data_15072 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 15072 _Entry.Title ; OSCP-NT (1-120) in complex with N-terminal (1-25) alpha subunit from F1-ATPase ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2006-12-12 _Entry.Accession_date 2006-12-12 _Entry.Last_release_date 2007-04-17 _Entry.Original_release_date 2007-04-17 _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version . _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 Rodrigo Carbajo . J. . 15072 2 David Neuhaus . . . 15072 3 Fiona Kellas . A. . 15072 4 Ji-Chun Yang . . . 15072 5 Michael Runswick . J. . 15072 6 Martin Montgomery . G. . 15072 7 John Walker . E. . 15072 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 'not applicable' 'not applicable' . 15072 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID 'oscp-nt alpha-nt complex' . 15072 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 15072 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 222 15072 '15N chemical shifts' 100 15072 '1H chemical shifts' 738 15072 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 . . 2007-04-17 2006-12-12 original author . 15072 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID BMRB 6564 'Chemical Shift Assignment for OSCP-NT (1-120)' 15072 PDB 2JMX 'BMRB Entry Tracking System' 15072 stop_ save_ ############### # Citations # ############### save_citation_1 _Citation.Sf_category citations _Citation.Sf_framecode citation_1 _Citation.Entry_ID 15072 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 17355883 _Citation.Full_citation . _Citation.Title 'How the N-terminal Domain of the OSCP Subunit of Bovine F1Fo-ATP Synthase Interacts with the N-terminal Region of an Alpha Subunit' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'J. Mol. Biol.' _Citation.Journal_name_full . _Citation.Journal_volume 368 _Citation.Journal_issue 2 _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first 310 _Citation.Page_last 318 _Citation.Year 2007 _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Rodrigo Carbajo . J. . 15072 1 2 Fiona Kellas . A. . 15072 1 3 Ji-Chun Yang . . . 15072 1 4 Michael Runswick . J. . 15072 1 5 Martin Montgomery . G. . 15072 1 6 John Walker . E. . 15072 1 7 David Neuhaus . . . 15072 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 15072 _Assembly.ID 1 _Assembly.Name 'oscp-nt alpha-nt' _Assembly.BMRB_code . _Assembly.Number_of_components 2 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds no _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic . _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 'OSCP N-terminal 1-120' 1 $oscp-nt A . yes native no no . . . 15072 1 2 'alpha N-terminal 1-25' 2 $alpha-nt A . yes native no no . . . 15072 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_oscp-nt _Entity.Sf_category entity _Entity.Sf_framecode oscp-nt _Entity.Entry_ID 15072 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name oscp-nt _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID A _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; FAKLVRPPVQIYGIEGRYAT ALYSAASKQNKLEQVEKELL RVGQILKEPKMAASLLNPYV KRSVKVKSLSDMTAKEKFSP LTSNLINLLAENGRLTNTPA VISAFSTMMSVHRGEVPCTV ; _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 120 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method . _Entity.Parent_entity_ID 1 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-11-26 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 2BO5 . "Bovine Oligomycin Sensitivity Conferral Protein N-Terminal Domain" . . . . . 100.00 120 100.00 100.00 3.67e-80 . . . . 15072 1 2 no PDB 2JMX . "Oscp-Nt (1-120) In Complex With N-Terminal (1-25) Alpha Subunit From F1-Atpase" . . . . . 100.00 120 100.00 100.00 3.67e-80 . . . . 15072 1 3 no PDB 4B2Q . "Model Of The Yeast F1fo-atp Synthase Dimer Based On Subtomogram Average" . . . . . 100.00 120 100.00 100.00 3.67e-80 . . . . 15072 1 4 no PDB 5ARA . "Bovine Mitochondrial Atp Synthase State 1a" . . . . . 100.00 190 100.00 100.00 2.76e-80 . . . . 15072 1 5 no PDB 5ARE . "Bovine Mitochondrial Atp Synthase State 1b" . . . . . 100.00 190 100.00 100.00 2.76e-80 . . . . 15072 1 6 no PDB 5ARH . "Bovine Mitochondrial Atp Synthase State 2a" . . . . . 100.00 190 100.00 100.00 2.76e-80 . . . . 15072 1 7 no PDB 5ARI . "Bovine Mitochondrial Atp Synthase State 2b" . . . . . 100.00 190 100.00 100.00 2.76e-80 . . . . 15072 1 8 no PDB 5FIJ . "Bovine Mitochondrial Atp Synthase State 2c" . . . . . 100.00 190 100.00 100.00 2.76e-80 . . . . 15072 1 9 no PDB 5FIK . "Bovine Mitochondrial Atp Synthase State 3a" . . . . . 100.00 190 100.00 100.00 2.76e-80 . . . . 15072 1 10 no PDB 5FIL . "Bovine Mitochondrial Atp Synthase State 3b" . . . . . 100.00 190 100.00 100.00 2.76e-80 . . . . 15072 1 11 no GB AAA30676 . "oligomycin sensitivity conferral protein precursor [Bos taurus]" . . . . . 100.00 213 100.00 100.00 6.49e-80 . . . . 15072 1 12 no GB AAI02205 . "ATP synthase, H+ transporting, mitochondrial F1 complex, O subunit [Bos taurus]" . . . . . 100.00 213 100.00 100.00 6.78e-80 . . . . 15072 1 13 no GB ELR58089 . "ATP synthase subunit O, mitochondrial [Bos mutus]" . . . . . 100.00 213 98.33 98.33 9.71e-78 . . . . 15072 1 14 no PRF 1002210A . "protein,oligomycin sensitivity" . . . . . 100.00 190 98.33 99.17 2.38e-78 . . . . 15072 1 15 no REF NP_776669 . "ATP synthase subunit O, mitochondrial precursor [Bos taurus]" . . . . . 100.00 213 100.00 100.00 6.49e-80 . . . . 15072 1 16 no REF XP_005674722 . "PREDICTED: ATP synthase subunit O, mitochondrial [Capra hircus]" . . . . . 100.00 213 97.50 99.17 5.82e-78 . . . . 15072 1 17 no REF XP_005893414 . "PREDICTED: ATP synthase subunit O, mitochondrial isoform X1 [Bos mutus]" . . . . . 100.00 213 98.33 98.33 9.71e-78 . . . . 15072 1 18 no REF XP_005956973 . "PREDICTED: ATP synthase subunit O, mitochondrial isoform X1 [Pantholops hodgsonii]" . . . . . 100.00 213 97.50 99.17 5.40e-78 . . . . 15072 1 19 no REF XP_005956974 . "PREDICTED: ATP synthase subunit O, mitochondrial isoform X2 [Pantholops hodgsonii]" . . . . . 100.00 194 97.50 99.17 4.38e-78 . . . . 15072 1 20 no SP P13621 . "RecName: Full=ATP synthase subunit O, mitochondrial; AltName: Full=Oligomycin sensitivity conferral protein; Short=OSCP; Flags:" . . . . . 100.00 213 100.00 100.00 6.78e-80 . . . . 15072 1 21 no TPG DAA33707 . "TPA: ATP synthase subunit O, mitochondrial precursor [Bos taurus]" . . . . . 100.00 213 100.00 100.00 6.78e-80 . . . . 15072 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 . PHE . 15072 1 2 . ALA . 15072 1 3 . LYS . 15072 1 4 . LEU . 15072 1 5 . VAL . 15072 1 6 . ARG . 15072 1 7 . PRO . 15072 1 8 . PRO . 15072 1 9 . VAL . 15072 1 10 . GLN . 15072 1 11 . ILE . 15072 1 12 . TYR . 15072 1 13 . GLY . 15072 1 14 . ILE . 15072 1 15 . GLU . 15072 1 16 . GLY . 15072 1 17 . ARG . 15072 1 18 . TYR . 15072 1 19 . ALA . 15072 1 20 . THR . 15072 1 21 . ALA . 15072 1 22 . LEU . 15072 1 23 . TYR . 15072 1 24 . SER . 15072 1 25 . ALA . 15072 1 26 . ALA . 15072 1 27 . SER . 15072 1 28 . LYS . 15072 1 29 . GLN . 15072 1 30 . ASN . 15072 1 31 . LYS . 15072 1 32 . LEU . 15072 1 33 . GLU . 15072 1 34 . GLN . 15072 1 35 . VAL . 15072 1 36 . GLU . 15072 1 37 . LYS . 15072 1 38 . GLU . 15072 1 39 . LEU . 15072 1 40 . LEU . 15072 1 41 . ARG . 15072 1 42 . VAL . 15072 1 43 . GLY . 15072 1 44 . GLN . 15072 1 45 . ILE . 15072 1 46 . LEU . 15072 1 47 . LYS . 15072 1 48 . GLU . 15072 1 49 . PRO . 15072 1 50 . LYS . 15072 1 51 . MET . 15072 1 52 . ALA . 15072 1 53 . ALA . 15072 1 54 . SER . 15072 1 55 . LEU . 15072 1 56 . LEU . 15072 1 57 . ASN . 15072 1 58 . PRO . 15072 1 59 . TYR . 15072 1 60 . VAL . 15072 1 61 . LYS . 15072 1 62 . ARG . 15072 1 63 . SER . 15072 1 64 . VAL . 15072 1 65 . LYS . 15072 1 66 . VAL . 15072 1 67 . LYS . 15072 1 68 . SER . 15072 1 69 . LEU . 15072 1 70 . SER . 15072 1 71 . ASP . 15072 1 72 . MET . 15072 1 73 . THR . 15072 1 74 . ALA . 