . 1 . . . . 85 THR H . 10131 1 1017 . 1 1 85 85 THR HA H 1 4.527 0.030 . 1 . . . . 85 THR HA . 10131 1 1018 . 1 1 85 85 THR HB H 1 3.910 0.030 . 1 . . . . 85 THR HB . 10131 1 1019 . 1 1 85 85 THR HG21 H 1 0.869 0.030 . 1 . . . . 85 THR HG2 . 10131 1 1020 . 1 1 85 85 THR HG22 H 1 0.869 0.030 . 1 . . . . 85 THR HG2 . 10131 1 1021 . 1 1 85 85 THR HG23 H 1 0.869 0.030 . 1 . . . . 85 THR HG2 . 10131 1 1022 . 1 1 85 85 THR C C 13 171.863 0.300 . 1 . . . . 85 THR C . 10131 1 1023 . 1 1 85 85 THR CA C 13 58.824 0.300 . 1 . . . . 85 THR CA . 10131 1 1024 . 1 1 85 85 THR CB C 13 69.994 0.300 . 1 . . . . 85 THR CB . 10131 1 1025 . 1 1 85 85 THR CG2 C 13 21.180 0.300 . 1 . . . . 85 THR CG2 . 10131 1 1026 . 1 1 85 85 THR N N 15 113.107 0.300 . 1 . . . . 85 THR N . 10131 1 1027 . 1 1 86 86 PRO HA H 1 4.170 0.030 . 1 . . . . 86 PRO HA . 10131 1 1028 . 1 1 86 86 PRO HB2 H 1 0.978 0.030 . 2 . . . . 86 PRO HB2 . 10131 1 1029 . 1 1 86 86 PRO HB3 H 1 1.748 0.030 . 2 . . . . 86 PRO HB3 . 10131 1 1030 . 1 1 86 86 PRO HG2 H 1 1.468 0.030 . 2 . . . . 86 PRO HG2 . 10131 1 1031 . 1 1 86 86 PRO HG3 H 1 1.638 0.030 . 2 . . . . 86 PRO HG3 . 10131 1 1032 . 1 1 86 86 PRO HD2 H 1 3.299 0.030 . 2 . . . . 86 PRO HD2 . 10131 1 1033 . 1 1 86 86 PRO HD3 H 1 3.470 0.030 . 2 . . . . 86 PRO HD3 . 10131 1 1034 . 1 1 86 86 PRO C C 13 175.944 0.300 . 1 . . . . 86 PRO C . 10131 1 1035 . 1 1 86 86 PRO CA C 13 62.747 0.300 . 1 . . . . 86 PRO CA . 10131 1 1036 . 1 1 86 86 PRO CB C 13 31.808 0.300 . 1 . . . . 86 PRO CB . 10131 1 1037 . 1 1 86 86 PRO CG C 13 26.662 0.300 . 1 . . . . 86 PRO CG . 10131 1 1038 . 1 1 86 86 PRO CD C 13 50.580 0.300 . 1 . . . . 86 PRO CD . 10131 1 1039 . 1 1 87 87 PHE H H 1 8.007 0.030 . 1 . . . . 87 PHE H . 10131 1 1040 . 1 1 87 87 PHE HA H 1 4.580 0.030 . 1 . . . . 87 PHE HA . 10131 1 1041 . 1 1 87 87 PHE HB2 H 1 2.953 0.030 . 2 . . . . 87 PHE HB2 . 10131 1 1042 . 1 1 87 87 PHE HB3 H 1 3.180 0.030 . 2 . . . . 87 PHE HB3 . 10131 1 1043 . 1 1 87 87 PHE HD1 H 1 7.051 0.030 . 1 . . . . 87 PHE HD1 . 10131 1 1044 . 1 1 87 87 PHE HD2 H 1 7.051 0.030 . 1 . . . . 87 PHE HD2 . 10131 1 1045 . 1 1 87 87 PHE HE1 H 1 7.370 0.030 . 1 . . . . 87 PHE HE1 . 10131 1 1046 . 1 1 87 87 PHE HE2 H 1 7.370 0.030 . 1 . . . . 87 PHE HE2 . 10131 1 1047 . 1 1 87 87 PHE HZ H 1 7.340 0.030 . 1 . . . . 87 PHE HZ . 10131 1 1048 . 1 1 87 87 PHE C C 13 174.101 0.300 . 1 . . . . 87 PHE C . 10131 1 1049 . 1 1 87 87 PHE CA C 13 56.125 0.300 . 1 . . . . 87 PHE CA . 10131 1 1050 . 1 1 87 87 PHE CB C 13 37.344 0.300 . 1 . . . . 87 PHE CB . 10131 1 1051 . 1 1 87 87 PHE CD1 C 13 131.405 0.300 . 1 . . . . 87 PHE CD1 . 10131 1 1052 . 1 1 87 87 PHE CD2 C 13 131.405 0.300 . 1 . . . . 87 PHE CD2 . 10131 1 1053 . 1 1 87 87 PHE CE1 C 13 131.567 0.300 . 1 . . . . 87 PHE CE1 . 10131 1 1054 . 1 1 87 87 PHE CE2 C 13 131.567 0.300 . 1 . . . . 87 PHE CE2 . 10131 1 1055 . 1 1 87 87 PHE CZ C 13 129.586 0.300 . 1 . . . . 87 PHE CZ . 10131 1 1056 . 1 1 87 87 PHE N N 15 115.484 0.300 . 1 . . . . 87 PHE N . 10131 1 1057 . 1 1 88 88 CYS H H 1 8.142 0.030 . 1 . . . . 88 CYS H . 10131 1 1058 . 1 1 88 88 CYS HA H 1 5.647 0.030 . 1 . . . . 88 CYS HA . 10131 1 1059 . 1 1 88 88 CYS HB2 H 1 2.839 0.030 . 2 . . . . 88 CYS HB2 . 10131 1 1060 . 1 1 88 88 CYS HB3 H 1 2.650 0.030 . 2 . . . . 88 CYS HB3 . 10131 1 1061 . 1 1 88 88 CYS C C 13 174.469 0.300 . 1 . . . . 88 CYS C . 10131 1 1062 . 1 1 88 88 CYS CA C 13 57.248 0.300 . 1 . . . . 88 CYS CA . 10131 1 1063 . 1 1 88 88 CYS CB C 13 29.641 0.300 . 1 . . . . 88 CYS CB . 10131 1 1064 . 1 1 88 88 CYS N N 15 118.916 0.300 . 1 . . . . 88 CYS N . 10131 1 1065 . 1 1 89 89 PHE H H 1 9.470 0.030 . 1 . . . . 89 PHE H . 10131 1 1066 . 1 1 89 89 PHE HA H 1 5.330 0.030 . 1 . . . . 89 PHE HA . 10131 1 1067 . 1 1 89 89 PHE HB2 H 1 2.877 0.030 . 2 . . . . 89 PHE HB2 . 10131 1 1068 . 1 1 89 89 PHE HB3 H 1 2.786 0.030 . 2 . . . . 89 PHE HB3 . 10131 1 1069 . 1 1 89 89 PHE HD1 H 1 6.820 0.030 . 1 . . . . 89 PHE HD1 . 10131 1 1070 . 1 1 89 89 PHE HD2 H 1 6.820 0.030 . 1 . . . . 89 PHE HD2 . 10131 1 1071 . 1 1 89 89 PHE HE1 H 1 6.610 0.030 . 1 . . . . 89 PHE HE1 . 10131 1 1072 . 1 1 89 89 PHE HE2 H 1 6.610 0.030 . 1 . . . . 89 PHE HE2 . 10131 1 1073 . 1 1 89 89 PHE HZ H 1 6.277 0.030 . 1 . . . . 89 PHE HZ . 10131 1 1074 . 1 1 89 89 PHE C C 13 170.904 0.300 . 1 . . . . 89 PHE C . 10131 1 1075 . 1 1 89 89 PHE CA C 13 55.301 0.300 . 1 . . . . 89 PHE CA . 10131 1 1076 . 1 1 89 89 PHE CB C 13 41.706 0.300 . 1 . . . . 89 PHE CB . 10131 1 1077 . 1 1 89 89 PHE CD1 C 13 132.451 0.300 . 1 . . . . 89 PHE CD1 . 10131 1 1078 . 1 1 89 89 PHE CD2 C 13 132.451 0.300 . 1 . . . . 89 PHE CD2 . 10131 1 1079 . 1 1 89 89 PHE CE1 C 13 129.923 0.300 . 1 . . . . 89 PHE CE1 . 10131 1 1080 . 1 1 89 89 PHE CE2 C 13 129.923 0.300 . 1 . . . . 89 PHE CE2 . 