15072 1 75 . LYS . 15072 1 76 . GLU . 15072 1 77 . LYS . 15072 1 78 . PHE . 15072 1 79 . SER . 15072 1 80 . PRO . 15072 1 81 . LEU . 15072 1 82 . THR . 15072 1 83 . SER . 15072 1 84 . ASN . 15072 1 85 . LEU . 15072 1 86 . ILE . 15072 1 87 . ASN . 15072 1 88 . LEU . 15072 1 89 . LEU . 15072 1 90 . ALA . 15072 1 91 . GLU . 15072 1 92 . ASN . 15072 1 93 . GLY . 15072 1 94 . ARG . 15072 1 95 . LEU . 15072 1 96 . THR . 15072 1 97 . ASN . 15072 1 98 . THR . 15072 1 99 . PRO . 15072 1 100 . ALA . 15072 1 101 . VAL . 15072 1 102 . ILE . 15072 1 103 . SER . 15072 1 104 . ALA . 15072 1 105 . PHE . 15072 1 106 . SER . 15072 1 107 . THR . 15072 1 108 . MET . 15072 1 109 . MET . 15072 1 110 . SER . 15072 1 111 . VAL . 15072 1 112 . HIS . 15072 1 113 . ARG . 15072 1 114 . GLY . 15072 1 115 . GLU . 15072 1 116 . VAL . 15072 1 117 . PRO . 15072 1 118 . CYS . 15072 1 119 . THR . 15072 1 120 . VAL . 15072 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 . PHE 1 1 15072 1 . ALA 2 2 15072 1 . LYS 3 3 15072 1 . LEU 4 4 15072 1 . VAL 5 5 15072 1 . ARG 6 6 15072 1 . PRO 7 7 15072 1 . PRO 8 8 15072 1 . VAL 9 9 15072 1 . GLN 10 10 15072 1 . ILE 11 11 15072 1 . TYR 12 12 15072 1 . GLY 13 13 15072 1 . ILE 14 14 15072 1 . GLU 15 15 15072 1 . GLY 16 16 15072 1 . ARG 17 17 15072 1 . TYR 18 18 15072 1 . ALA 19 19 15072 1 . THR 20 20 15072 1 . ALA 21 21 15072 1 . LEU 22 22 15072 1 . TYR 23 23 15072 1 . SER 24 24 15072 1 . ALA 25 25 15072 1 . ALA 26 26 15072 1 . SER 27 27 15072 1 . LYS 28 28 15072 1 . GLN 29 29 15072 1 . ASN 30 30 15072 1 . LYS 31 31 15072 1 . LEU 32 32 15072 1 . GLU 33 33 15072 1 . GLN 34 34 15072 1 . VAL 35 35 15072 1 . GLU 36 36 15072 1 . LYS 37 37 15072 1 . GLU 38 38 15072 1 . LEU 39 39 15072 1 . LEU 40 40 15072 1 . ARG 41 41 15072 1 . VAL 42 42 15072 1 . GLY 43 43 15072 1 . GLN 44 44 15072 1 . ILE 45 45 15072 1 . LEU 46 46 15072 1 . LYS 47 47 15072 1 . GLU 48 48 15072 1 . PRO 49 49 15072 1 . LYS 50 50 15072 1 . MET 51 51 15072 1 . ALA 52 52 15072 1 . ALA 53 53 15072 1 . SER 54 54 15072 1 . LEU 55 55 15072 1 . LEU 56 56 15072 1 . ASN 57 57 15072 1 . PRO 58 58 15072 1 . TYR 59 59 15072 1 . VAL 60 60 15072 1 . LYS 61 61 15072 1 . ARG 62 62 15072 1 . SER 63 63 15072 1 . VAL 64 64 15072 1 . LYS 65 65 15072 1 . VAL 66 66 15072 1 . LYS 67 67 15072 1 . SER 68 68 15072 1 . LEU 69 69 15072 1 . SER 70 70 15072 1 . ASP 71 71 15072 1 . MET 72 72 15072 1 . THR 73 73 15072 1 . ALA 74 74 15072 1 . LYS 75 75 15072 1 . GLU 76 76 15072 1 . LYS 77 77 15072 1 . PHE 78 78 15072 1 . SER 79 79 15072 1 . PRO 80 80 15072 1 . LEU 81 81 15072 1 . THR 82 82 15072 1 . SER 83 83 15072 1 . ASN 84 84 15072 1 . LEU 85 85 15072 1 . ILE 86 86 15072 1 . ASN 87 87 15072 1 . LEU 88 88 15072 1 . LEU 89 89 15072 1 . ALA 90 90 15072 1 . GLU 91 91 15072 1 . ASN 92 92 15072 1 . GLY 93 93 15072 1 . ARG 94 94 15072 1 . LEU 95 95 15072 1 . THR 96 96 15072 1 . ASN 97 97 15072 1 . THR 98 98 15072 1 . PRO 99 99 15072 1 . ALA 100 100 15072 1 . VAL 101 101 15072 1 . ILE 102 102 15072 1 . SER 103 103 15072 1 . ALA 104 104 15072 1 . PHE 105 105 15072 1 . SER 106 106 15072 1 . THR 107 107 15072 1 . MET 108 108 15072 1 . MET 109 109 15072 1 . SER 110 110 15072 1 . VAL 111 111 15072 1 . HIS 112 112 15072 1 . ARG 113 113 15072 1 . GLY 114 114 15072 1 . GLU 115 115 15072 1 . VAL 116 116 15072 1 . PRO 117 117 15072 1 . CYS 118 118 15072 1 . THR 119 119 15072 1 . VAL 120 120 15072 1 stop_ save_ save_alpha-nt _Entity.Sf_category entity _Entity.Sf_framecode alpha-nt _Entity.Entry_ID 15072 _Entity.ID 2 _Entity.BMRB_code . _Entity.Name alpha-nt _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID B _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; QKTGTAEVSSILEERILGAD TSVDL ; _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 25 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method . _Entity.Parent_entity_ID 2 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-01-31 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 1BMF . "Bovine Mitochondrial F1-Atpase" . . . . . 100.00 510 100.00 100.00 1.37e-05 . . . . 15072 2 2 no PDB 1E1Q . "Bovine Mitochondrial F1-Atpase At 100k" . . . . . 100.00 510 100.00 100.00 1.37e-05 . . . . 15072 2 3 no PDB 1E1R . "Bovine Mitochondrial F1-Atpase Inhibited By Mg2+adp And Aluminium Fluoride" . . . . . 100.00 510 100.00 100.00 1.37e-05 . . . . 15072 2 4 no PDB 1E79 . "Bovine F1-atpase Inhibited By Dccd (dicyclohexylcarbodiimide)" . . . . . 100.00 510 100.00 100.00 1.37e-05 . . . . 15072 2 5 no PDB 1H8E . "(Adp.Alf4)2(Adp.So4) Bovine F1-Atpase (All Three Catalytic Sites Occupied)" . . . . . 100.00 510 100.00 100.00 1.37e-05 . . . . 15072 2 6 no PDB 1H8H . "Bovine Mitochondrial F1-atpase Crystallised In The Presence Of 5mm Amppnp" . . . . . 100.00 510 100.00 100.00 1.37e-05 . . . . 15072 2 7 no PDB 1NBM . "The Structure Of Bovine F1-Atpase Covalently Inhibited With 4-Chloro-7-Nitrobenzofurazan" . . . . . 100.00 510 100.00 100.00 1.37e-05 . . . . 15072 2 8 no PDB 1OHH . "Bovine Mitochondrial F1-Atpase Complexed With The Inhibitor Protein If1" . . . . . 100.00 510 100.00 100.00 1.37e-05 . . . . 15072 2 9 no PDB 1QO1 . "Molecular Architecture Of The Rotary Motor In Atp Synthase From Yeast Mitochondria" . . . . . 100.00 510 100.00 100.00 1.37e-05 . . . . 15072 2 10 no PDB 1W0J . "Beryllium Fluoride Inhibited Bovine F1-atpase" . . . . . 100.00 510 100.00 100.00 1.37e-05 . . . . 15072 2 11 no PDB 1W0K . "Beryllium Fluoride Inhibited Bovine F1-atpase" . . . . . 100.00 510 100.00 100.00 1.37e-05 . . . . 15072 2 12 no PDB 2CK3 . "Azide Inhibited Bovine F1-atpase" . . . . . 100.00 510 100.00 100.00 1.37e-05 . . . . 15072 2 13 no PDB 2JDI . "Ground State Structure Of F1-Atpase From Bovine Heart Mitochondria (Bovine F1-Atpase Crystallised In The Absence Of Azide)" . . . . . 100.00 510 100.00 100.00 1.37e-05 . . . . 15072 2 14 no PDB 2JMX . "Oscp-Nt (1-120) In Complex With N-Terminal (1-25) Alpha Subunit From F1-Atpase" . . . . . 100.00 25 100.00 100.00 1.05e-06 . . . . 15072 2 15 no PDB 2W6E . "Low Resolution Structures Of Bovine Mitochondrial F1-Atpase During Controlled Dehydration: Hydration State 1." . . . . . 100.00 553 100.00 100.00 1.26e-05 . . . . 15072 2 16 no PDB 2W6F . "Low Resolution Structures Of Bovine Mitochondrial F1-Atpase During Controlled Dehydration: Hydration State 2." . . . . . 100.00 553 100.00 100.00 1.26e-05 . . . . 15072 2 17 no PDB 2W6G . "Low Resolution Structures Of Bovine Mitochondrial F1-Atpase During Controlled Dehydration: Hydration State 3." . . . . . 100.00 553 100.00 100.00 1.26e-05 . . . . 15072 2 18 no PDB 2W6H . "Low Resolution Structures Of Bovine Mitochondrial F1-Atpase During Controlled Dehydration: Hydration State 4a." . . . . . 100.00 553 100.00 100.00 1.26e-05 . . . . 15072 2 19 no PDB 2W6I . "Low Resolution Structures Of Bovine Mitochondrial F1-Atpase During Controlled Dehydration: Hydration State 4b." . . . . . 100.00 553 100.00 100.00 1.26e-05 . . . . 15072 2 20 no PDB 2W6J . "Low Resolution Structures Of Bovine Mitochondrial F1-Atpase During Controlled Dehydration: Hydration State 5." . . . . . 100.00 553 100.00 100.00 1.26e-05 . . . . 15072 2 21 no PDB 2WSS . "The Structure Of The Membrane Extrinsic Region Of Bovine Atp Synthase" . . . . . 100.00 510 100.00 100.00 1.37e-05 . . . . 15072 2 22 no PDB 4ASU . "F1-Atpase In Which All Three Catalytic Sites Contain Bound Nucleotide, With Magnesium Ion Released In The Empty Site" . . . . . 100.00 510 100.00 100.00 1.37e-05 . . . . 15072 2 23 no PDB 4TSF . "The Pathway Of Binding Of The Intrinsically Disordered Mitochondrial Inhibitor Protein To F1-atpase" . . . . . 100.00 510 100.00 100.00 1.37e-05 . . . . 15072 2 24 no PDB 4TT3 . "The Pathway Of Binding Of The Intrinsically Disordered Mitochondrial Inhibitor Protein To F1-atpase" . . . . . 100.00 510 100.00 100.00 1.37e-05 . . . . 15072 2 25 no DBJ BAK09231 . "ATP synthase alpha subunit 1 [Mesocricetus auratus]" . . . . . 100.00 553 100.00 100.00 1.28e-05 . . . . 15072 2 26 no EMBL CAA45865 . "H(+)-transporting ATP synthase [Bos taurus]" . . . . . 100.00 553 100.00 100.00 1.26e-05 . . . . 15072 2 27 no GB AAB59266 . "alpha subunit ATP synthase isoform precursor (EC 3.6.1.34) [Bos taurus]" . . . . . 100.00 553 100.00 100.00 1.26e-05 . . . . 15072 2 28 no GB AAI16060 . "ATP synthase, H+ transporting, mitochondrial F1 complex, alpha subunit 1, cardiac muscle [Bos taurus]" . . . . . 100.00 553 100.00 100.00 1.22e-05 . . . . 15072 2 29 no GB ACD02421 . "cardiac muscle ATP synthase H+ transporting mitochondrial F1 complex alpha subunit 1 [Sus scrofa]" . . . . . 100.00 553 100.00 100.00 1.24e-05 . . . . 15072 2 30 no GB EFB21996 . "hypothetical protein PANDA_006569 [Ailuropoda melanoleuca]" . . . . . 88.00 507 100.00 100.00 1.54e-03 . . . . 15072 2 31 no GB EGW04262 . "ATP synthase subunit alpha, mitochondrial [Cricetulus griseus]" . . . . . 100.00 65 100.00 100.00 1.28e-06 . . . . 15072 2 32 no REF NP_001172071 . "ATP synthase subunit alpha, mitochondrial [Sus scrofa]" . . . . . 100.00 553 100.00 100.00 1.24e-05 . . . . 15072 2 33 no REF NP_001268629 . "ATP synthase, H+ transporting, mitochondrial F1 complex, alpha subunit 1, cardiac muscle [Mesocricetus auratus]" . . . . . 100.00 553 100.00 100.00 1.28e-05 . . . . 15072 2 34 no REF NP_001274083 . "ATP synthase subunit alpha, mitochondrial [Canis lupus familiaris]" . . . . . 100.00 553 100.00 100.00 1.32e-05 . . . . 15072 2 35 no REF NP_777109 . "ATP synthase subunit alpha, mitochondrial precursor [Bos taurus]" . . . . . 100.00 553 100.00 100.00 1.26e-05 . . . . 15072 2 36 no REF XP_001506958 . "PREDICTED: ATP synthase subunit alpha, mitochondrial [Ornithorhynchus anatinus]" . . . . . 100.00 553 100.00 100.00 1.31e-05 . . . . 15072 2 37 no SP P19483 . "RecName: Full=ATP synthase subunit alpha, mitochondrial; Flags: Precursor [Bos taurus]" . . . . . 100.00 553 100.00 100.00 1.26e-05 . . . . 15072 2 38 no SP P80021 . "RecName: Full=ATP synthase subunit alpha, mitochondrial; AltName: Full=ATP synthase subunit alpha heart isoform, mitochondrial;" . . . . . 100.00 553 100.00 100.00 1.24e-05 . . . . 15072 2 39 no TPG DAA15776 . "TPA: ATP synthase subunit alpha, mitochondrial precursor [Bos taurus]" . . . . . 100.00 553 100.00 100.00 1.27e-05 . . . . 15072 2 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 . GLN . 15072 2 2 . LYS . 15072 2 3 . THR . 15072 2 4 . GLY . 15072 2 5 . THR . 15072 2 6 . ALA . 15072 2 7 . GLU . 15072 2 8 . VAL . 15072 2 9 . SER . 15072 2 10 . SER . 15072 2 11 . ILE . 15072 2 12 . LEU . 15072 2 13 . GLU . 15072 2 14 . GLU . 15072 2 15 . ARG . 15072 2 16 . ILE . 15072 2 17 . LEU . 15072 2 18 . GLY . 15072 2 19 . ALA . 15072 2 20 . ASP . 15072 2 21 . THR . 15072 2 22 . SER . 15072 2 23 . VAL . 15072 2 24 . ASP . 15072 2 25 . LEU . 15072 2 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 . GLN 1 1 15072 2 . LYS 2 2 15072 2 . THR 3 3 15072 2 . GLY 4 4 15072 2 . THR 5 5 15072 2 . ALA 6 6 15072 2 . GLU 7 7 15072 2 . VAL 8 8 15072 2 . SER 9 9 15072 2 . SER 10 10 15072 2 . ILE 11 11 15072 2 . LEU 12 12 15072 2 . GLU 13 13 15072 2 . GLU 14 14 15072 2 . ARG 15 15 15072 2 . ILE 16 16 15072 2 . LEU 17 17 15072 2 . GLY 18 18 15072 2 . ALA 19 19 15072 2 . ASP 20 20 15072 2 . THR 21 21 15072 2 . SER 22 22 15072 2 . VAL 23 23 15072 2 . ASP 24 24 15072 2 . LEU 25 25 15072 2 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 15072 _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 $oscp-nt . 9913 organism . 'Bos taurus' Cow . . Eukaryota Metazoa Bos taurus . . . . . . . . . . . . . . . . . . . . . 15072 1 2 2 $alpha-nt . 9913 organism . 'Bos taurus' Cow . . Eukaryota Metazoa Bos taurus . . . . . . . . . . . . . . . . . . . . . 15072 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 15072 _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 $oscp-nt . 'recombinant technology' 'Escherichia coli' . . . . . . . . . . . . . . . . . . . . . pET10 . . . . . . 15072 1 2 2 $alpha-nt . 'chemical synthesis' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 15072 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 15072 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '95% H2O/5% 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 oscp-nt '[U-99% 13C; U-99% 15N]' . . 1 $oscp-nt . . 0.5 . . mM . . . . 15072 1 2 alpha-nt 'natural abundance' . . 2 $alpha-nt . . 1.5 . . mM . . . . 15072 1 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID 15072 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 0.5 . M 15072 1 pH 6.5 . pH 15072 1 pressure 1 . atm 15072 1 temperature 300 . K 15072 1 stop_ save_ ############################ # Computer software used # ############################ save_TOPSPIN _Software.Sf_category software _Software.Sf_framecode TOPSPIN _Software.Entry_ID 15072 _Software.ID 1 _Software.Name TOPSPIN _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bruker Biospin' . . 15072 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection 15072 1 stop_ save_ save_SPARKY _Software.Sf_category software _Software.Sf_framecode SPARKY _Software.Entry_ID 15072 _Software.ID 2 _Software.Name SPARKY _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Goddard . . 15072 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 15072 2 stop_ save_ save_X-PLOR _Software.Sf_category software _Software.Sf_framecode X-PLOR _Software.Entry_ID 15072 _Software.ID 3 _Software.Name X-PLOR _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Brunger . . 15072 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'structure solution' 15072 3 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 15072 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ save_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_2 _NMR_spectrometer.Entry_ID 15072 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model DMX _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_spectrometer_3 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_3 _NMR_spectrometer.Entry_ID 15072 _NMR_spectrometer.ID 3 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model DRX _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 500 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 15072 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 Bruker Avance . 800 . . . 15072 1 2 spectrometer_2 Bruker DMX . 600 . . . 15072 1 3 spectrometer_3 Bruker DRX . 500 . . . 15072 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 15072 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 15072 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_reference_1 _Chem_shift_reference.Entry_ID 15072 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 TSP 'methylene protons' . . . . ppm 0.00 external indirect 0.251449530 . . . 1 $citation_1 . . 1 $citation_1 15072 1 H 1 TSP 'methylene protons' . . . . ppm 0.00 external direct 1.000000000 . . . 1 $citation_1 . . 1 $citation_1 15072 1 N 15 TSP 'methylene protons' . . . . ppm 0.00 external indirect 0.101329118 . . . 1 $citation_1 . . 1 $citation_1 15072 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 15072 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' . . . 15072 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 1 1 PHE HA H 1 4.74 0.01 . 1 . . . . 1 PHE HA . 15072 1 2 . 1 1 1 1 PHE HB2 H 1 3.12 0.01 . 2 . . . . 1 PHE HB2 . 15072 1 3 . 1 1 1 1 PHE HB3 H 1 3.24 0.01 . 2 . . . . 1 PHE HB3 . 15072 1 4 . 1 1 1 1 PHE HD1 H 1 7.37 0.01 . 1 . . . . 1 PHE HD1 . 15072 1 5 . 1 1 1 1 PHE HD2 H 1 7.37 0.01 . 1 . . . . 1 PHE HD2 . 15072 1 6 . 1 1 1 1 PHE HE1 H 1 7.44 0.01 . 1 . . . . 1 PHE HE1 . 15072 1 7 . 1 1 1 1 PHE HE2 H 1 7.44 0.01 . 1 . . . . 1 PHE HE2 . 15072 1 8 . 1 1 1 1 PHE HZ H 1 7.38 0.01 . 1 . . . . 1 PHE HZ . 15072 1 9 . 1 1 1 1 PHE CB C 13 39.5 0.2 . 1 . . . . 1 PHE CB . 15072 1 10 . 1 1 1 1 PHE CD1 C 13 131.9 0.2 . 