10131 1 1081 . 1 1 89 89 PHE CZ C 13 129.611 0.300 . 1 . . . . 89 PHE CZ . 10131 1 1082 . 1 1 89 89 PHE N N 15 123.459 0.300 . 1 . . . . 89 PHE N . 10131 1 1083 . 1 1 90 90 VAL H H 1 9.292 0.030 . 1 . . . . 90 VAL H . 10131 1 1084 . 1 1 90 90 VAL HA H 1 4.980 0.030 . 1 . . . . 90 VAL HA . 10131 1 1085 . 1 1 90 90 VAL HB H 1 1.750 0.030 . 1 . . . . 90 VAL HB . 10131 1 1086 . 1 1 90 90 VAL HG11 H 1 0.595 0.030 . 1 . . . . 90 VAL HG1 . 10131 1 1087 . 1 1 90 90 VAL HG12 H 1 0.595 0.030 . 1 . . . . 90 VAL HG1 . 10131 1 1088 . 1 1 90 90 VAL HG13 H 1 0.595 0.030 . 1 . . . . 90 VAL HG1 . 10131 1 1089 . 1 1 90 90 VAL HG21 H 1 0.498 0.030 . 1 . . . . 90 VAL HG2 . 10131 1 1090 . 1 1 90 90 VAL HG22 H 1 0.498 0.030 . 1 . . . . 90 VAL HG2 . 10131 1 1091 . 1 1 90 90 VAL HG23 H 1 0.498 0.030 . 1 . . . . 90 VAL HG2 . 10131 1 1092 . 1 1 90 90 VAL C C 13 175.788 0.300 . 1 . . . . 90 VAL C . 10131 1 1093 . 1 1 90 90 VAL CA C 13 59.055 0.300 . 1 . . . . 90 VAL CA . 10131 1 1094 . 1 1 90 90 VAL CB C 13 35.427 0.300 . 1 . . . . 90 VAL CB . 10131 1 1095 . 1 1 90 90 VAL CG1 C 13 20.393 0.300 . 2 . . . . 90 VAL CG1 . 10131 1 1096 . 1 1 90 90 VAL CG2 C 13 21.486 0.300 . 2 . . . . 90 VAL CG2 . 10131 1 1097 . 1 1 90 90 VAL N N 15 118.591 0.300 . 1 . . . . 90 VAL N . 10131 1 1098 . 1 1 91 91 ILE H H 1 8.968 0.030 . 1 . . . . 91 ILE H . 10131 1 1099 . 1 1 91 91 ILE HA H 1 4.524 0.030 . 1 . . . . 91 ILE HA . 10131 1 1100 . 1 1 91 91 ILE HB H 1 1.777 0.030 . 1 . . . . 91 ILE HB . 10131 1 1101 . 1 1 91 91 ILE HG12 H 1 0.953 0.030 . 2 . . . . 91 ILE HG12 . 10131 1 1102 . 1 1 91 91 ILE HG13 H 1 1.649 0.030 . 2 . . . . 91 ILE HG13 . 10131 1 1103 . 1 1 91 91 ILE HG21 H 1 0.870 0.030 . 1 . . . . 91 ILE HG2 . 10131 1 1104 . 1 1 91 91 ILE HG22 H 1 0.870 0.030 . 1 . . . . 91 ILE HG2 . 10131 1 1105 . 1 1 91 91 ILE HG23 H 1 0.870 0.030 . 1 . . . . 91 ILE HG2 . 10131 1 1106 . 1 1 91 91 ILE HD11 H 1 0.535 0.030 . 1 . . . . 91 ILE HD1 . 10131 1 1107 . 1 1 91 91 ILE HD12 H 1 0.535 0.030 . 1 . . . . 91 ILE HD1 . 10131 1 1108 . 1 1 91 91 ILE HD13 H 1 0.535 0.030 . 1 . . . . 91 ILE HD1 . 10131 1 1109 . 1 1 91 91 ILE C C 13 175.018 0.300 . 1 . . . . 91 ILE C . 10131 1 1110 . 1 1 91 91 ILE CA C 13 60.690 0.300 . 1 . . . . 91 ILE CA . 10131 1 1111 . 1 1 91 91 ILE CB C 13 40.926 0.300 . 1 . . . . 91 ILE CB . 10131 1 1112 . 1 1 91 91 ILE CG1 C 13 26.854 0.300 . 1 . . . . 91 ILE CG1 . 10131 1 1113 . 1 1 91 91 ILE CG2 C 13 18.304 0.300 . 1 . . . . 91 ILE CG2 . 10131 1 1114 . 1 1 91 91 ILE CD1 C 13 14.164 0.300 . 1 . . . . 91 ILE CD1 . 10131 1 1115 . 1 1 91 91 ILE N N 15 124.990 0.300 . 1 . . . . 91 ILE N . 10131 1 1116 . 1 1 92 92 ASN H H 1 8.927 0.030 . 1 . . . . 92 ASN H . 10131 1 1117 . 1 1 92 92 ASN HA H 1 5.119 0.030 . 1 . . . . 92 ASN HA . 10131 1 1118 . 1 1 92 92 ASN HB2 H 1 2.855 0.030 . 2 . . . . 92 ASN HB2 . 10131 1 1119 . 1 1 92 92 ASN HB3 H 1 2.787 0.030 . 2 . . . . 92 ASN HB3 . 10131 1 1120 . 1 1 92 92 ASN HD21 H 1 7.212 0.030 . 2 . . . . 92 ASN HD21 . 10131 1 1121 . 1 1 92 92 ASN HD22 H 1 6.794 0.030 . 2 . . . . 92 ASN HD22 . 10131 1 1122 . 1 1 92 92 ASN C C 13 173.486 0.300 . 1 . . . . 92 ASN C . 10131 1 1123 . 1 1 92 92 ASN CA C 13 53.195 0.300 . 1 . . . . 92 ASN CA . 10131 1 1124 . 1 1 92 92 ASN CB C 13 39.851 0.300 . 1 . . . . 92 ASN CB . 10131 1 1125 . 1 1 92 92 ASN N N 15 126.612 0.300 . 1 . . . . 92 ASN N . 10131 1 1126 . 1 1 92 92 ASN ND2 N 15 111.142 0.300 . 1 . . . . 92 ASN ND2 . 10131 1 1127 . 1 1 93 93 ALA H H 1 8.489 0.030 . 1 . . . . 93 ALA H . 10131 1 1128 . 1 1 93 93 ALA HA H 1 5.339 0.030 . 1 . . . . 93 ALA HA . 10131 1 1129 . 1 1 93 93 ALA HB1 H 1 1.551 0.030 . 1 . . . . 93 ALA HB . 10131 1 1130 . 1 1 93 93 ALA HB2 H 1 1.551 0.030 . 1 . . . . 93 ALA HB . 10131 1 1131 . 1 1 93 93 ALA HB3 H 1 1.551 0.030 . 1 . . . . 93 ALA HB . 10131 1 1132 . 1 1 93 93 ALA C C 13 176.494 0.300 . 1 . . . . 93 ALA C . 10131 1 1133 . 1 1 93 93 ALA CA C 13 51.068 0.300 . 1 . . . . 93 ALA CA . 10131 1 1134 . 1 1 93 93 ALA CB C 13 22.011 0.300 . 1 . . . . 93 ALA CB . 10131 1 1135 . 1 1 93 93 ALA N N 15 127.442 0.300 . 1 . . . . 93 ALA N . 10131 1 1136 . 1 1 94 94 LEU H H 1 8.517 0.030 . 1 . . . . 94 LEU H . 10131 1 1137 . 1 1 94 94 LEU HA H 1 4.041 0.030 . 1 . . . . 94 LEU HA . 10131 1 1138 . 1 1 94 94 LEU HB2 H 1 1.902 0.030 . 2 . . . . 94 LEU HB2 . 10131 1 1139 . 1 1 94 94 LEU HB3 H 1 1.606 0.030 . 2 . . . . 94 LEU HB3 . 10131 1 1140 . 1 1 94 94 LEU HG H 1 1.630 0.030 . 1 . . . . 94 LEU HG . 10131 1 1141 . 1 1 94 94 LEU HD11 H 1 0.779 0.030 . 1 . . . . 94 LEU HD1 . 10131 1 1142 . 1 1 94 94 LEU HD12 H 1 0.779 0.030 . 1 . . . . 94 LEU HD1 . 10131 1 1143 . 1 1 94 94 LEU HD13 H 1 0.779 0.030 . 1 . . . . 94 LEU HD1 . 10131 1 1144 . 1 1 94 94 LEU HD21 H 1 0.759 0.030 . 1 . . . . 94 LEU HD2 . 10131 1 1145 . 