1 . . . . 1 PHE CD1 . 15072 1 11 . 1 1 1 1 PHE CD2 C 13 131.9 0.2 . 1 . . . . 1 PHE CD2 . 15072 1 12 . 1 1 1 1 PHE CE1 C 13 131.9 0.2 . 1 . . . . 1 PHE CE1 . 15072 1 13 . 1 1 1 1 PHE CE2 C 13 131.9 0.2 . 1 . . . . 1 PHE CE2 . 15072 1 14 . 1 1 1 1 PHE CZ C 13 130.0 0.2 . 1 . . . . 1 PHE CZ . 15072 1 15 . 1 1 2 2 ALA H H 1 8.41 0.01 . 1 . . . . 2 ALA H . 15072 1 16 . 1 1 2 2 ALA HA H 1 4.37 0.01 . 1 . . . . 2 ALA HA . 15072 1 17 . 1 1 2 2 ALA HB1 H 1 1.42 0.01 . 1 . . . . 2 ALA HB . 15072 1 18 . 1 1 2 2 ALA HB2 H 1 1.42 0.01 . 1 . . . . 2 ALA HB . 15072 1 19 . 1 1 2 2 ALA HB3 H 1 1.42 0.01 . 1 . . . . 2 ALA HB . 15072 1 20 . 1 1 2 2 ALA CA C 13 52.3 0.2 . 1 . . . . 2 ALA CA . 15072 1 21 . 1 1 2 2 ALA CB C 13 19.7 0.2 . 1 . . . . 2 ALA CB . 15072 1 22 . 1 1 2 2 ALA N N 15 126.1 0.2 . 1 . . . . 2 ALA N . 15072 1 23 . 1 1 3 3 LYS H H 1 8.18 0.01 . 1 . . . . 3 LYS H . 15072 1 24 . 1 1 3 3 LYS HB2 H 1 1.80 0.01 . 2 . . . . 3 LYS HB2 . 15072 1 25 . 1 1 3 3 LYS HB3 H 1 1.90 0.01 . 2 . . . . 3 LYS HB3 . 15072 1 26 . 1 1 3 3 LYS CB C 13 33.2 0.2 . 1 . . . . 3 LYS CB . 15072 1 27 . 1 1 3 3 LYS N N 15 120.4 0.2 . 1 . . . . 3 LYS N . 15072 1 28 . 1 1 4 4 LEU H H 1 8.23 0.01 . 1 . . . . 4 LEU H . 15072 1 29 . 1 1 4 4 LEU HB2 H 1 1.57 0.01 . 2 . . . . 4 LEU HB2 . 15072 1 30 . 1 1 4 4 LEU HB3 H 1 1.62 0.01 . 2 . . . . 4 LEU HB3 . 15072 1 31 . 1 1 4 4 LEU CB C 13 42.8 0.2 . 1 . . . . 4 LEU CB . 15072 1 32 . 1 1 4 4 LEU N N 15 124.4 0.2 . 1 . . . . 4 LEU N . 15072 1 33 . 1 1 5 5 VAL H H 1 8.25 0.01 . 1 . . . . 5 VAL H . 15072 1 34 . 1 1 5 5 VAL N N 15 122.6 0.2 . 1 . . . . 5 VAL N . 15072 1 35 . 1 1 6 6 ARG H H 1 8.33 0.01 . 1 . . . . 6 ARG H . 15072 1 36 . 1 1 6 6 ARG HA H 1 4.71 0.01 . 1 . . . . 6 ARG HA . 15072 1 37 . 1 1 6 6 ARG HB2 H 1 1.78 0.01 . 2 . . . . 6 ARG HB2 . 15072 1 38 . 1 1 6 6 ARG HB3 H 1 1.87 0.01 . 2 . . . . 6 ARG HB3 . 15072 1 39 . 1 1 6 6 ARG HG2 H 1 1.73 0.01 . 1 . . . . 6 ARG HG2 . 15072 1 40 . 1 1 6 6 ARG HG3 H 1 1.73 0.01 . 1 . . . . 6 ARG HG3 . 15072 1 41 . 1 1 6 6 ARG HD2 H 1 3.26 0.01 . 1 . . . . 6 ARG HD2 . 15072 1 42 . 1 1 6 6 ARG HD3 H 1 3.26 0.01 . 1 . . . . 6 ARG HD3 . 15072 1 43 . 1 1 6 6 ARG CB C 13 30.2 0.2 . 1 . . . . 6 ARG CB . 15072 1 44 . 1 1 6 6 ARG CD C 13 43.5 0.2 . 1 . . . . 6 ARG CD . 15072 1 45 . 1 1 6 6 ARG N N 15 126.3 0.2 . 1 . . . . 6 ARG N . 15072 1 46 . 1 1 7 7 PRO HD2 H 1 3.70 0.01 . 2 . . . . 7 PRO HD2 . 15072 1 47 . 1 1 7 7 PRO HD3 H 1 3.88 0.01 . 2 . . . . 7 PRO HD3 . 15072 1 48 . 1 1 7 7 PRO CD C 13 50.3 0.2 . 1 . . . . 7 PRO CD . 15072 1 49 . 1 1 8 8 PRO HA H 1 4.45 0.01 . 1 . . . . 8 PRO HA . 15072 1 50 . 1 1 8 8 PRO CA C 13 63.5 0.2 . 1 . . . . 8 PRO CA . 15072 1 51 . 1 1 9 9 VAL HG11 H 1 0.83 0.01 . 2 . . . . 9 VAL HG1 . 15072 1 52 . 1 1 9 9 VAL HG12 H 1 0.83 0.01 . 2 . . . . 9 VAL HG1 . 15072 1 53 . 1 1 9 9 VAL HG13 H 1 0.83 0.01 . 2 . . . . 9 VAL HG1 . 15072 1 54 . 1 1 9 9 VAL HG21 H 1 0.92 0.01 . 2 . . . . 9 VAL HG2 . 15072 1 55 . 1 1 9 9 VAL HG22 H 1 0.92 0.01 . 2 . . . . 9 VAL HG2 . 15072 1 56 . 1 1 9 9 VAL HG23 H 1 0.92 0.01 . 2 . . . . 9 VAL HG2 . 15072 1 57 . 1 1 9 9 VAL CG1 C 13 20.8 0.2 . 2 . . . . 9 VAL CG1 . 15072 1 58 . 1 1 9 9 VAL CG2 C 13 20.7 0.2 . 2 . . . . 9 VAL CG2 . 15072 1 59 . 1 1 10 10 GLN H H 1 8.33 0.01 . 1 . . . . 10 GLN H . 15072 1 60 . 1 1 10 10 GLN HG2 H 1 2.20 0.01 . 1 . . . . 10 GLN HG2 . 15072 1 61 . 1 1 10 10 GLN HG3 H 1 2.20 0.01 . 1 . . . . 10 GLN HG3 . 15072 1 62 . 1 1 10 10 GLN HE21 H 1 6.81 0.01 . 2 . . . . 10 GLN HE21 . 15072 1 63 . 1 1 10 10 GLN HE22 H 1 7.37 0.01 . 2 . . . . 10 GLN HE22 . 15072 1 64 . 1 1 10 10 GLN CG C 13 33.7 0.2 . 1 . . . . 10 GLN CG . 15072 1 65 . 1 1 10 10 GLN N N 15 124.0 0.2 . 1 . . . . 10 GLN N . 15072 1 66 . 1 1 10 10 GLN NE2 N 15 112.3 0.2 . 1 . . . . 10 GLN NE2 . 15072 1 67 . 1 1 11 11 ILE HB H 1 1.62 0.01 . 1 . . . . 11 ILE HB . 15072 1 68 . 1 1 11 11 ILE HG21 H 1 0.84 0.01 . 1 . . . . 11 ILE HG2 . 15072 1 69 . 1 1 11 11 ILE HG22 H 1 0.84 0.01 . 1 . . . . 11 ILE HG2 . 15072 1 70 . 1 1 11 11 ILE HG23 H 1 0.84 0.01 . 1 . . . . 11 ILE HG2 . 15072 1 71 . 1 1 11 11 ILE HD11 H 1 0.85 0.01 . 1 . . . . 11 ILE HD1 . 15072 1 72 . 1 1 11 11 ILE HD12 H 1 0.85 0.01 . 1 . . . . 11 ILE HD1 . 15072 1 73 . 1 1 11 11 ILE HD13 H 1 0.85 0.01 . 1 . . . . 11 ILE HD1 . 15072 1 74 . 1 1 11 11 ILE CB C 13 39.1 0.2 . 1 . . . . 11 ILE CB . 15072 1 75 . 1 1 11 11 ILE CG2 C 13 17.5 0.2 . 1 . . . . 11 ILE CG2 . 15072 1 76 . 1 1 11 11 ILE CD1 C 13 12.9 0.2 . 1 . . . . 11 ILE CD1 . 15072 1 77 . 1 1 12 12 TYR HB2 H 1 2.96 0.01 . 2 . . . . 12 TYR HB2 . 15072 1 78 . 1 1 12 12 TYR HB3 H 1 3.26 0.01 . 2 . . . . 12 TYR HB3 . 15072 1 79 . 1 1 12 12 TYR HD1 H 1 7.24 0.01 . 1 . . . . 12 TYR HD1 . 15072 1 80 . 1 1 12 12 TYR HD2 H 1 7.24 0.01 . 1 . . . . 12 TYR HD2 . 15072 1 81 . 1 1 12 12 TYR HE1 H 1 6.88 0.01 . 1 . . . . 12 TYR HE1 . 15072 1 82 . 1 1 12 12 TYR HE2 H 1 6.88 0.01 . 1 . . . . 12 TYR HE2 . 15072 1 83 . 1 1 12 12 TYR CD1 C 13 133.1 0.2 . 1 . . . . 12 TYR CD1 . 15072 1 84 . 1 1 12 12 TYR CD2 C 13 133.1 0.2 . 1 . . . . 12 TYR CD2 . 15072 1 85 . 1 1 12 12 TYR CE1 C 13 118.3 0.2 . 1 . . . . 12 TYR CE1 . 15072 1 86 . 1 1 12 12 TYR CE2 C 13 118.3 0.2 . 1 . . . . 12 TYR CE2 . 15072 1 87 . 1 1 13 13 GLY H H 1 8.30 0.01 . 1 . . . . 13 GLY H . 15072 1 88 . 1 1 13 13 GLY HA2 H 1 4.03 0.01 . 1 . . . . 13 GLY HA2 . 15072 1 89 . 1 1 13 13 GLY CA C 13 45.4 0.2 . 1 . . . . 13 GLY CA . 15072 1 90 . 1 1 13 13 GLY N N 15 108.9 0.2 . 1 . . . . 13 GLY N . 15072 1 91 . 1 1 14 14 ILE H H 1 8.80 0.01 . 1 . . . . 14 ILE H . 15072 1 92 . 1 1 14 14 ILE HG12 H 1 1.28 0.01 . 2 . . . . 14 ILE HG12 . 15072 1 93 . 1 1 14 14 ILE HG13 H 1 1.59 0.01 . 2 . . . . 14 ILE HG13 . 15072 1 94 . 1 1 14 14 ILE HG21 H 1 0.96 0.01 . 1 . . . . 14 ILE HG2 . 15072 1 95 . 1 1 14 14 ILE HG22 H 1 0.96 0.01 . 1 . . . . 14 ILE HG2 . 15072 1 96 . 1 1 14 14 ILE HG23 H 1 0.96 0.01 . 1 . . . . 14 ILE HG2 . 15072 1 97 . 1 1 14 14 ILE HD11 H 1 1.01 0.01 . 1 . . . . 14 ILE HD1 . 15072 1 98 . 1 1 14 14 ILE HD12 H 1 1.01 0.01 . 1 . . . . 14 ILE HD1 . 15072 1 99 . 1 1 14 14 ILE HD13 H 1 1.01 0.01 . 1 . . . . 14 ILE HD1 . 15072 1 100 . 1 1 14 14 ILE CG1 C 13 28.8 0.2 . 1 . . . . 14 ILE CG1 . 15072 1 101 . 1 1 14 14 ILE CG2 C 13 17.4 0.2 . 1 . . . . 14 ILE CG2 . 15072 1 102 . 1 1 14 14 ILE CD1 C 13 13.2 0.2 . 1 . . . . 14 ILE CD1 . 15072 1 103 . 1 1 14 14 ILE N N 15 122.0 0.2 . 1 . . . . 14 ILE N . 15072 1 104 . 1 1 16 16 GLY H H 1 7.87 0.01 . 1 . . . . 16 GLY H . 15072 1 105 . 1 1 16 16 GLY N N 15 107.2 0.2 . 1 . . . . 16 GLY N . 15072 1 106 . 1 1 17 17 ARG H H 1 8.08 0.01 . 1 . . . . 17 ARG H . 15072 1 107 . 1 1 17 17 ARG N N 15 124.1 0.2 . 1 . . . . 17 ARG N . 15072 1 108 . 1 1 18 18 TYR HD1 H 1 7.15 0.01 . 1 . . . . 18 TYR HD1 . 15072 1 109 . 1 1 18 18 TYR HD2 H 1 7.15 0.01 . 1 . . . . 18 TYR HD2 . 15072 1 110 . 1 1 18 18 TYR HE1 H 1 6.66 0.01 . 1 . . . . 18 TYR HE1 . 15072 1 111 . 1 1 18 18 TYR HE2 H 1 6.66 0.01 . 1 . . . . 18 TYR HE2 . 15072 1 112 . 1 1 18 18 TYR CD1 C 13 132.1 0.2 . 1 . . . . 18 TYR CD1 . 15072 1 113 . 1 1 18 18 TYR CD2 C 13 132.1 0.2 . 1 . . . . 18 TYR CD2 . 15072 1 114 . 1 1 18 18 TYR CE1 C 13 118.0 0.2 . 1 . . . . 18 TYR CE1 . 15072 1 115 . 1 1 18 18 TYR CE2 C 13 118.0 0.2 . 1 . . . . 18 TYR CE2 . 15072 1 116 . 1 1 19 19 ALA H H 1 8.49 0.01 . 1 . . . . 19 ALA H . 15072 1 117 . 1 1 19 19 ALA HA H 1 4.19 0.01 . 1 . . . . 19 ALA HA . 15072 1 118 . 1 1 19 19 ALA HB1 H 1 1.80 0.01 . 1 . . . . 19 ALA HB . 15072 1 119 . 1 1 19 19 ALA HB2 H 1 1.80 0.01 . 1 . . . . 19 ALA HB . 15072 1 120 . 1 1 19 19 ALA HB3 H 1 1.80 0.01 . 1 . . . . 19 ALA HB . 15072 1 121 . 1 1 19 19 ALA CA C 13 56.0 0.2 . 1 . . . . 19 ALA CA . 15072 1 122 . 1 1 19 19 ALA CB C 13 18.5 0.2 . 1 . . . . 19 ALA CB . 15072 1 123 . 1 1 19 19 ALA N N 15 119.9 0.2 . 1 . . . . 19 ALA N . 15072 1 124 . 1 1 20 20 THR H H 1 8.53 0.01 . 1 . . . . 20 THR H . 15072 1 125 . 1 1 20 20 THR HA H 1 3.92 0.01 . 1 . . . . 20 THR HA . 15072 1 126 . 1 1 20 20 THR HB H 1 4.38 0.01 . 1 . . . . 20 THR HB . 15072 1 127 . 1 1 20 20 THR HG21 H 1 1.35 0.01 . 1 . . . . 20 THR HG2 . 15072 1 128 . 1 1 20 20 THR HG22 H 1 1.35 0.01 . 1 . . . . 20 THR HG2 . 15072 1 129 . 1 1 20 20 THR HG23 H 1 1.35 0.01 . 1 . . . . 20 THR HG2 . 15072 1 130 . 1 1 20 20 THR CB C 13 68.7 0.2 . 1 . . . . 20 THR CB . 15072 1 131 . 1 1 20 20 THR CG2 C 13 21.4 0.2 . 1 . . . . 20 THR CG2 . 15072 1 132 . 1 1 20 20 THR N N 15 115.2 0.2 . 1 . . . . 20 THR N . 15072 1 133 . 1 1 21 21 ALA HA H 1 4.34 0.01 . 1 . . . . 21 ALA HA . 15072 1 134 . 1 1 21 21 ALA HB1 H 1 1.61 0.01 . 1 . . . . 21 ALA HB . 15072 1 135 . 1 1 21 21 ALA HB2 H 1 1.61 0.01 . 1 . . . . 21 ALA HB . 15072 1 136 . 1 1 21 21 ALA HB3 H 1 1.61 0.01 . 1 . . . . 21 ALA HB . 15072 1 137 . 1 1 21 21 ALA CA C 13 55.3 0.2 . 1 . . . . 21 ALA CA . 15072 1 138 . 1 1 21 21 ALA CB C 13 18.5 0.2 . 1 . . . . 21 ALA CB . 15072 1 139 . 1 1 22 22 LEU HD11 H 1 0.29 0.01 . 2 . . . . 22 LEU HD1 . 15072 1 140 . 1 1 22 22 LEU HD12 H 1 0.29 0.01 . 2 . . . . 22 LEU HD1 . 15072 1 141 . 1 1 22 22 LEU HD13 H 1 0.29 0.01 . 2 . . . . 22 LEU HD1 . 15072 1 142 . 1 1 22 22 LEU CD1 C 13 26.5 0.2 . 2 . . . . 22 LEU CD1 . 15072 1 143 . 1 1 23 23 TYR H H 1 9.13 0.01 . 1 . . . . 23 TYR H . 15072 1 144 . 1 1 23 23 TYR HD1 H 1 6.77 0.01 . 1 . . . . 23 TYR HD1 . 15072 1 145 . 1 1 23 23 TYR HD2 H 1 6.77 0.01 . 1 . . . . 23 TYR HD2 . 15072 1 146 . 1 1 23 23 TYR HE1 H 1 6.53 0.01 . 1 . . . . 23 TYR HE1 . 15072 1 147 . 1 1 23 23 TYR HE2 H 1 6.53 0.01 . 1 . . . . 23 TYR HE2 . 15072 1 148 . 1 1 23 23 TYR CD1 C 13 133.4 0.2 . 1 . . . . 23 TYR CD1 . 15072 1 149 . 1 1 23 23 TYR CD2 C 13 133.4 0.2 . 1 . . . . 23 TYR CD2 . 15072 1 150 . 1 1 23 23 TYR CE1 C 13 118.4 0.2 . 1 . . . . 23 TYR CE1 . 15072 1 151 . 1 1 23 23 TYR CE2 C 13 118.4 0.2 . 1 . . . . 23 TYR CE2 . 15072 1 152 . 1 1 23 23 TYR N N 15 120.3 0.2 . 1 . . . . 23 TYR N . 15072 1 153 . 1 1 25 25 ALA HB1 H 1 1.56 0.01 . 1 . . . . 25 ALA HB . 15072 1 154 . 1 1 25 25 ALA HB2 H 1 1.56 0.01 . 1 . . . . 25 ALA HB . 15072 1 155 . 1 1 25 25 ALA HB3 H 1 1.56 0.01 . 1 . . . . 25 ALA HB . 15072 1 156 . 1 1 25 25 ALA CB C 13 19.6 0.2 . 1 . . . . 25 ALA CB . 15072 1 157 . 1 1 26 26 ALA H H 1 9.17 0.01 . 1 . . . . 26 ALA H . 15072 1 158 . 1 1 26 26 ALA HA H 1 3.87 0.01 . 1 . . . . 26 ALA HA . 15072 1 159 . 1 1 26 26 ALA HB1 H 1 1.30 0.01 . 1 . . . . 26 ALA HB . 15072 1 160 . 1 1 26 26 ALA HB2 H 1 1.30 0.01 . 1 . . . . 26 ALA HB . 15072 1 161 . 1 1 26 26 ALA HB3 H 1 1.30 0.01 . 1 . . . . 26 ALA HB . 15072 1 162 . 1 1 26 26 ALA CA C 13 54.7 0.2 . 1 . . . . 26 ALA CA . 15072 1 163 . 1 1 26 26 ALA CB C 13 18.1 0.2 . 1 . . . . 26 ALA CB . 15072 1 164 . 1 1 26 26 ALA N N 15 116.5 0.2 . 1 . . . . 26 ALA N . 15072 1 165 . 1 1 27 27 SER H H 1 8.77 0.01 . 1 . . . . 27 SER H . 15072 1 166 . 1 1 27 27 SER HA H 1 4.07 0.01 . 1 . . . . 27 SER HA . 15072 1 167 . 1 1 27 27 SER CA C 13 61.7 0.2 . 1 . . . . 27 SER CA . 15072 1 168 . 1 1 27 27 SER N N 15 115.5 0.2 . 1 . . . . 27 SER N . 15072 1 169 . 1 1 29 29 GLN H H 1 7.27 0.01 . 1 . . . . 29 GLN H . 15072 1 170 . 1 1 29 29 GLN HA H 1 4.51 0.01 . 1 . . . . 29 GLN HA . 15072 1 171 . 1 1 29 29 GLN HE21 H 1 6.93 0.01 . 2 . . . . 29 GLN HE21 . 15072 1 172 . 1 1 29 29 GLN N N 15 113.6 0.2 . 1 . . . . 29 GLN N . 15072 1 173 . 1 1 29 29 GLN NE2 N 15 111.0 0.2 . 1 . . . . 29 GLN NE2 . 15072 1 174 . 1 1 30 30 ASN H H 1 7.99 0.01 . 1 . . . . 30 ASN H . 15072 1 175 . 1 1 30 30 ASN HA H 1 4.69 0.01 . 1 . . . . 30 ASN HA . 15072 1 176 . 1 1 30 30 ASN HB2 H 1 2.90 0.01 . 2 . . . . 30 ASN HB2 . 15072 1 177 . 1 1 30 30 ASN HB3 H 1 3.36 0.01 . 2 . . . . 30 ASN HB3 . 15072 1 178 . 1 1 30 30 ASN HD21 H 1 6.97 0.01 . 2 . . . . 30 ASN HD21 . 15072 1 179 . 1 1 30 30 ASN HD22 H 1 7.67 0.01 . 2 . . . . 30 ASN HD22 . 15072 1 180 . 1 1 30 30 ASN CA C 13 54.2 0.2 . 1 . . . . 30 ASN CA . 15072 1 181 . 1 1 30 30 ASN CB C 13 37.1 0.2 . 1 . . . . 30 ASN CB . 15072 1 182 . 1 1 30 30 ASN N N 15 117.5 0.2 . 1 . . . . 30 ASN N . 15072 1 183 . 1 1 30 30 ASN ND2 N 15 112.5 0.2 . 1 . . . . 30 ASN ND2 . 15072 1 184 . 1 1 31 31 LYS HA H 1 5.13 0.01 . 1 . . . . 31 LYS HA . 15072 1 185 . 1 1 31 31 LYS HB2 H 1 1.29 0.01 . 2 . . . . 31 LYS HB2 . 15072 1 186 . 1 1 31 31 LYS HB3 H 1 2.44 0.01 . 2 . . . . 31 LYS HB3 . 15072 1 187 . 1 1 31 31 LYS HD2 H 1 1.46 0.01 . 2 . . . . 31 LYS HD2 . 15072 1 188 . 1 1 31 31 LYS CB C 13 34.9 0.2 . 1 . . . . 31 LYS CB . 15072 1 189 . 1 1 32 32 LEU H H 1 8.22 0.01 . 1 . . . . 32 LEU H . 15072 1 190 . 1 1 32 32 LEU HD11 H 1 0.47 0.01 . 2 . . . . 32 LEU HD1 . 15072 1 191 . 1 1 32 32 LEU HD12 H 1 0.47 0.01 . 2 . . . . 32 LEU HD1 . 15072 1 192 . 1 1 32 32 LEU HD13 H 1 0.47 0.01 . 2 . . . . 32 LEU HD1 . 15072 1 193 . 1 1 32 32 LEU HD21 H 1 0.59 0.01 . 2 . . . . 32 LEU HD2 . 15072 1 194 . 1 1 32 32 LEU HD22 H 1 0.59 0.01 . 2 . . . . 32 LEU HD2 . 15072 1 195 . 1 1 32 32 LEU HD23 H 1 0.59 0.01 . 2 . . . . 32 LEU HD2 . 15072 1 196 . 1 1 32 32 LEU CD1 C 13 25.2 0.2 . 2 . . . . 32 LEU CD1 . 15072 1 197 . 1 1 32 32 LEU CD2 C 13 23.9 0.2 . 2 . . . . 32 LEU CD2 . 15072 1 198 . 1 1 32 32 LEU N N 15 121.0 0.2 . 1 . . . . 32 LEU N . 15072 1 199 . 1 1 33 33 GLU H H 1 8.59 0.01 . 1 . . . . 33 GLU H . 15072 1 200 . 1 1 33 33 GLU HA H 1 4.11 0.01 . 1 . . . . 33 GLU HA . 15072 1 201 . 1 1 33 33 GLU HB2 H 1 2.09 0.01 . 2 . . . . 33 GLU HB2 . 15072 1 202 . 1 1 33 33 GLU HB3 H 1 2.15 0.01 . 2 . . . . 33 GLU HB3 . 15072 1 203 . 1 1 33 33 GLU HG2 H 1 2.38 0.01 . 2 . . . . 33 GLU HG2 . 15072 1 204 . 1 1 33 33 GLU HG3 H 1 2.46 0.01 . 2 . . . . 33 GLU HG3 . 15072 1 205 . 1 1 33 33 GLU CA C 13 60.4 0.2 . 1 . . . . 33 GLU CA . 15072 1 206 . 1 1 33 33 GLU CB C 13 28.7 0.2 . 1 . . . . 33 GLU CB . 15072 1 207 . 1 1 33 33 GLU CG C 13 37.6 0.2 . 1 . . . . 33 GLU CG . 15072 1 208 . 1 1 33 33 GLU N N 15 115.0 0.2 . 1 . . . . 33 GLU N . 15072 1 209 . 1 1 34 34 GLN H H 1 8.02 0.01 . 1 . . . . 34 GLN H . 15072 1 210 . 1 1 34 34 GLN HA H 1 4.16 0.01 . 1 . . . . 34 GLN HA . 15072 1 211 . 1 1 34 34 GLN HB2 H 1 2.05 0.01 . 2 . . . . 34 GLN HB2 . 15072 1 212 . 1 1 34 34 GLN HB3 H 1 2.31 0.01 . 2 . . . . 34 GLN HB3 . 15072 1 213 . 1 1 34 34 GLN HG2 H 1 2.34 0.01 . 2 . . . . 34 GLN HG2 . 15072 1 214 . 1 1 34 34 GLN HG3 H 1 2.56 0.01 . 2 . . . . 34 GLN HG3 . 15072 1 215 . 1 1 34 34 GLN HE21 H 1 7.14 0.01 . 2 . . . . 34 GLN HE21 . 15072 1 216 . 1 1 34 34 GLN HE22 H 1 7.81 0.01 . 2 . . . . 34 GLN HE22 . 15072 1 217 . 1 1 34 34 GLN CA C 13 59.2 0.2 . 1 . . . . 34 GLN CA . 15072 1 218 . 1 1 34 34 GLN CB C 13 28.3 0.2 . 1 . . . . 34 GLN CB . 15072 1 219 . 1 1 34 34 GLN CG C 13 33.3 0.2 . 1 . . . . 34 GLN CG . 15072 1 220 . 1 1 34 34 GLN N N 15 120.6 0.2 . 1 . . . . 34 GLN N . 15072 1 221 . 1 1 34 34 GLN NE2 N 15 112.0 0.2 . 1 . . . . 34 GLN NE2 . 15072 1 222 . 1 1 35 35 VAL H H 1 8.44 0.01 . 1 . . . . 35 VAL H . 15072 1 223 . 1 1 35 35 VAL HB H 1 2.05 0.01 . 1 . . . . 35 VAL HB . 15072 1 224 . 1 1 35 35 VAL HG11 H 1 0.59 0.01 . 2 . . . . 35 VAL HG1 . 15072 1 225 . 1 1 35 35 VAL HG12 H 1 0.59 0.01 . 2 . . . . 35 VAL HG1 . 15072 1 226 . 1 1 35 35 VAL HG13 H 1 0.59 0.01 . 2 . . . . 35 VAL HG1 . 15072 1 227 . 1 1 35 35 VAL HG21 H 1 1.00 0.01 . 2 . . . . 35 VAL HG2 . 15072 1 228 . 1 1 35 35 VAL HG22 H 1 1.00 0.01 . 2 . . . . 35 VAL HG2 . 15072 1 229 . 1 1 35 35 VAL HG23 H 1 1.00 0.01 . 2 . . . . 35 VAL HG2 . 15072 1 230 . 1 1 35 35 VAL CG1 C 13 22.2 0.2 . 2 . . . . 35 VAL CG1 . 15072 1 231 . 1 1 35 35 VAL CG2 C 13 23.9 0.2 . 2 . . . . 35 VAL CG2 . 15072 1 232 . 1 1 35 35 VAL N N 15 118.4 0.2 . 1 . . . . 35 VAL N . 15072 1 233 . 1 1 36 36 GLU H H 1 8.55 0.01 . 1 . . . . 36 GLU H . 15072 1 234 . 1 1 36 36 GLU N N 15 120.2 0.2 . 1 . . . . 36 GLU N . 15072 1 235 . 1 1 37 37 LYS H H 1 7.55 0.01 . 1 . . . . 37 LYS H . 15072 1 236 . 1 1 37 37 LYS N N 15 116.3 0.2 . 1 . . . . 37 LYS N . 15072 1 237 . 1 1 38 38 GLU H H 1 8.27 0.01 . 1 . . . . 38 GLU H . 