1 1 94 94 LEU HD22 H 1 0.759 0.030 . 1 . . . . 94 LEU HD2 . 10131 1 1146 . 1 1 94 94 LEU HD23 H 1 0.759 0.030 . 1 . . . . 94 LEU HD2 . 10131 1 1147 . 1 1 94 94 LEU C C 13 177.838 0.300 . 1 . . . . 94 LEU C . 10131 1 1148 . 1 1 94 94 LEU CA C 13 57.516 0.300 . 1 . . . . 94 LEU CA . 10131 1 1149 . 1 1 94 94 LEU CB C 13 40.472 0.300 . 1 . . . . 94 LEU CB . 10131 1 1150 . 1 1 94 94 LEU CG C 13 27.147 0.300 . 1 . . . . 94 LEU CG . 10131 1 1151 . 1 1 94 94 LEU CD1 C 13 24.977 0.300 . 2 . . . . 94 LEU CD1 . 10131 1 1152 . 1 1 94 94 LEU CD2 C 13 23.154 0.300 . 2 . . . . 94 LEU CD2 . 10131 1 1153 . 1 1 94 94 LEU N N 15 121.504 0.300 . 1 . . . . 94 LEU N . 10131 1 1154 . 1 1 95 95 SER H H 1 8.401 0.030 . 1 . . . . 95 SER H . 10131 1 1155 . 1 1 95 95 SER HA H 1 4.432 0.030 . 1 . . . . 95 SER HA . 10131 1 1156 . 1 1 95 95 SER HB2 H 1 3.950 0.030 . 2 . . . . 95 SER HB2 . 10131 1 1157 . 1 1 95 95 SER HB3 H 1 4.029 0.030 . 2 . . . . 95 SER HB3 . 10131 1 1158 . 1 1 95 95 SER C C 13 173.674 0.300 . 1 . . . . 95 SER C . 10131 1 1159 . 1 1 95 95 SER CA C 13 58.819 0.300 . 1 . . . . 95 SER CA . 10131 1 1160 . 1 1 95 95 SER CB C 13 63.520 0.300 . 1 . . . . 95 SER CB . 10131 1 1161 . 1 1 95 95 SER N N 15 112.517 0.300 . 1 . . . . 95 SER N . 10131 1 1162 . 1 1 96 96 GLN H H 1 7.685 0.030 . 1 . . . . 96 GLN H . 10131 1 1163 . 1 1 96 96 GLN HA H 1 4.478 0.030 . 1 . . . . 96 GLN HA . 10131 1 1164 . 1 1 96 96 GLN HB2 H 1 1.990 0.030 . 2 . . . . 96 GLN HB2 . 10131 1 1165 . 1 1 96 96 GLN HB3 H 1 1.831 0.030 . 2 . . . . 96 GLN HB3 . 10131 1 1166 . 1 1 96 96 GLN HG2 H 1 1.928 0.030 . 2 . . . . 96 GLN HG2 . 10131 1 1167 . 1 1 96 96 GLN HG3 H 1 2.096 0.030 . 2 . . . . 96 GLN HG3 . 10131 1 1168 . 1 1 96 96 GLN HE21 H 1 7.196 0.030 . 2 . . . . 96 GLN HE21 . 10131 1 1169 . 1 1 96 96 GLN HE22 H 1 6.843 0.030 . 2 . . . . 96 GLN HE22 . 10131 1 1170 . 1 1 96 96 GLN C C 13 173.412 0.300 . 1 . . . . 96 GLN C . 10131 1 1171 . 1 1 96 96 GLN CA C 13 54.915 0.300 . 1 . . . . 96 GLN CA . 10131 1 1172 . 1 1 96 96 GLN CB C 13 32.230 0.300 . 1 . . . . 96 GLN CB . 10131 1 1173 . 1 1 96 96 GLN CG C 13 33.519 0.300 . 1 . . . . 96 GLN CG . 10131 1 1174 . 1 1 96 96 GLN N N 15 119.210 0.300 . 1 . . . . 96 GLN N . 10131 1 1175 . 1 1 96 96 GLN NE2 N 15 112.013 0.300 . 1 . . . . 96 GLN NE2 . 10131 1 1176 . 1 1 97 97 ARG H H 1 8.163 0.030 . 1 . . . . 97 ARG H . 10131 1 1177 . 1 1 97 97 ARG HA H 1 5.115 0.030 . 1 . . . . 97 ARG HA . 10131 1 1178 . 1 1 97 97 ARG HB2 H 1 1.377 0.030 . 2 . . . . 97 ARG HB2 . 10131 1 1179 . 1 1 97 97 ARG HB3 H 1 1.584 0.030 . 2 . . . . 97 ARG HB3 . 10131 1 1180 . 1 1 97 97 ARG HG2 H 1 1.312 0.030 . 2 . . . . 97 ARG HG2 . 10131 1 1181 . 1 1 97 97 ARG HG3 H 1 1.448 0.030 . 2 . . . . 97 ARG HG3 . 10131 1 1182 . 1 1 97 97 ARG HD2 H 1 3.010 0.030 . 2 . . . . 97 ARG HD2 . 10131 1 1183 . 1 1 97 97 ARG HD3 H 1 3.064 0.030 . 2 . . . . 97 ARG HD3 . 10131 1 1184 . 1 1 97 97 ARG C C 13 174.863 0.300 . 1 . . . . 97 ARG C . 10131 1 1185 . 1 1 97 97 ARG CA C 13 54.725 0.300 . 1 . . . . 97 ARG CA . 10131 1 1186 . 1 1 97 97 ARG CB C 13 32.899 0.300 . 1 . . . . 97 ARG CB . 10131 1 1187 . 1 1 97 97 ARG CG C 13 27.147 0.300 . 1 . . . . 97 ARG CG . 10131 1 1188 . 1 1 97 97 ARG CD C 13 43.835 0.300 . 1 . . . . 97 ARG CD . 10131 1 1189 . 1 1 97 97 ARG N N 15 121.162 0.300 . 1 . . . . 97 ARG N . 10131 1 1190 . 1 1 98 98 TYR H H 1 8.733 0.030 . 1 . . . . 98 TYR H . 10131 1 1191 . 1 1 98 98 TYR HA H 1 4.858 0.030 . 1 . . . . 98 TYR HA . 10131 1 1192 . 1 1 98 98 TYR HB2 H 1 2.553 0.030 . 2 . . . . 98 TYR HB2 . 10131 1 1193 . 1 1 98 98 TYR HB3 H 1 2.476 0.030 . 2 . . . . 98 TYR HB3 . 10131 1 1194 . 1 1 98 98 TYR HD1 H 1 6.997 0.030 . 1 . . . . 98 TYR HD1 . 10131 1 1195 . 1 1 98 98 TYR HD2 H 1 6.997 0.030 . 1 . . . . 98 TYR HD2 . 10131 1 1196 . 1 1 98 98 TYR HE1 H 1 6.837 0.030 . 1 . . . . 98 TYR HE1 . 10131 1 1197 . 1 1 98 98 TYR HE2 H 1 6.837 0.030 . 1 . . . . 98 TYR HE2 . 10131 1 1198 . 1 1 98 98 TYR C C 13 173.855 0.300 . 1 . . . . 98 TYR C . 10131 1 1199 . 1 1 98 98 TYR CA C 13 56.302 0.300 . 1 . . . . 98 TYR CA . 10131 1 1200 . 1 1 98 98 TYR CB C 13 40.979 0.300 . 1 . . . . 98 TYR CB . 10131 1 1201 . 1 1 98 98 TYR CD1 C 13 132.976 0.300 . 1 . . . . 98 TYR CD1 . 10131 1 1202 . 1 1 98 98 TYR CD2 C 13 132.976 0.300 . 1 . . . . 98 TYR CD2 . 10131 1 1203 . 1 1 98 98 TYR CE1 C 13 118.001 0.300 . 1 . . . . 98 TYR CE1 . 10131 1 1204 . 1 1 98 98 TYR CE2 C 13 118.001 0.300 . 1 . . . . 98 TYR CE2 . 10131 1 1205 . 1 1 98 98 TYR N N 15 122.075 0.300 . 1 . . . . 98 TYR N . 10131 1 1206 . 1 1 99 99 PHE H H 1 8.983 0.030 . 1 . . . . 99 PHE H . 10131 1 1207 . 1 1 99 99 PHE HA H 1 4.892 0.030 . 1 . . . . 99 PHE HA . 10131 1 1208 . 1 1 99 99 PHE HB2 H 1 2.927 0.030 . 2 . . . . 99 PHE HB2 . 10131 1 1209 . 1 1 99 99 PHE HB3 H 1 2.773 0.030 . 2 . . . . 99 PHE HB3 . 10131 1 1210 . 1 1 99 99 PHE HD1 H 1 7.140 0.030 . 1 . . . . 99 PHE HD1 . 10131 1 1211 . 1 1 99 99 PHE HD2 H 1 7.140 0.030 . 1 . . . . 99 PHE HD2 . 10131 1 1212 . 1 1 99 99 PHE HE1 H 1 7.130 0.030 . 1 . . . . 99 PHE HE1 . 10131 1 1213 . 1 1 99 99 PHE HE2 H 1 7.130 0.030 . 1 . . . . 99 PHE HE2 . 10131 1 1214 . 1 1 99 99 PHE HZ H 1 7.124 0.030 . 1 . . . . 99 PHE HZ . 10131 1 1215 . 1 1 99 99 PHE C C 13 173.683 0.300 . 1 . . . . 99 PHE C . 10131 1 1216 . 1 1 99 99 PHE CA C 13 57.480 0.300 . 1 . . . . 99 PHE CA . 10131 1 1217 . 1 1 99 99 PHE CB C 13 41.226 0.300 . 1 . . . . 99 PHE CB . 10131 1 1218 . 1 1 99 99 PHE CD1 C 13 132.240 0.300 . 1 . . . . 99 PHE CD1 . 10131 1 1219 . 1 1 99 99 PHE CD2 C 13 132.240 0.300 . 1 . . . . 99 PHE CD2 . 10131 1 1220 . 1 1 99 99 PHE CE1 C 13 131.013 0.300 . 1 . . . . 99 PHE CE1 . 10131 1 1221 . 1 1 99 99 PHE CE2 C 13 131.013 0.300 . 1 . . . . 99 PHE CE2 . 10131 1 1222 . 1 1 99 99 PHE CZ C 13 129.217 0.300 . 1 . . . . 99 PHE CZ . 10131 1 1223 . 1 1 99 99 PHE N N 15 122.922 0.300 . 1 . . . . 99 PHE N . 10131 1 1224 . 1 1 100 100 LEU H H 1 8.630 0.030 . 1 . . . . 100 LEU H . 10131 1 1225 . 1 1 100 100 LEU HA H 1 5.207 0.030 . 1 . . . . 100 LEU HA . 10131 1 1226 . 1 1 100 100 LEU HB2 H 1 -0.437 0.030 . 2 . . . . 100 LEU HB2 . 10131 1 1227 . 1 1 100 100 LEU HB3 H 1 0.400 0.030 . 2 . . . . 100 LEU HB3 . 10131 1 1228 . 1 1 100 100 LEU HG H 1 0.840 0.030 . 1 . . . . 100 LEU HG . 10131 1 1229 . 1 1 100 100 LEU HD11 H 1 0.002 0.030 . 1 . . . . 100 LEU HD1 . 10131 1 1230 . 1 1 100 100 LEU HD12 H 1 0.002 0.030 . 1 . . . . 100 LEU HD1 . 10131 1 1231 . 1 1 100 100 LEU HD13 H 1 0.002 0.030 . 1 . . . . 100 LEU HD1 . 10131 1 1232 . 1 1 100 100 LEU HD21 H 1 -0.237 0.030 . 1 . . . . 100 LEU HD2 . 10131 1 1233 . 1 1 100 100 LEU HD22 H 1 -0.237 0.030 . 1 . . . . 100 LEU HD2 . 10131 1 1234 . 1 1 100 100 LEU HD23 H 1 -0.237 0.030 . 1 . . . . 100 LEU HD2 . 10131 1 1235 . 1 1 100 100 LEU C C 13 174.666 0.300 . 1 . . . . 100 LEU C . 10131 1 1236 . 1 1 100 100 LEU CA C 13 53.887 0.300 . 1 . . . . 100 LEU CA . 10131 1 1237 . 1 1 100 100 LEU CB C 13 44.022 0.300 . 1 . . . . 100 LEU CB . 10131 1 1238 . 1 1 100 100 LEU CG C 13 28.575 0.300 . 1 . . . . 100 LEU CG . 10131 1 1239 . 1 1 100 100 LEU CD1 C 13 25.443 0.300 . 2 . . . . 100 LEU CD1 . 10131 1 1240 . 1 1 100 100 LEU CD2 C 13 27.022 0.300 . 2 . . . . 100 LEU CD2 . 10131 1 1241 . 1 1 100 100 LEU N N 15 124.520 0.300 . 1 . . . . 100 LEU N . 10131 1 1242 . 1 1 101 101 GLN H H 1 9.189 0.030 . 1 . . . . 101 GLN H . 10131 1 1243 . 1 1 101 101 GLN HA H 1 4.846 0.030 . 1 . . . . 101 GLN HA . 10131 1 1244 . 1 1 101 101 GLN HB2 H 1 1.809 0.030 . 2 . . . . 101 GLN HB2 . 10131 1 1245 . 1 1 101 101 GLN HB3 H 1 1.426 0.030 . 2 . . . . 101 GLN HB3 . 10131 1 1246 . 1 1 101 101 GLN HG2 H 1 2.175 0.030 . 1 . . . . 101 GLN HG2 . 10131 1 1247 . 1 1 101 101 GLN HG3 H 1 2.175 0.030 . 1 . . . . 101 GLN HG3 . 10131 1 1248 . 1 1 101 101 GLN HE21 H 1 6.254 0.030 . 2 . . . . 101 GLN HE21 . 10131 1 1249 . 1 1 101 101 GLN HE22 H 1 7.111 0.030 . 2 . . . . 101 GLN HE22 . 10131 1 1250 . 1 1 101 101 GLN C C 13 175.445 0.300 . 1 . . . . 101 GLN C . 10131 1 1251 . 1 1 101 101 GLN CA C 13 54.550 0.300 . 1 . . . . 101 GLN CA . 10131 1 1252 . 1 1 101 101 GLN CB C 13 32.071 0.300 . 1 . . . . 101 GLN CB . 10131 1 1253 . 1 1 101 101 GLN CG C 13 34.089 0.300 . 1 . . . . 101 GLN CG . 10131 1 1254 . 1 1 101 101 GLN N N 15 119.400 0.300 . 1 . . . . 101 GLN N . 10131 1 1255 . 1 1 101 101 GLN NE2 N 15 109.257 0.300 . 1 . . . . 101 GLN NE2 . 10131 1 1256 . 1 1 102 102 ALA H H 1 8.899 0.030 . 1 . . . . 102 ALA H . 10131 1 1257 . 1 1 102 102 ALA HA H 1 4.800 0.030 . 1 . . . . 102 ALA HA . 10131 1 1258 . 1 1 102 102 ALA HB1 H 1 1.608 0.030 . 1 . . . . 102 ALA HB . 10131 1 1259 . 1 1 102 102 ALA HB2 H 1 1.608 0.030 . 1 . . . . 102 ALA HB . 10131 1 1260 . 1 1 102 102 ALA HB3 H 1 1.608 0.030 . 1 . . . . 102 ALA HB . 10131 1 1261 . 1 1 102 102 ALA C C 13 175.912 0.300 . 1 . . . . 102 ALA C . 10131 1 1262 . 1 1 102 102 ALA CA C 13 50.206 0.300 . 1 . . . . 102 ALA CA . 10131 1 1263 . 1 1 102 102 ALA CB C 13 20.266 0.300 . 1 . . . . 102 ALA CB . 10131 1 1264 . 1 1 102 102 ALA N N 15 128.669 0.300 . 1 . . . . 102 ALA N . 10131 1 1265 . 1 1 103 103 ASN H H 1 9.975 0.030 . 1 . . . . 103 ASN H . 10131 1 1266 . 1 1 103 103 ASN HA H 1 4.471 0.030 . 1 . . . . 103 ASN HA . 10131 1 1267 . 1 1 103 103 ASN HB2 H 1 2.776 0.030 . 2 . . . . 103 ASN HB2 . 10131 1 1268 . 1 1 103 103 ASN HB3 H 1 2.652 0.030 . 2 . . . . 103 ASN HB3 . 10131 1 1269 . 1 1 103 103 ASN HD21 H 1 6.915 0.030 . 2 . . . . 103 ASN HD21 . 10131 1 1270 . 1 1 103 103 ASN HD22 H 1 8.223 0.030 . 2 . . . . 103 ASN HD22 . 10131 1 1271 . 1 1 103 103 ASN C C 13 174.625 0.300 . 1 . . . . 103 ASN C . 