15072 1 238 . 1 1 38 38 GLU N N 15 120.5 0.2 . 1 . . . . 38 GLU N . 15072 1 239 . 1 1 39 39 LEU H H 1 8.90 0.01 . 1 . . . . 39 LEU H . 15072 1 240 . 1 1 39 39 LEU HA H 1 3.81 0.01 . 1 . . . . 39 LEU HA . 15072 1 241 . 1 1 39 39 LEU HB3 H 1 1.93 0.01 . 2 . . . . 39 LEU HB3 . 15072 1 242 . 1 1 39 39 LEU HG H 1 1.65 0.01 . 1 . . . . 39 LEU HG . 15072 1 243 . 1 1 39 39 LEU HD11 H 1 0.41 0.01 . 2 . . . . 39 LEU HD1 . 15072 1 244 . 1 1 39 39 LEU HD12 H 1 0.41 0.01 . 2 . . . . 39 LEU HD1 . 15072 1 245 . 1 1 39 39 LEU HD13 H 1 0.41 0.01 . 2 . . . . 39 LEU HD1 . 15072 1 246 . 1 1 39 39 LEU HD21 H 1 0.48 0.01 . 2 . . . . 39 LEU HD2 . 15072 1 247 . 1 1 39 39 LEU HD22 H 1 0.48 0.01 . 2 . . . . 39 LEU HD2 . 15072 1 248 . 1 1 39 39 LEU HD23 H 1 0.48 0.01 . 2 . . . . 39 LEU HD2 . 15072 1 249 . 1 1 39 39 LEU CA C 13 57.8 0.2 . 1 . . . . 39 LEU CA . 15072 1 250 . 1 1 39 39 LEU CD1 C 13 25.4 0.2 . 2 . . . . 39 LEU CD1 . 15072 1 251 . 1 1 39 39 LEU CD2 C 13 22.2 0.2 . 2 . . . . 39 LEU CD2 . 15072 1 252 . 1 1 39 39 LEU N N 15 119.5 0.2 . 1 . . . . 39 LEU N . 15072 1 253 . 1 1 40 40 LEU H H 1 8.13 0.01 . 1 . . . . 40 LEU H . 15072 1 254 . 1 1 40 40 LEU HB2 H 1 1.61 0.01 . 2 . . . . 40 LEU HB2 . 15072 1 255 . 1 1 40 40 LEU HD11 H 1 0.94 0.01 . 2 . . . . 40 LEU HD1 . 15072 1 256 . 1 1 40 40 LEU HD12 H 1 0.94 0.01 . 2 . . . . 40 LEU HD1 . 15072 1 257 . 1 1 40 40 LEU HD13 H 1 0.94 0.01 . 2 . . . . 40 LEU HD1 . 15072 1 258 . 1 1 40 40 LEU CB C 13 41.0 0.2 . 1 . . . . 40 LEU CB . 15072 1 259 . 1 1 40 40 LEU CD1 C 13 22.4 0.2 . 2 . . . . 40 LEU CD1 . 15072 1 260 . 1 1 40 40 LEU N N 15 118.5 0.2 . 1 . . . . 40 LEU N . 15072 1 261 . 1 1 41 41 ARG H H 1 7.69 0.01 . 1 . . . . 41 ARG H . 15072 1 262 . 1 1 41 41 ARG HA H 1 4.35 0.01 . 1 . . . . 41 ARG HA . 15072 1 263 . 1 1 41 41 ARG HB3 H 1 2.62 0.01 . 2 . . . . 41 ARG HB3 . 15072 1 264 . 1 1 41 41 ARG HG3 H 1 2.15 0.01 . 2 . . . . 41 ARG HG3 . 15072 1 265 . 1 1 41 41 ARG HD3 H 1 3.63 0.01 . 2 . . . . 41 ARG HD3 . 15072 1 266 . 1 1 41 41 ARG CA C 13 58.8 0.2 . 1 . . . . 41 ARG CA . 15072 1 267 . 1 1 41 41 ARG CB C 13 28.9 0.2 . 1 . . . . 41 ARG CB . 15072 1 268 . 1 1 41 41 ARG CG C 13 27.0 0.2 . 1 . . . . 41 ARG CG . 15072 1 269 . 1 1 41 41 ARG CD C 13 43.3 0.2 . 1 . . . . 41 ARG CD . 15072 1 270 . 1 1 41 41 ARG N N 15 121.1 0.2 . 1 . . . . 41 ARG N . 15072 1 271 . 1 1 42 42 VAL H H 1 8.71 0.01 . 1 . . . . 42 VAL H . 15072 1 272 . 1 1 42 42 VAL HA H 1 3.62 0.01 . 1 . . . . 42 VAL HA . 15072 1 273 . 1 1 42 42 VAL HB H 1 2.30 0.01 . 1 . . . . 42 VAL HB . 15072 1 274 . 1 1 42 42 VAL HG11 H 1 0.78 0.01 . 2 . . . . 42 VAL HG1 . 15072 1 275 . 1 1 42 42 VAL HG12 H 1 0.78 0.01 . 2 . . . . 42 VAL HG1 . 15072 1 276 . 1 1 42 42 VAL HG13 H 1 0.78 0.01 . 2 . . . . 42 VAL HG1 . 15072 1 277 . 1 1 42 42 VAL HG21 H 1 0.78 0.01 . 2 . . . . 42 VAL HG2 . 15072 1 278 . 1 1 42 42 VAL HG22 H 1 0.78 0.01 . 2 . . . . 42 VAL HG2 . 15072 1 279 . 1 1 42 42 VAL HG23 H 1 0.78 0.01 . 2 . . . . 42 VAL HG2 . 15072 1 280 . 1 1 42 42 VAL CA C 13 67.4 0.2 . 1 . . . . 42 VAL CA . 15072 1 281 . 1 1 42 42 VAL CB C 13 30.8 0.2 . 1 . . . . 42 VAL CB . 15072 1 282 . 1 1 42 42 VAL CG1 C 13 24.4 0.2 . 2 . . . . 42 VAL CG1 . 15072 1 283 . 1 1 42 42 VAL CG2 C 13 21.4 0.2 . 2 . . . . 42 VAL CG2 . 15072 1 284 . 1 1 42 42 VAL N N 15 121.4 0.2 . 1 . . . . 42 VAL N . 15072 1 285 . 1 1 43 43 GLY H H 1 8.58 0.01 . 1 . . . . 43 GLY H . 15072 1 286 . 1 1 43 43 GLY HA2 H 1 3.62 0.01 . 2 . . . . 43 GLY HA2 . 15072 1 287 . 1 1 43 43 GLY HA3 H 1 3.90 0.01 . 2 . . . . 43 GLY HA3 . 15072 1 288 . 1 1 43 43 GLY CA C 13 47.4 0.2 . 1 . . . . 43 GLY CA . 15072 1 289 . 1 1 43 43 GLY N N 15 105.4 0.2 . 1 . . . . 43 GLY N . 15072 1 290 . 1 1 44 44 GLN H H 1 7.59 0.01 . 1 . . . . 44 GLN H . 15072 1 291 . 1 1 44 44 GLN HB3 H 1 2.46 0.01 . 2 . . . . 44 GLN HB3 . 15072 1 292 . 1 1 44 44 GLN HG2 H 1 2.55 0.01 . 2 . . . . 44 GLN HG2 . 15072 1 293 . 1 1 44 44 GLN HG3 H 1 2.67 0.01 . 2 . . . . 44 GLN HG3 . 15072 1 294 . 1 1 44 44 GLN HE21 H 1 6.95 0.01 . 2 . . . . 44 GLN HE21 . 15072 1 295 . 1 1 44 44 GLN HE22 H 1 7.65 0.01 . 2 . . . . 44 GLN HE22 . 15072 1 296 . 1 1 44 44 GLN CB C 13 28.9 0.2 . 1 . . . . 44 GLN CB . 15072 1 297 . 1 1 44 44 GLN CG C 13 33.7 0.2 . 1 . . . . 44 GLN CG . 15072 1 298 . 1 1 44 44 GLN N N 15 119.3 0.2 . 1 . . . . 44 GLN N . 15072 1 299 . 1 1 44 44 GLN NE2 N 15 112.5 0.2 . 1 . . . . 44 GLN NE2 . 15072 1 300 . 1 1 45 45 ILE H H 1 8.36 0.01 . 1 . . . . 45 ILE H . 15072 1 301 . 1 1 45 45 ILE HA H 1 3.83 0.01 . 1 . . . . 45 ILE HA . 15072 1 302 . 1 1 45 45 ILE HG12 H 1 1.18 0.01 . 2 . . . . 45 ILE HG12 . 15072 1 303 . 1 1 45 45 ILE HG21 H 1 1.04 0.01 . 1 . . . . 45 ILE HG2 . 15072 1 304 . 1 1 45 45 ILE HG22 H 1 1.04 0.01 . 1 . . . . 45 ILE HG2 . 15072 1 305 . 1 1 45 45 ILE HG23 H 1 1.04 0.01 . 1 . . . . 45 ILE HG2 . 15072 1 306 . 1 1 45 45 ILE HD11 H 1 1.00 0.01 . 1 . . . . 45 ILE HD1 . 15072 1 307 . 1 1 45 45 ILE HD12 H 1 1.00 0.01 . 1 . . . . 45 ILE HD1 . 15072 1 308 . 1 1 45 45 ILE HD13 H 1 1.00 0.01 . 1 . . . . 45 ILE HD1 . 15072 1 309 . 1 1 45 45 ILE CG1 C 13 29.2 0.2 . 1 . . . . 45 ILE CG1 . 15072 1 310 . 1 1 45 45 ILE CG2 C 13 17.8 0.2 . 1 . . . . 45 ILE CG2 . 15072 1 311 . 1 1 45 45 ILE CD1 C 13 14.9 0.2 . 1 . . . . 45 ILE CD1 . 15072 1 312 . 1 1 45 45 ILE N N 15 123.3 0.2 . 1 . . . . 45 ILE N . 15072 1 313 . 1 1 46 46 LEU H H 1 8.14 0.01 . 1 . . . . 46 LEU H . 15072 1 314 . 1 1 46 46 LEU HA H 1 3.99 0.01 . 1 . . . . 46 LEU HA . 15072 1 315 . 1 1 46 46 LEU HB2 H 1 1.60 0.01 . 2 . . . . 46 LEU HB2 . 15072 1 316 . 1 1 46 46 LEU HB3 H 1 1.86 0.01 . 2 . . . . 46 LEU HB3 . 15072 1 317 . 1 1 46 46 LEU HD11 H 1 0.80 0.01 . 2 . . . . 46 LEU HD1 . 15072 1 318 . 1 1 46 46 LEU HD12 H 1 0.80 0.01 . 2 . . . . 46 LEU HD1 . 15072 1 319 . 1 1 46 46 LEU HD13 H 1 0.80 0.01 . 2 . . . . 46 LEU HD1 . 15072 1 320 . 1 1 46 46 LEU HD21 H 1 0.83 0.01 . 2 . . . . 46 LEU HD2 . 15072 1 321 . 1 1 46 46 LEU HD22 H 1 0.83 0.01 . 2 . . . . 46 LEU HD2 . 15072 1 322 . 1 1 46 46 LEU HD23 H 1 0.83 0.01 . 2 . . . . 46 LEU HD2 . 15072 1 323 . 1 1 46 46 LEU CA C 13 56.6 0.2 . 1 . . . . 46 LEU CA . 15072 1 324 . 1 1 46 46 LEU CB C 13 41.5 0.2 . 1 . . . . 46 LEU CB . 15072 1 325 . 1 1 46 46 LEU CD1 C 13 22.7 0.2 . 2 . . . . 46 LEU CD1 . 15072 1 326 . 1 1 46 46 LEU CD2 C 13 25.7 0.2 . 2 . . . . 46 LEU CD2 . 15072 1 327 . 1 1 46 46 LEU N N 15 115.3 0.2 . 1 . . . . 46 LEU N . 15072 1 328 . 1 1 47 47 LYS H H 1 7.21 0.01 . 1 . . . . 47 LYS H . 15072 1 329 . 1 1 47 47 LYS HA H 1 4.29 0.01 . 1 . . . . 47 LYS HA . 15072 1 330 . 1 1 47 47 LYS HB2 H 1 1.93 0.01 . 2 . . . . 47 LYS HB2 . 15072 1 331 . 1 1 47 47 LYS CA C 13 56.4 0.2 . 1 . . . . 47 LYS CA . 15072 1 332 . 1 1 47 47 LYS N N 15 114.4 0.2 . 1 . . . . 47 LYS N . 15072 1 333 . 1 1 48 48 GLU H H 1 7.80 0.01 . 1 . . . . 48 GLU H . 15072 1 334 . 1 1 48 48 GLU HB2 H 1 2.29 0.01 . 2 . . . . 48 GLU HB2 . 15072 1 335 . 1 1 48 48 GLU HG2 H 1 2.46 0.01 . 2 . . . . 48 GLU HG2 . 15072 1 336 . 1 1 48 48 GLU HG3 H 1 2.71 0.01 . 2 . . . . 48 GLU HG3 . 15072 1 337 . 1 1 48 48 GLU CG C 13 36.5 0.2 . 1 . . . . 48 GLU CG . 15072 1 338 . 1 1 48 48 GLU N N 15 124.9 0.2 . 1 . . . . 48 GLU N . 15072 1 339 . 1 1 49 49 PRO HA H 1 4.28 0.01 . 1 . . . . 49 PRO HA . 15072 1 340 . 1 1 49 49 PRO HB3 H 1 2.48 0.01 . 2 . . . . 49 PRO HB3 . 15072 1 341 . 1 1 49 49 PRO HG2 H 1 2.16 0.01 . 2 . . . . 49 PRO HG2 . 15072 1 342 . 1 1 49 49 PRO HG3 H 1 2.30 0.01 . 2 . . . . 49 PRO HG3 . 15072 1 343 . 1 1 49 49 PRO HD2 H 1 4.01 0.01 . 2 . . . . 49 PRO HD2 . 15072 1 344 . 1 1 49 49 PRO HD3 H 1 4.18 0.01 . 2 . . . . 49 PRO HD3 . 15072 1 345 . 1 1 49 49 PRO CA C 13 66.4 0.2 . 1 . . . . 49 PRO CA . 15072 1 346 . 1 1 49 49 PRO CB C 13 32.4 0.2 . 1 . . . . 49 PRO CB . 15072 1 347 . 1 1 49 49 PRO CG C 13 27.7 0.2 . 1 . . . . 49 PRO CG . 15072 1 348 . 1 1 49 49 PRO CD C 13 50.9 0.2 . 1 . . . . 49 PRO CD . 15072 1 349 . 1 1 50 50 LYS H H 1 8.97 0.01 . 1 . . . . 50 LYS H . 15072 1 350 . 