10131 1 1272 . 1 1 103 103 ASN CA C 13 56.273 0.300 . 1 . . . . 103 ASN CA . 10131 1 1273 . 1 1 103 103 ASN CB C 13 40.947 0.300 . 1 . . . . 103 ASN CB . 10131 1 1274 . 1 1 103 103 ASN N N 15 115.728 0.300 . 1 . . . . 103 ASN N . 10131 1 1275 . 1 1 103 103 ASN ND2 N 15 116.412 0.300 . 1 . . . . 103 ASN ND2 . 10131 1 1276 . 1 1 104 104 ASP H H 1 7.498 0.030 . 1 . . . . 104 ASP H . 10131 1 1277 . 1 1 104 104 ASP HA H 1 3.096 0.030 . 1 . . . . 104 ASP HA . 10131 1 1278 . 1 1 104 104 ASP HB2 H 1 2.655 0.030 . 2 . . . . 104 ASP HB2 . 10131 1 1279 . 1 1 104 104 ASP HB3 H 1 2.837 0.030 . 2 . . . . 104 ASP HB3 . 10131 1 1280 . 1 1 104 104 ASP C C 13 174.560 0.300 . 1 . . . . 104 ASP C . 10131 1 1281 . 1 1 104 104 ASP CA C 13 52.050 0.300 . 1 . . . . 104 ASP CA . 10131 1 1282 . 1 1 104 104 ASP CB C 13 40.899 0.300 . 1 . . . . 104 ASP CB . 10131 1 1283 . 1 1 104 104 ASP N N 15 112.000 0.300 . 1 . . . . 104 ASP N . 10131 1 1284 . 1 1 105 105 GLN H H 1 8.182 0.030 . 1 . . . . 105 GLN H . 10131 1 1285 . 1 1 105 105 GLN HA H 1 3.755 0.030 . 1 . . . . 105 GLN HA . 10131 1 1286 . 1 1 105 105 GLN HB2 H 1 2.161 0.030 . 2 . . . . 105 GLN HB2 . 10131 1 1287 . 1 1 105 105 GLN HB3 H 1 2.000 0.030 . 2 . . . . 105 GLN HB3 . 10131 1 1288 . 1 1 105 105 GLN HG2 H 1 2.475 0.030 . 1 . . . . 105 GLN HG2 . 10131 1 1289 . 1 1 105 105 GLN HG3 H 1 2.475 0.030 . 1 . . . . 105 GLN HG3 . 10131 1 1290 . 1 1 105 105 GLN HE21 H 1 7.520 0.030 . 2 . . . . 105 GLN HE21 . 10131 1 1291 . 1 1 105 105 GLN HE22 H 1 6.908 0.030 . 2 . . . . 105 GLN HE22 . 10131 1 1292 . 1 1 105 105 GLN C C 13 177.043 0.300 . 1 . . . . 105 GLN C . 10131 1 1293 . 1 1 105 105 GLN CA C 13 59.158 0.300 . 1 . . . . 105 GLN CA . 10131 1 1294 . 1 1 105 105 GLN CB C 13 28.638 0.300 . 1 . . . . 105 GLN CB . 10131 1 1295 . 1 1 105 105 GLN CG C 13 33.603 0.300 . 1 . . . . 105 GLN CG . 10131 1 1296 . 1 1 105 105 GLN N N 15 117.589 0.300 . 1 . . . . 105 GLN N . 10131 1 1297 . 1 1 105 105 GLN NE2 N 15 111.097 0.300 . 1 . . . . 105 GLN NE2 . 10131 1 1298 . 1 1 106 106 LYS H H 1 7.946 0.030 . 1 . . . . 106 LYS H . 10131 1 1299 . 1 1 106 106 LYS HA H 1 3.975 0.030 . 1 . . . . 106 LYS HA . 10131 1 1300 . 1 1 106 106 LYS HB2 H 1 1.900 0.030 . 2 . . . . 106 LYS HB2 . 10131 1 1301 . 1 1 106 106 LYS HB3 H 1 1.780 0.030 . 2 . . . . 106 LYS HB3 . 10131 1 1302 . 1 1 106 106 LYS HG2 H 1 1.418 0.030 . 1 . . . . 106 LYS HG2 . 10131 1 1303 . 1 1 106 106 LYS HG3 H 1 1.418 0.030 . 1 . . . . 106 LYS HG3 . 10131 1 1304 . 1 1 106 106 LYS C C 13 177.387 0.300 . 1 . . . . 106 LYS C . 10131 1 1305 . 1 1 106 106 LYS CA C 13 59.276 0.300 . 1 . . . . 106 LYS CA . 10131 1 1306 . 1 1 106 106 LYS CB C 13 32.139 0.300 . 1 . . . . 106 LYS CB . 10131 1 1307 . 1 1 106 106 LYS CG C 13 24.926 0.300 . 1 . . . . 106 LYS CG . 10131 1 1308 . 1 1 106 106 LYS CD C 13 28.883 0.300 . 1 . . . . 106 LYS CD . 10131 1 1309 . 1 1 106 106 LYS CE C 13 42.489 0.300 . 1 . . . . 106 LYS CE . 10131 1 1310 . 1 1 106 106 LYS N N 15 122.099 0.300 . 1 . . . . 106 LYS N . 10131 1 1311 . 1 1 107 107 ASP H H 1 8.521 0.030 . 1 . . . . 107 ASP H . 10131 1 1312 . 1 1 107 107 ASP HA H 1 4.420 0.030 . 1 . . . . 107 ASP HA . 10131 1 1313 . 1 1 107 107 ASP HB2 H 1 2.940 0.030 . 2 . . . . 107 ASP HB2 . 10131 1 1314 . 1 1 107 107 ASP HB3 H 1 2.688 0.030 . 2 . . . . 107 ASP HB3 . 10131 1 1315 . 1 1 107 107 ASP C C 13 177.674 0.300 . 1 . . . . 107 ASP C . 10131 1 1316 . 1 1 107 107 ASP CA C 13 57.156 0.300 . 1 . . . . 107 ASP CA . 10131 1 1317 . 1 1 107 107 ASP CB C 13 42.409 0.300 . 1 . . . . 107 ASP CB . 10131 1 1318 . 1 1 107 107 ASP N N 15 120.297 0.300 . 1 . . . . 107 ASP N . 10131 1 1319 . 1 1 108 108 LEU H H 1 7.678 0.030 . 1 . . . . 108 LEU H . 10131 1 1320 . 1 1 108 108 LEU HA H 1 3.718 0.030 . 1 . . . . 108 LEU HA . 10131 1 1321 . 1 1 108 108 LEU HB2 H 1 2.160 0.030 . 2 . . . . 108 LEU HB2 . 10131 1 1322 . 1 1 108 108 LEU HB3 H 1 1.501 0.030 . 2 . . . . 108 LEU HB3 . 10131 1 1323 . 1 1 108 108 LEU HG H 1 1.430 0.030 . 1 . . . . 108 LEU HG . 10131 1 1324 . 1 1 108 108 LEU HD11 H 1 1.112 0.030 . 1 . . . . 108 LEU HD1 . 10131 1 1325 . 1 1 108 108 LEU HD12 H 1 1.112 0.030 . 1 . . . . 108 LEU HD1 . 10131 1 1326 . 1 1 108 108 LEU HD13 H 1 1.112 0.030 . 1 . . . . 108 LEU HD1 . 10131 1 1327 . 1 1 108 108 LEU HD21 H 1 0.934 0.030 . 1 . . . . 108 LEU HD2 . 10131 1 1328 . 1 1 108 108 LEU HD22 H 1 0.934 0.030 . 1 . . . . 108 LEU HD2 . 10131 1 1329 . 1 1 108 108 LEU HD23 H 1 0.934 0.030 . 1 . . . . 108 LEU HD2 . 10131 1 1330 . 1 1 108 108 LEU C C 13 176.469 0.300 . 1 . . . . 108 LEU C . 10131 1 1331 . 1 1 108 108 LEU CA C 13 58.629 0.300 . 1 . . . . 108 LEU CA . 10131 1 1332 . 1 1 108 108 LEU CB C 13 42.847 0.300 . 1 . . . . 108 LEU CB . 10131 1 1333 . 1 1 108 108 LEU CG C 13 26.800 0.300 . 1 . . . . 108 LEU CG . 10131 1 1334 . 