1 1 50 50 LYS HA H 1 4.23 0.01 . 1 . . . . 50 LYS HA . 15072 1 351 . 1 1 50 50 LYS HG2 H 1 1.53 0.01 . 2 . . . . 50 LYS HG2 . 15072 1 352 . 1 1 50 50 LYS CG C 13 25.3 0.2 . 1 . . . . 50 LYS CG . 15072 1 353 . 1 1 50 50 LYS N N 15 117.0 0.2 . 1 . . . . 50 LYS N . 15072 1 354 . 1 1 51 51 MET H H 1 7.76 0.01 . 1 . . . . 51 MET H . 15072 1 355 . 1 1 51 51 MET HA H 1 4.58 0.01 . 1 . . . . 51 MET HA . 15072 1 356 . 1 1 51 51 MET HB2 H 1 2.07 0.01 . 2 . . . . 51 MET HB2 . 15072 1 357 . 1 1 51 51 MET HB3 H 1 2.58 0.01 . 2 . . . . 51 MET HB3 . 15072 1 358 . 1 1 51 51 MET HG2 H 1 2.70 0.01 . 2 . . . . 51 MET HG2 . 15072 1 359 . 1 1 51 51 MET HG3 H 1 2.77 0.01 . 2 . . . . 51 MET HG3 . 15072 1 360 . 1 1 51 51 MET HE1 H 1 2.12 0.01 . 1 . . . . 51 MET HE . 15072 1 361 . 1 1 51 51 MET HE2 H 1 2.12 0.01 . 1 . . . . 51 MET HE . 15072 1 362 . 1 1 51 51 MET HE3 H 1 2.12 0.01 . 1 . . . . 51 MET HE . 15072 1 363 . 1 1 51 51 MET CA C 13 56.2 0.2 . 1 . . . . 51 MET CA . 15072 1 364 . 1 1 51 51 MET CB C 13 32.1 0.2 . 1 . . . . 51 MET CB . 15072 1 365 . 1 1 51 51 MET CG C 13 32.5 0.2 . 1 . . . . 51 MET CG . 15072 1 366 . 1 1 51 51 MET CE C 13 17.4 0.2 . 1 . . . . 51 MET CE . 15072 1 367 . 1 1 51 51 MET N N 15 119.4 0.2 . 1 . . . . 51 MET N . 15072 1 368 . 1 1 52 52 ALA H H 1 8.75 0.01 . 1 . . . . 52 ALA H . 15072 1 369 . 1 1 52 52 ALA HA H 1 4.01 0.01 . 1 . . . . 52 ALA HA . 15072 1 370 . 1 1 52 52 ALA HB1 H 1 1.55 0.01 . 1 . . . . 52 ALA HB . 15072 1 371 . 1 1 52 52 ALA HB2 H 1 1.55 0.01 . 1 . . . . 52 ALA HB . 15072 1 372 . 1 1 52 52 ALA HB3 H 1 1.55 0.01 . 1 . . . . 52 ALA HB . 15072 1 373 . 1 1 52 52 ALA CA C 13 55.8 0.2 . 1 . . . . 52 ALA CA . 15072 1 374 . 1 1 52 52 ALA CB C 13 18.2 0.2 . 1 . . . . 52 ALA CB . 15072 1 375 . 1 1 52 52 ALA N N 15 123.7 0.2 . 1 . . . . 52 ALA N . 15072 1 376 . 1 1 53 53 ALA H H 1 7.95 0.01 . 1 . . . . 53 ALA H . 15072 1 377 . 1 1 53 53 ALA HA H 1 4.23 0.01 . 1 . . . . 53 ALA HA . 15072 1 378 . 1 1 53 53 ALA HB1 H 1 1.57 0.01 . 1 . . . . 53 ALA HB . 15072 1 379 . 1 1 53 53 ALA HB2 H 1 1.57 0.01 . 1 . . . . 53 ALA HB . 15072 1 380 . 1 1 53 53 ALA HB3 H 1 1.57 0.01 . 1 . . . . 53 ALA HB . 15072 1 381 . 1 1 53 53 ALA CA C 13 54.5 0.2 . 1 . . . . 53 ALA CA . 15072 1 382 . 1 1 53 53 ALA N N 15 117.0 0.2 . 1 . . . . 53 ALA N . 15072 1 383 . 1 1 54 54 SER H H 1 7.54 0.01 . 1 . . . . 54 SER H . 15072 1 384 . 1 1 54 54 SER HA H 1 4.62 0.01 . 1 . . . . 54 SER HA . 15072 1 385 . 1 1 54 54 SER HB2 H 1 4.01 0.01 . 1 . . . . 54 SER HB2 . 15072 1 386 . 1 1 54 54 SER HB3 H 1 4.01 0.01 . 1 . . . . 54 SER HB3 . 15072 1 387 . 1 1 54 54 SER CA C 13 59.8 0.2 . 1 . . . . 54 SER CA . 15072 1 388 . 1 1 54 54 SER CB C 13 64.1 0.2 . 1 . . . . 54 SER CB . 15072 1 389 . 1 1 54 54 SER N N 15 111.2 0.2 . 1 . . . . 54 SER N . 15072 1 390 . 1 1 55 55 LEU H H 1 8.24 0.01 . 1 . . . . 55 LEU H . 15072 1 391 . 1 1 55 55 LEU HA H 1 4.17 0.01 . 1 . . . . 55 LEU HA . 15072 1 392 . 1 1 55 55 LEU HB2 H 1 1.43 0.01 . 2 . . . . 55 LEU HB2 . 15072 1 393 . 1 1 55 55 LEU HB3 H 1 1.83 0.01 . 2 . . . . 55 LEU HB3 . 15072 1 394 . 1 1 55 55 LEU HD11 H 1 0.91 0.01 . 2 . . . . 55 LEU HD1 . 15072 1 395 . 1 1 55 55 LEU HD12 H 1 0.91 0.01 . 2 . . . . 55 LEU HD1 . 15072 1 396 . 1 1 55 55 LEU HD13 H 1 0.91 0.01 . 2 . . . . 55 LEU HD1 . 15072 1 397 . 1 1 55 55 LEU HD21 H 1 0.92 0.01 . 2 . . . . 55 LEU HD2 . 15072 1 398 . 1 1 55 55 LEU HD22 H 1 0.92 0.01 . 2 . . . . 55 LEU HD2 . 15072 1 399 . 1 1 55 55 LEU HD23 H 1 0.92 0.01 . 2 . . . . 55 LEU HD2 . 15072 1 400 . 1 1 55 55 LEU CA C 13 57.2 0.2 . 1 . . . . 55 LEU CA . 15072 1 401 . 1 1 55 55 LEU CB C 13 42.4 0.2 . 1 . . . . 55 LEU CB . 15072 1 402 . 1 1 55 55 LEU CD1 C 13 23.2 0.2 . 2 . . . . 55 LEU CD1 . 15072 1 403 . 1 1 55 55 LEU CD2 C 13 26.3 0.2 . 2 . . . . 55 LEU CD2 . 15072 1 404 . 1 1 55 55 LEU N N 15 117.4 0.2 . 1 . . . . 55 LEU N . 15072 1 405 . 1 1 56 56 LEU H H 1 7.68 0.01 . 1 . . . . 56 LEU H . 15072 1 406 . 1 1 56 56 LEU HB2 H 1 1.78 0.01 . 2 . . . . 56 LEU HB2 . 15072 1 407 . 1 1 56 56 LEU HD11 H 1 0.85 0.01 . 2 . . . . 56 LEU HD1 . 15072 1 408 . 1 1 56 56 LEU HD12 H 1 0.85 0.01 . 2 . . . . 56 LEU HD1 . 15072 1 409 . 1 1 56 56 LEU HD13 H 1 0.85 0.01 . 2 . . . . 56 LEU HD1 . 15072 1 410 . 1 1 56 56 LEU CB C 13 40.9 0.2 . 1 . . . . 56 LEU CB . 15072 1 411 . 1 1 56 56 LEU CD1 C 13 22.9 0.2 . 2 . . . . 56 LEU CD1 . 15072 1 412 . 1 1 56 56 LEU N N 15 114.5 0.2 . 1 . . . . 56 LEU N . 15072 1 413 . 1 1 57 57 ASN H H 1 7.03 0.01 . 1 . . . . 57 ASN H . 15072 1 414 . 1 1 57 57 ASN HA H 1 4.97 0.01 . 1 . . . . 57 ASN HA . 15072 1 415 . 1 1 57 57 ASN HB2 H 1 2.95 0.01 . 2 . . . . 57 ASN HB2 . 15072 1 416 . 1 1 57 57 ASN HB3 H 1 3.11 0.01 . 2 . . . . 57 ASN HB3 . 15072 1 417 . 1 1 57 57 ASN HD21 H 1 7.28 0.01 . 2 . . . . 57 ASN HD21 . 15072 1 418 . 1 1 57 57 ASN HD22 H 1 7.74 0.01 . 2 . . . . 57 ASN HD22 . 15072 1 419 . 1 1 57 57 ASN N N 15 119.4 0.2 . 1 . . . . 57 ASN N . 15072 1 420 . 1 1 57 57 ASN ND2 N 15 112.6 0.2 . 1 . . . . 57 ASN ND2 . 15072 1 421 . 1 1 58 58 PRO HA H 1 4.44 0.01 . 1 . . . . 58 PRO HA . 15072 1 422 . 1 1 58 58 PRO HB2 H 1 1.52 0.01 . 2 . . . . 58 PRO HB2 . 15072 1 423 . 1 1 58 58 PRO HB3 H 1 2.22 0.01 . 2 . . . . 58 PRO HB3 . 15072 1 424 . 1 1 58 58 PRO HG2 H 1 1.44 0.01 . 2 . . . . 58 PRO HG2 . 15072 1 425 . 1 1 58 58 PRO HG3 H 1 1.94 0.01 . 2 . . . . 58 PRO HG3 . 15072 1 426 . 1 1 58 58 PRO HD2 H 1 3.85 0.01 . 2 . . . . 58 PRO HD2 . 15072 1 427 . 1 1 58 58 PRO HD3 H 1 4.06 0.01 . 2 . . . . 58 PRO HD3 . 15072 1 428 . 1 1 58 58 PRO CA C 13 64.0 0.2 . 1 . . . . 58 PRO CA . 15072 1 429 . 1 1 58 58 PRO CB C 13 32.1 0.2 . 1 . . . . 58 PRO CB . 15072 1 430 . 1 1 58 58 PRO CG C 13 26.5 0.2 . 1 . . . . 58 PRO CG . 15072 1 431 . 1 1 58 58 PRO CD C 13 51.2 0.2 . 1 . . . . 58 PRO CD . 15072 1 432 . 1 1 59 59 TYR H H 1 8.25 0.01 . 1 . . . . 59 TYR H . 15072 1 433 . 1 1 59 59 TYR HA H 1 4.67 0.01 . 1 . . . . 59 TYR HA . 15072 1 434 . 1 1 59 59 TYR HB2 H 1 2.95 0.01 . 2 . . . . 59 TYR HB2 . 15072 1 435 . 1 1 59 59 TYR HB3 H 1 3.43 0.01 . 2 . . . . 59 TYR HB3 . 15072 1 436 . 1 1 59 59 TYR HD1 H 1 7.33 0.01 . 1 . . . . 59 TYR HD1 . 15072 1 437 . 1 1 59 59 TYR HD2 H 1 7.33 0.01 . 1 . . . . 59 TYR HD2 . 15072 1 438 . 1 1 59 59 TYR HE1 H 1 6.97 0.01 . 1 . . . . 59 TYR HE1 . 15072 1 439 . 1 1 59 59 TYR HE2 H 1 6.97 0.01 . 1 . . . . 59 TYR HE2 . 15072 1 440 . 1 1 59 59 TYR CA C 13 57.8 0.2 . 1 . . . . 59 TYR CA . 15072 1 441 . 1 1 59 59 TYR CB C 13 37.6 0.2 . 1 . . . . 59 TYR CB . 15072 1 442 . 1 1 59 59 TYR CD1 C 13 133.0 0.2 . 1 . . . . 59 TYR CD1 . 15072 1 443 . 1 1 59 59 TYR CD2 C 13 133.0 0.2 . 1 . . . . 59 TYR CD2 . 15072 1 444 . 1 1 59 59 TYR CE1 C 13 118.4 0.2 . 1 . . . . 59 TYR CE1 . 15072 1 445 . 1 1 59 59 TYR CE2 C 13 118.4 0.2 . 1 . . . . 59 TYR CE2 . 15072 1 446 . 1 1 59 59 TYR N N 15 116.9 0.2 . 1 . . . . 59 TYR N . 15072 1 447 . 1 1 60 60 VAL H H 1 7.06 0.01 . 1 . . . . 60 VAL H . 15072 1 448 . 1 1 60 60 VAL HA H 1 4.18 0.01 . 1 . . . . 60 VAL HA . 15072 1 449 . 1 1 60 60 VAL HB H 1 2.07 0.01 . 1 . . . . 60 VAL HB . 15072 1 450 . 1 1 60 60 VAL HG11 H 1 1.16 0.01 . 2 . . . . 60 VAL HG1 . 15072 1 451 . 1 1 60 60 VAL HG12 H 1 1.16 0.01 . 2 . . . . 60 VAL HG1 . 15072 1 452 . 1 1 60 60 VAL HG13 H 1 1.16 0.01 . 2 . . . . 60 VAL HG1 . 15072 1 453 . 1 1 60 60 VAL HG21 H 1 1.18 0.01 . 2 . . . . 60 VAL HG2 . 15072 1 454 . 1 1 60 60 VAL HG22 H 1 1.18 0.01 . 2 . . . . 60 VAL HG2 . 15072 1 455 . 1 1 60 60 VAL HG23 H 1 1.18 0.01 . 2 . . . . 60 VAL HG2 . 15072 1 456 . 1 1 60 60 VAL CA C 13 62.3 0.2 . 1 . . . . 60 VAL CA . 15072 1 457 . 1 1 60 60 VAL CG1 C 13 21.1 0.2 . 2 . . . . 60 VAL CG1 . 15072 1 458 . 1 1 60 60 VAL CG2 C 13 22.3 0.2 . 2 . . . . 60 VAL CG2 . 15072 1 459 . 1 1 60 60 VAL N N 15 121.8 0.2 . 1 . . . . 60 VAL N . 15072 1 460 . 1 1 61 61 LYS H H 1 8.63 0.01 . 1 . . . . 61 LYS H . 15072 1 461 . 1 1 61 61 LYS HA H 1 4.31 0.01 . 1 . . . . 61 LYS HA . 15072 1 462 . 