1 1 108 108 LEU CD1 C 13 26.780 0.300 . 2 . . . . 108 LEU CD1 . 10131 1 1335 . 1 1 108 108 LEU CD2 C 13 25.447 0.300 . 2 . . . . 108 LEU CD2 . 10131 1 1336 . 1 1 108 108 LEU N N 15 117.138 0.300 . 1 . . . . 108 LEU N . 10131 1 1337 . 1 1 109 109 LYS H H 1 7.721 0.030 . 1 . . . . 109 LYS H . 10131 1 1338 . 1 1 109 109 LYS HA H 1 3.717 0.030 . 1 . . . . 109 LYS HA . 10131 1 1339 . 1 1 109 109 LYS HB2 H 1 1.921 0.030 . 1 . . . . 109 LYS HB2 . 10131 1 1340 . 1 1 109 109 LYS HB3 H 1 1.921 0.030 . 1 . . . . 109 LYS HB3 . 10131 1 1341 . 1 1 109 109 LYS HG2 H 1 1.420 0.030 . 2 . . . . 109 LYS HG2 . 10131 1 1342 . 1 1 109 109 LYS HG3 H 1 1.569 0.030 . 2 . . . . 109 LYS HG3 . 10131 1 1343 . 1 1 109 109 LYS C C 13 178.804 0.300 . 1 . . . . 109 LYS C . 10131 1 1344 . 1 1 109 109 LYS CA C 13 59.687 0.300 . 1 . . . . 109 LYS CA . 10131 1 1345 . 1 1 109 109 LYS CB C 13 32.383 0.300 . 1 . . . . 109 LYS CB . 10131 1 1346 . 1 1 109 109 LYS CG C 13 24.996 0.300 . 1 . . . . 109 LYS CG . 10131 1 1347 . 1 1 109 109 LYS CD C 13 29.508 0.300 . 1 . . . . 109 LYS CD . 10131 1 1348 . 1 1 109 109 LYS CE C 13 42.072 0.300 . 1 . . . . 109 LYS CE . 10131 1 1349 . 1 1 109 109 LYS N N 15 117.567 0.300 . 1 . . . . 109 LYS N . 10131 1 1350 . 1 1 110 110 ASP H H 1 8.603 0.030 . 1 . . . . 110 ASP H . 10131 1 1351 . 1 1 110 110 ASP HA H 1 4.220 0.030 . 1 . . . . 110 ASP HA . 10131 1 1352 . 1 1 110 110 ASP HB2 H 1 2.255 0.030 . 2 . . . . 110 ASP HB2 . 10131 1 1353 . 1 1 110 110 ASP HB3 H 1 2.740 0.030 . 2 . . . . 110 ASP HB3 . 10131 1 1354 . 1 1 110 110 ASP C C 13 179.919 0.300 . 1 . . . . 110 ASP C . 10131 1 1355 . 1 1 110 110 ASP CA C 13 57.215 0.300 . 1 . . . . 110 ASP CA . 10131 1 1356 . 1 1 110 110 ASP CB C 13 39.754 0.300 . 1 . . . . 110 ASP CB . 10131 1 1357 . 1 1 110 110 ASP N N 15 119.028 0.300 . 1 . . . . 110 ASP N . 10131 1 1358 . 1 1 111 111 TRP H H 1 8.141 0.030 . 1 . . . . 111 TRP H . 10131 1 1359 . 1 1 111 111 TRP HA H 1 3.962 0.030 . 1 . . . . 111 TRP HA . 10131 1 1360 . 1 1 111 111 TRP HB2 H 1 2.800 0.030 . 2 . . . . 111 TRP HB2 . 10131 1 1361 . 1 1 111 111 TRP HB3 H 1 2.552 0.030 . 2 . . . . 111 TRP HB3 . 10131 1 1362 . 1 1 111 111 TRP HD1 H 1 7.333 0.030 . 1 . . . . 111 TRP HD1 . 10131 1 1363 . 1 1 111 111 TRP HE1 H 1 10.161 0.030 . 1 . . . . 111 TRP HE1 . 10131 1 1364 . 1 1 111 111 TRP HE3 H 1 7.209 0.030 . 1 . . . . 111 TRP HE3 . 10131 1 1365 . 1 1 111 111 TRP HZ2 H 1 6.832 0.030 . 1 . . . . 111 TRP HZ2 . 10131 1 1366 . 1 1 111 111 TRP HZ3 H 1 6.665 0.030 . 1 . . . . 111 TRP HZ3 . 10131 1 1367 . 1 1 111 111 TRP HH2 H 1 6.663 0.030 . 1 . . . . 111 TRP HH2 . 10131 1 1368 . 1 1 111 111 TRP C C 13 178.452 0.300 . 1 . . . . 111 TRP C . 10131 1 1369 . 1 1 111 111 TRP CA C 13 61.956 0.300 . 1 . . . . 111 TRP CA . 10131 1 1370 . 1 1 111 111 TRP CB C 13 29.666 0.300 . 1 . . . . 111 TRP CB . 10131 1 1371 . 1 1 111 111 TRP CD1 C 13 128.082 0.300 . 1 . . . . 111 TRP CD1 . 10131 1 1372 . 1 1 111 111 TRP CE3 C 13 118.565 0.300 . 1 . . . . 111 TRP CE3 . 10131 1 1373 . 1 1 111 111 TRP CZ2 C 13 113.670 0.300 . 1 . . . . 111 TRP CZ2 . 10131 1 1374 . 1 1 111 111 TRP CZ3 C 13 120.670 0.300 . 1 . . . . 111 TRP CZ3 . 10131 1 1375 . 1 1 111 111 TRP CH2 C 13 124.104 0.300 . 1 . . . . 111 TRP CH2 . 10131 1 1376 . 1 1 111 111 TRP N N 15 120.780 0.300 . 1 . . . . 111 TRP N . 10131 1 1377 . 1 1 111 111 TRP NE1 N 15 128.632 0.300 . 1 . . . . 111 TRP NE1 . 10131 1 1378 . 1 1 112 112 VAL H H 1 8.054 0.030 . 1 . . . . 112 VAL H . 10131 1 1379 . 1 1 112 112 VAL HA H 1 3.109 0.030 . 1 . . . . 112 VAL HA . 10131 1 1380 . 1 1 112 112 VAL HB H 1 1.885 0.030 . 1 . . . . 112 VAL HB . 10131 1 1381 . 1 1 112 112 VAL HG11 H 1 0.719 0.030 . 1 . . . . 112 VAL HG1 . 10131 1 1382 . 1 1 112 112 VAL HG12 H 1 0.719 0.030 . 1 . . . . 112 VAL HG1 . 10131 1 1383 . 1 1 112 112 VAL HG13 H 1 0.719 0.030 . 1 . . . . 112 VAL HG1 . 10131 1 1384 . 1 1 112 112 VAL HG21 H 1 0.429 0.030 . 1 . . . . 112 VAL HG2 . 10131 1 1385 . 1 1 112 112 VAL HG22 H 1 0.429 0.030 . 1 . . . . 112 VAL HG2 . 10131 1 1386 . 1 1 112 112 VAL HG23 H 1 0.429 0.030 . 1 . . . . 112 VAL HG2 . 10131 1 1387 . 1 1 112 112 VAL C C 13 178.428 0.300 . 1 . . . . 112 VAL C . 10131 1 1388 . 1 1 112 112 VAL CA C 13 67.477 0.300 . 1 . . . . 112 VAL CA . 10131 1 1389 . 1 1 112 112 VAL CB C 13 31.549 0.300 . 1 . . . . 112 VAL CB . 10131 1 1390 . 1 1 112 112 VAL CG1 C 13 21.080 0.300 . 2 . . . . 112 VAL CG1 . 10131 1 1391 . 1 1 112 112 VAL CG2 C 13 23.672 0.300 . 2 . . . . 112 VAL CG2 . 10131 1 1392 . 1 1 112 112 VAL N N 15 118.696 0.300 . 1 . . . . 112 VAL N . 10131 1 1393 . 1 1 113 113 GLU H H 1 8.313 0.030 . 1 . . . . 113 GLU H . 10131 1 1394 . 1 1 113 113 GLU HA H 1 4.108 0.030 . 1 . . . . 113 GLU HA . 10131 1 1395 . 1 1 113 113 GLU HB2 H 1 1.960 0.030 . 2 . . . . 113 GLU HB2 . 10131 1 1396 . 1 1 113 113 GLU HB3 H 1 2.092 0.030 . 2 . . . . 113 GLU HB3 . 10131 1 1397 . 1 1 113 113 GLU HG2 H 1 2.247 0.030 . 2 . . . . 113 GLU HG2 . 10131 1 1398 . 1 1 113 113 GLU HG3 H 1 2.401 0.030 . 2 . . . . 113 GLU HG3 . 10131 1 1399 . 1 1 113 113 GLU C C 13 179.321 0.300 . 1 . . . . 113 GLU C . 10131 1 1400 . 1 1 113 113 GLU CA C 13 59.455 0.300 . 1 . . . . 113 GLU CA . 10131 1 1401 . 1 1 113 113 GLU CB C 13 29.336 0.300 . 1 . . . . 113 GLU CB . 10131 1 1402 . 1 1 113 113 GLU CG C 13 36.434 0.300 . 1 . . . . 113 GLU CG . 10131 1 1403 . 1 1 113 113 GLU N N 15 118.100 0.300 . 1 . . . . 113 GLU N . 10131 1 1404 . 1 1 114 114 ALA H H 1 7.936 0.030 . 1 . . . . 114 ALA H . 10131 1 1405 . 1 1 114 114 ALA HA H 1 4.037 0.030 . 1 . . . . 114 ALA HA . 10131 1 1406 . 1 1 114 114 ALA HB1 H 1 1.290 0.030 . 1 . . . . 114 ALA HB . 10131 1 1407 . 1 1 114 114 ALA HB2 H 1 1.290 0.030 . 1 . . . . 114 ALA HB . 10131 1 1408 . 1 1 114 114 ALA HB3 H 1 1.290 0.030 . 1 . . . . 114 ALA HB . 10131 1 1409 . 1 1 114 114 ALA C C 13 181.346 0.300 . 1 . . . . 114 ALA C . 10131 1 1410 . 1 1 114 114 ALA CA C 13 55.201 0.300 . 1 . . . . 114 ALA CA . 10131 1 1411 . 1 1 114 114 ALA CB C 13 18.897 0.300 . 1 . . . . 114 ALA CB . 10131 1 1412 . 1 1 114 114 ALA N N 15 120.800 0.300 . 1 . . . . 114 ALA N . 10131 1 1413 . 1 1 115 115 LEU H H 1 8.553 0.030 . 1 . . . . 115 LEU H . 10131 1 1414 . 1 1 115 115 LEU HA H 1 4.048 0.030 . 1 . . . . 115 LEU HA . 10131 1 1415 . 1 1 115 115 LEU HB2 H 1 2.072 0.030 . 2 . . . . 115 LEU HB2 . 10131 1 1416 . 1 1 115 115 LEU HB3 H 1 1.340 0.030 . 2 . . . . 115 LEU HB3 . 10131 1 1417 . 1 1 115 115 LEU HG H 1 2.120 0.030 . 1 . . . . 115 LEU HG . 10131 1 1418 . 1 1 115 115 LEU HD11 H 1 0.994 0.030 . 1 . . . . 115 LEU HD1 . 10131 1 1419 . 1 1 115 115 LEU HD12 H 1 0.994 0.030 . 1 . . . . 115 LEU HD1 . 10131 1 1420 . 1 1 115 115 LEU HD13 H 1 0.994 0.030 . 1 . . . . 115 LEU HD1 . 10131 1 1421 . 1 1 115 115 LEU HD21 H 1 1.007 0.030 . 1 . . . . 115 LEU HD2 . 10131 1 1422 . 1 1 115 115 LEU HD22 H 1 1.007 0.030 . 1 . . . . 115 LEU HD2 . 10131 1 1423 . 1 1 115 115 LEU HD23 H 1 1.007 0.030 . 1 . . . . 115 LEU HD2 . 10131 1 1424 . 1 1 115 115 LEU C C 13 179.346 0.300 . 1 . . . . 115 LEU C . 10131 1 1425 . 1 1 115 115 LEU CA C 13 57.907 0.300 . 1 . . . . 115 LEU CA . 10131 1 1426 . 1 1 115 115 LEU CB C 13 43.092 0.300 . 1 . . . . 115 LEU CB . 10131 1 1427 . 1 1 115 115 LEU CG C 13 27.842 0.300 . 1 . . . . 115 LEU CG . 10131 1 1428 . 1 1 115 115 LEU CD1 C 13 27.118 0.300 . 2 . . . . 115 LEU CD1 . 10131 1 1429 . 1 1 115 115 LEU CD2 C 13 24.576 0.300 . 2 . . . . 115 LEU CD2 . 10131 1 1430 . 1 1 115 115 LEU N N 15 117.640 0.300 . 1 . . . . 115 LEU N . 10131 1 1431 . 1 1 116 116 ASN H H 1 8.384 0.030 . 1 . . . . 116 ASN H . 10131 1 1432 . 1 1 116 116 ASN HA H 1 4.480 0.030 . 1 . . . . 116 ASN HA . 10131 1 1433 . 1 1 116 116 ASN HB2 H 1 2.732 0.030 . 2 . . . . 116 ASN HB2 . 10131 1 1434 . 1 1 116 116 ASN HB3 H 1 2.938 0.030 . 2 . . . . 116 ASN HB3 . 10131 1 1435 . 1 1 116 116 ASN HD21 H 1 7.402 0.030 . 2 . . . . 116 ASN HD21 . 10131 1 1436 . 1 1 116 116 ASN HD22 H 1 7.142 0.030 . 2 . . . . 116 ASN HD22 . 10131 1 1437 . 1 1 116 116 ASN C C 13 178.108 0.300 . 1 . . . . 116 ASN C . 10131 1 1438 . 1 1 116 116 ASN CA C 13 56.641 0.300 . 1 . . . . 116 ASN CA . 10131 1 1439 . 1 1 116 116 ASN CB C 13 38.531 0.300 . 1 . . . . 116 ASN CB . 10131 1 1440 . 1 1 116 116 ASN N N 15 119.022 0.300 . 1 . . . . 116 ASN N . 10131 1 1441 . 1 1 116 116 ASN ND2 N 15 113.359 0.300 . 1 . . . . 116 ASN ND2 . 10131 1 1442 . 1 1 117 117 GLN H H 1 8.215 0.030 . 1 . . . . 117 GLN H . 10131 1 1443 . 1 1 117 117 GLN HA H 1 4.089 0.030 . 1 . . . . 117 GLN HA . 10131 1 1444 . 1 1 117 117 GLN HB2 H 1 2.143 0.030 . 1 . . . . 117 GLN HB2 . 10131 1 1445 . 1 1 117 117 GLN HB3 H 1 2.143 0.030 . 1 . . . . 117 GLN HB3 . 10131 1 1446 . 1 1 117 117 GLN HG2 H 1 2.436 0.030 . 2 . . . . 117 GLN HG2 . 10131 1 1447 . 1 1 117 117 GLN HG3 H 1 2.512 0.030 . 2 . . . . 117 GLN HG3 . 10131 1 1448 . 1 1 117 117 GLN HE21 H 1 7.552 0.030 . 2 . . . . 117 GLN HE21 . 10131 1 1449 . 1 1 117 117 GLN HE22 H 1 6.824 0.030 . 2 . . . . 117 GLN HE22 . 10131 1 1450 . 1 1 117 117 GLN C C 13 178.248 0.300 . 1 . . . . 117 GLN C . 10131 1 1451 . 1 1 117 117 GLN CA C 13 58.614 0.300 . 1 . . . . 117 GLN CA . 10131 1 1452 . 1 1 117 117 GLN CB C 13 28.439 0.300 . 1 . . . . 117 GLN CB . 10131 1 1453 . 1 1 117 117 GLN CG C 13 33.803 0.300 . 1 . . . . 117 GLN CG . 10131 1 1454 . 1 1 117 117 GLN N N 15 118.791 0.300 . 1 . . . . 117 GLN N . 10131 1 1455 . 1 1 117 117 GLN NE2 N 15 111.912 0.300 . 1 . . . . 117 GLN NE2 . 10131 1 1456 . 1 1 118 118 ALA H H 1 7.990 0.030 . 1 . . . . 118 ALA H . 10131 1 1457 . 1 1 118 118 ALA HA H 1 4.279 0.030 . 1 . . . . 118 ALA HA . 10131 1 1458 . 1 1 118 118 ALA HB1 H 1 1.540 0.030 . 1 . . . . 118 ALA HB . 10131 1 1459 . 1 1 118 118 ALA HB2 H 1 1.540 0.030 . 1 . . . . 118 ALA HB . 10131 1 1460 . 1 1 118 118 ALA HB3 H 1 1.540 0.030 . 1 . . . . 118 ALA HB . 10131 1 1461 . 1 1 118 118 ALA C C 13 178.256 0.300 . 1 . . . . 118 ALA C . 10131 1 1462 . 1 1 118 118 ALA CA C 13 53.791 0.300 . 1 . . . . 118 ALA CA . 10131 1 1463 . 1 1 118 118 ALA CB C 13 19.870 0.300 . 1 . . . . 118 ALA CB . 10131 1 1464 . 1 1 118 118 ALA N N 15 119.946 0.300 . 1 . . . . 118 ALA N . 10131 1 1465 . 1 1 119 119 SER H H 1 7.760 0.030 . 1 . . . . 119 SER H . 10131 1 1466 . 1 1 119 119 SER HA H 1 4.355 0.030 . 1 . . . . 119 SER HA . 10131 1 1467 . 1 1 119 119 SER HB2 H 1 3.880 0.030 . 2 . . . . 119 SER HB2 . 10131 1 1468 . 1 1 119 119 SER HB3 H 1 4.155 0.030 . 2 . . . . 119 SER HB3 . 10131 1 1469 . 1 1 119 119 SER C C 13 174.493 0.300 . 1 . . . . 119 SER C . 10131 1 1470 . 1 1 119 119 SER CA C 13 59.320 0.300 . 1 . . . . 119 SER CA . 10131 1 1471 . 1 1 119 119 SER CB C 13 64.510 0.300 . 1 . . . . 119 SER CB . 10131 1 1472 . 1 1 119 119 SER N N 15 111.425 0.300 . 1 . . . . 119 SER N . 10131 1 1473 . 1 1 120 120 LYS H H 1 7.629 0.030 . 1 . . . . 120 LYS H . 10131 1 1474 . 1 1 120 120 LYS HA H 1 4.411 0.030 . 1 . . . . 120 LYS HA . 10131 1 1475 . 1 1 120 120 LYS HB2 H 1 1.971 0.030 . 2 . . . . 120 LYS HB2 . 10131 1 1476 . 1 1 120 120 LYS HB3 H 1 1.891 0.030 . 2 . . . . 120 LYS HB3 . 10131 1 1477 . 1 1 120 120 LYS HG2 H 1 1.539 0.030 . 2 . . . . 120 LYS HG2 . 10131 1 1478 . 1 1 120 120 LYS HG3 H 1 1.500 0.030 . 2 . . . . 120 LYS HG3 . 10131 1 1479 . 1 1 120 120 LYS HD2 H 1 1.700 0.030 . 1 . . . . 120 LYS HD2 . 10131 1 1480 . 1 1 120 120 LYS HD3 H 1 1.700 0.030 . 1 . . . . 120 LYS HD3 . 10131 1 1481 . 1 1 120 120 LYS HE2 H 1 2.988 0.030 . 2 . . . . 120 LYS HE2 . 10131 1 1482 . 1 1 120 120 LYS HE3 H 1 3.020 0.030 . 2 . . . . 120 LYS HE3 . 10131 1 1483 . 1 1 120 120 LYS C C 13 176.723 0.300 . 1 . . . . 120 LYS C . 10131 1 1484 . 1 1 120 120 LYS CA C 13 56.582 0.300 . 1 . . . . 120 LYS CA . 10131 1 1485 . 1 1 120 120 LYS CB C 13 32.537 0.300 . 1 . . . . 120 LYS CB . 10131 1 1486 . 1 1 120 120 LYS CG C 13 24.648 0.300 . 1 . . . . 120 LYS CG . 10131 1 1487 . 1 1 120 120 LYS CD C 13 29.091 0.300 . 1 . . . . 120 LYS CD . 10131 1 1488 . 1 1 120 120 LYS CE C 13 42.350 0.300 . 1 . . . . 120 LYS CE . 10131 1 1489 . 1 1 120 120 LYS N N 15 121.177 0.300 . 1 . . . . 120 LYS N . 10131 1 1490 . 1 1 121 121 SER H H 1 8.099 0.030 . 1 . . . . 121 SER H . 10131 1 1491 . 1 1 121 121 SER HA H 1 4.524 0.030 . 1 . . . . 121 SER HA . 10131 1 1492 . 1 1 121 121 SER HB2 H 1 3.929 0.030 . 1 . . . . 121 SER HB2 . 10131 1 1493 . 1 1 121 121 SER HB3 H 1 3.929 0.030 . 1 . . . . 121 SER HB3 . 10131 1 1494 . 1 1 121 121 SER C C 13 174.781 0.300 . 1 . . . . 121 SER C . 10131 1 1495 . 1 1 121 121 SER CA C 13 58.672 0.300 . 1 . . . . 121 SER CA . 10131 1 1496 . 1 1 121 121 SER CB C 13 64.078 0.300 . 1 . . . . 121 SER CB . 10131 1 1497 . 1 1 121 121 SER N N 15 115.639 0.300 . 1 . . . . 121 SER N . 10131 1 1498 . 1 1 122 122 GLY H H 1 8.201 0.030 . 1 . . . . 122 GLY H . 10131 1 1499 . 1 1 122 122 GLY HA2 H 1 4.202 0.030 . 2 . . . . 122 GLY HA2 . 10131 1 1500 . 1 1 122 122 GLY HA3 H 1 4.091 0.030 . 2 . . . . 122 GLY HA3 . 10131 1 1501 . 1 1 122 122 GLY C C 13 171.830 0.300 . 1 . . . . 122 GLY C . 10131 1 1502 . 1 1 122 122 GLY CA C 13 44.811 0.300 . 1 . . . . 122 GLY CA . 10131 1 1503 . 1 1 122 122 GLY N N 15 110.445 0.300 . 1 . . . . 122 GLY N . 10131 1 1504 . 1 1 123 123 PRO HA H 1 4.501 0.030 . 1 . . . . 123 PRO HA . 10131 1 1505 . 1 1 123 123 PRO HB2 H 1 2.309 0.030 . 1 . . . . 123 PRO HB2 . 10131 1 1506 . 1 1 123 123 PRO HB3 H 1 2.309 0.030 . 1 . . . . 123 PRO HB3 . 10131 1 1507 . 1 1 123 123 PRO HG2 H 1 2.021 0.030 . 1 . . . . 123 PRO HG2 . 10131 1 1508 . 1 1 123 123 PRO HG3 H 1 2.021 0.030 . 1 . . . . 123 PRO HG3 . 10131 1 1509 . 1 1 123 123 PRO HD2 H 1 3.651 0.030 . 1 . . . . 123 PRO HD2 . 10131 1 1510 . 1 1 123 123 PRO HD3 H 1 3.651 0.030 . 1 . . . . 123 PRO HD3 . 10131 1 1511 . 1 1 123 123 PRO CA C 13 63.272 0.300 . 1 . . . . 123 PRO CA . 10131 1 1512 . 1 1 123 123 PRO CB C 13 32.316 0.300 . 1 . . . . 123 PRO CB . 10131 1 1513 . 1 1 123 123 PRO CG C 13 27.262 0.300 . 1 . . . . 123 PRO CG . 10131 1 1514 . 1 1 123 123 PRO CD C 13 49.910 0.300 . 1 . . . . 123 PRO CD . 10131 1 1515 . 1 1 124 124 SER H H 1 8.529 0.030 . 1 . . . . 124 SER H . 10131 1 1516 . 1 1 124 124 SER HA H 1 4.501 0.030 . 1 . . . . 124 SER HA . 10131 1 1517 . 1 1 124 124 SER HB2 H 1 3.931 0.030 . 1 . . . . 124 SER HB2 . 10131 1 1518 . 1 1 124 124 SER HB3 H 1 3.931 0.030 . 1 . . . . 124 SER HB3 . 10131 1 1519 . 1 1 124 124 SER N N 15 116.400 0.300 . 1 . . . . 124 SER N . 10131 1 stop_ save_