1 1 61 61 LYS HB2 H 1 1.92 0.01 . 2 . . . . 61 LYS HB2 . 15072 1 463 . 1 1 61 61 LYS HB3 H 1 2.18 0.01 . 2 . . . . 61 LYS HB3 . 15072 1 464 . 1 1 61 61 LYS HG2 H 1 1.72 0.01 . 2 . . . . 61 LYS HG2 . 15072 1 465 . 1 1 61 61 LYS HG3 H 1 1.78 0.01 . 2 . . . . 61 LYS HG3 . 15072 1 466 . 1 1 61 61 LYS HD2 H 1 1.86 0.01 . 1 . . . . 61 LYS HD2 . 15072 1 467 . 1 1 61 61 LYS HD3 H 1 1.86 0.01 . 1 . . . . 61 LYS HD3 . 15072 1 468 . 1 1 61 61 LYS HE2 H 1 3.17 0.01 . 1 . . . . 61 LYS HE2 . 15072 1 469 . 1 1 61 61 LYS HE3 H 1 3.17 0.01 . 1 . . . . 61 LYS HE3 . 15072 1 470 . 1 1 61 61 LYS CA C 13 57.1 0.2 . 1 . . . . 61 LYS CA . 15072 1 471 . 1 1 61 61 LYS CE C 13 42.3 0.2 . 1 . . . . 61 LYS CE . 15072 1 472 . 1 1 61 61 LYS N N 15 127.1 0.2 . 1 . . . . 61 LYS N . 15072 1 473 . 1 1 62 62 ARG H H 1 8.89 0.01 . 1 . . . . 62 ARG H . 15072 1 474 . 1 1 62 62 ARG HA H 1 3.99 0.01 . 1 . . . . 62 ARG HA . 15072 1 475 . 1 1 62 62 ARG HB2 H 1 2.00 0.01 . 2 . . . . 62 ARG HB2 . 15072 1 476 . 1 1 62 62 ARG HB3 H 1 2.15 0.01 . 2 . . . . 62 ARG HB3 . 15072 1 477 . 1 1 62 62 ARG HG2 H 1 1.77 0.01 . 2 . . . . 62 ARG HG2 . 15072 1 478 . 1 1 62 62 ARG HG3 H 1 1.82 0.01 . 2 . . . . 62 ARG HG3 . 15072 1 479 . 1 1 62 62 ARG HD2 H 1 3.36 0.01 . 1 . . . . 62 ARG HD2 . 15072 1 480 . 1 1 62 62 ARG HD3 H 1 3.36 0.01 . 1 . . . . 62 ARG HD3 . 15072 1 481 . 1 1 62 62 ARG CA C 13 60.3 0.2 . 1 . . . . 62 ARG CA . 15072 1 482 . 1 1 62 62 ARG CD C 13 43.5 0.2 . 1 . . . . 62 ARG CD . 15072 1 483 . 1 1 62 62 ARG N N 15 124.2 0.2 . 1 . . . . 62 ARG N . 15072 1 484 . 1 1 63 63 SER H H 1 8.65 0.01 . 1 . . . . 63 SER H . 15072 1 485 . 1 1 63 63 SER HA H 1 4.17 0.01 . 1 . . . . 63 SER HA . 15072 1 486 . 1 1 63 63 SER HB2 H 1 3.99 0.01 . 1 . . . . 63 SER HB2 . 15072 1 487 . 1 1 63 63 SER HB3 H 1 3.99 0.01 . 1 . . . . 63 SER HB3 . 15072 1 488 . 1 1 63 63 SER CB C 13 61.8 0.2 . 1 . . . . 63 SER CB . 15072 1 489 . 1 1 63 63 SER N N 15 112.1 0.2 . 1 . . . . 63 SER N . 15072 1 490 . 1 1 64 64 VAL H H 1 7.14 0.01 . 1 . . . . 64 VAL H . 15072 1 491 . 1 1 64 64 VAL HA H 1 3.85 0.01 . 1 . . . . 64 VAL HA . 15072 1 492 . 1 1 64 64 VAL HB H 1 2.35 0.01 . 1 . . . . 64 VAL HB . 15072 1 493 . 1 1 64 64 VAL HG11 H 1 1.00 0.01 . 2 . . . . 64 VAL HG1 . 15072 1 494 . 1 1 64 64 VAL HG12 H 1 1.00 0.01 . 2 . . . . 64 VAL HG1 . 15072 1 495 . 1 1 64 64 VAL HG13 H 1 1.00 0.01 . 2 . . . . 64 VAL HG1 . 15072 1 496 . 1 1 64 64 VAL HG21 H 1 1.14 0.01 . 2 . . . . 64 VAL HG2 . 15072 1 497 . 1 1 64 64 VAL HG22 H 1 1.14 0.01 . 2 . . . . 64 VAL HG2 . 15072 1 498 . 1 1 64 64 VAL HG23 H 1 1.14 0.01 . 2 . . . . 64 VAL HG2 . 15072 1 499 . 1 1 64 64 VAL CB C 13 31.9 0.2 . 1 . . . . 64 VAL CB . 15072 1 500 . 1 1 64 64 VAL CG2 C 13 22.6 0.2 . 2 . . . . 64 VAL CG2 . 15072 1 501 . 1 1 64 64 VAL N N 15 124.1 0.2 . 1 . . . . 64 VAL N . 15072 1 502 . 1 1 65 65 LYS H H 1 7.71 0.01 . 1 . . . . 65 LYS H . 15072 1 503 . 1 1 65 65 LYS HA H 1 3.99 0.01 . 1 . . . . 65 LYS HA . 15072 1 504 . 1 1 65 65 LYS HB2 H 1 1.78 0.01 . 2 . . . . 65 LYS HB2 . 15072 1 505 . 1 1 65 65 LYS CB C 13 32.6 0.2 . 1 . . . . 65 LYS CB . 15072 1 506 . 1 1 65 65 LYS N N 15 121.6 0.2 . 1 . . . . 65 LYS N . 15072 1 507 . 1 1 66 66 VAL H H 1 8.61 0.01 . 1 . . . . 66 VAL H . 15072 1 508 . 1 1 66 66 VAL HA H 1 3.66 0.01 . 1 . . . . 66 VAL HA . 15072 1 509 . 1 1 66 66 VAL HB H 1 2.15 0.01 . 1 . . . . 66 VAL HB . 15072 1 510 . 1 1 66 66 VAL HG11 H 1 1.03 0.01 . 2 . . . . 66 VAL HG1 . 15072 1 511 . 1 1 66 66 VAL HG12 H 1 1.03 0.01 . 2 . . . . 66 VAL HG1 . 15072 1 512 . 1 1 66 66 VAL HG13 H 1 1.03 0.01 . 2 . . . . 66 VAL HG1 . 15072 1 513 . 1 1 66 66 VAL HG21 H 1 1.10 0.01 . 2 . . . . 66 VAL HG2 . 15072 1 514 . 1 1 66 66 VAL HG22 H 1 1.10 0.01 . 2 . . . . 66 VAL HG2 . 15072 1 515 . 1 1 66 66 VAL HG23 H 1 1.10 0.01 . 2 . . . . 66 VAL HG2 . 15072 1 516 . 1 1 66 66 VAL CG1 C 13 21.1 0.2 . 2 . . . . 66 VAL CG1 . 15072 1 517 . 1 1 66 66 VAL CG2 C 13 22.5 0.2 . 2 . . . . 66 VAL CG2 . 15072 1 518 . 1 1 66 66 VAL N N 15 117.5 0.2 . 1 . . . . 66 VAL N . 15072 1 519 . 1 1 67 67 LYS H H 1 7.67 0.01 . 1 . . . . 67 LYS H . 15072 1 520 . 1 1 67 67 LYS HD2 H 1 1.74 0.01 . 2 . . . . 67 LYS HD2 . 15072 1 521 . 1 1 67 67 LYS HD3 H 1 1.85 0.01 . 2 . . . . 67 LYS HD3 . 15072 1 522 . 1 1 67 67 LYS CD C 13 28.7 0.2 . 1 . . . . 67 LYS CD . 15072 1 523 . 1 1 67 67 LYS N N 15 121.9 0.2 . 1 . . . . 67 LYS N . 15072 1 524 . 1 1 68 68 SER H H 1 8.25 0.01 . 1 . . . . 68 SER H . 15072 1 525 . 1 1 68 68 SER HA H 1 4.41 0.01 . 1 . . . . 68 SER HA . 15072 1 526 . 1 1 68 68 SER HB2 H 1 3.99 0.01 . 2 . . . . 68 SER HB2 . 15072 1 527 . 1 1 68 68 SER CA C 13 61.9 0.2 . 1 . . . . 68 SER CA . 15072 1 528 . 1 1 68 68 SER CB C 13 63.1 0.2 . 1 . . . . 68 SER CB . 15072 1 529 . 1 1 68 68 SER N N 15 115.4 0.2 . 1 . . . . 68 SER N . 15072 1 530 . 1 1 69 69 LEU H H 1 8.47 0.01 . 1 . . . . 69 LEU H . 15072 1 531 . 1 1 69 69 LEU HB2 H 1 1.66 0.01 . 2 . . . . 69 LEU HB2 . 15072 1 532 . 1 1 69 69 LEU HG H 1 1.90 0.01 . 1 . . . . 69 LEU HG . 15072 1 533 . 1 1 69 69 LEU CB C 13 41.7 0.2 . 1 . . . . 69 LEU CB . 15072 1 534 . 1 1 69 69 LEU CG C 13 26.7 0.2 . 1 . . . . 69 LEU CG . 15072 1 535 . 1 1 69 69 LEU N N 15 122.2 0.2 . 1 . . . . 69 LEU N . 15072 1 536 . 1 1 70 70 SER H H 1 8.43 0.01 . 1 . . . . 70 SER H . 15072 1 537 . 1 1 70 70 SER HA H 1 4.40 0.01 . 1 . . . . 70 SER HA . 15072 1 538 . 1 1 70 70 SER CA C 13 61.4 0.2 . 1 . . . . 70 SER CA . 15072 1 539 . 1 1 70 70 SER N N 15 116.9 0.2 . 1 . . . . 70 SER N . 15072 1 540 . 1 1 71 71 ASP H H 1 8.42 0.01 . 1 . . . . 71 ASP H . 15072 1 541 . 1 1 71 71 ASP HA H 1 4.53 0.01 . 1 . . . . 71 ASP HA . 15072 1 542 . 1 1 71 71 ASP HB2 H 1 2.75 0.01 . 2 . . . . 71 ASP HB2 . 15072 1 543 . 1 1 71 71 ASP HB3 H 1 2.93 0.01 . 2 . . . . 71 ASP HB3 . 15072 1 544 . 1 1 71 71 ASP CA C 13 57.2 0.2 . 1 . . . . 71 ASP CA . 15072 1 545 . 1 1 71 71 ASP CB C 13 40.3 0.2 . 1 . . . . 71 ASP CB . 15072 1 546 . 1 1 71 71 ASP N N 15 122.5 0.2 . 1 . . . . 71 ASP N . 15072 1 547 . 1 1 72 72 MET H H 1 8.00 0.01 . 1 . . . . 72 MET H . 15072 1 548 . 1 1 72 72 MET HA H 1 4.25 0.01 . 1 . . . . 72 MET HA . 15072 1 549 . 1 1 72 72 MET HB2 H 1 2.37 0.01 . 2 . . . . 72 MET HB2 . 15072 1 550 . 1 1 72 72 MET HB3 H 1 2.45 0.01 . 2 . . . . 72 MET HB3 . 15072 1 551 . 1 1 72 72 MET HG2 H 1 2.52 0.01 . 2 . . . . 72 MET HG2 . 15072 1 552 . 1 1 72 72 MET HG3 H 1 2.80 0.01 . 2 . . . . 72 MET HG3 . 15072 1 553 . 1 1 72 72 MET HE1 H 1 2.11 0.01 . 1 . . . . 72 MET HE . 15072 1 554 . 1 1 72 72 MET HE2 H 1 2.11 0.01 . 1 . . . . 72 MET HE . 15072 1 555 . 1 1 72 72 MET HE3 H 1 2.11 0.01 . 1 . . . . 72 MET HE . 15072 1 556 . 1 1 72 72 MET CG C 13 31.6 0.2 . 1 . . . . 72 MET CG . 15072 1 557 . 1 1 72 72 MET CE C 13 17.0 0.2 . 1 . . . . 72 MET CE . 15072 1 558 . 1 1 72 72 MET N N 15 120.3 0.2 . 1 . . . . 72 MET N . 15072 1 559 . 1 1 73 73 THR H H 1 8.72 0.01 . 1 . . . . 73 THR H . 15072 1 560 . 1 1 73 73 THR HB H 1 4.49 0.01 . 1 . . . . 73 THR HB . 15072 1 561 . 1 1 73 73 THR HG21 H 1 1.45 0.01 . 1 . . . . 73 THR HG2 . 15072 1 562 . 1 1 73 73 THR HG22 H 1 1.45 0.01 . 1 . . . . 73 THR HG2 . 15072 1 563 . 1 1 73 73 THR HG23 H 1 1.45 0.01 . 1 . . . . 73 THR HG2 . 15072 1 564 . 1 1 73 73 THR CB C 13 68.6 0.2 . 1 . . . . 73 THR CB . 15072 1 565 . 1 1 73 73 THR CG2 C 13 22.2 0.2 . 1 . . . . 73 THR CG2 . 15072 1 566 . 1 1 73 73 THR N N 15 112.2 0.2 . 1 . . . . 73 THR N . 15072 1 567 . 1 1 74 74 ALA H H 1 7.83 0.01 . 1 . . . . 74 ALA H . 15072 1 568 . 1 1 74 74 ALA HA H 1 4.30 0.01 . 1 . . . . 74 ALA HA . 15072 1 569 . 1 1 74 74 ALA HB1 H 1 1.59 0.01 . 1 . . . . 74 ALA HB . 15072 1 570 . 1 1 74 74 ALA HB2 H 1 1.59 0.01 . 1 . . . . 74 ALA HB . 15072 1 571 . 1 1 74 74 ALA HB3 H 1 1.59 0.01 . 1 . . . . 74 ALA HB . 15072 1 572 . 1 1 74 74 ALA CA C 13 54.7 0.2 . 1 . . . . 74 ALA CA . 15072 1 573 . 1 1 74 74 ALA N N 15 124.2 0.2 . 1 . . . . 74 ALA N . 15072 1 574 . 1 1 75 75 LYS H H 1 7.91 0.01 . 1 . . . . 75 LYS H . 15072 1 575 . 1 1 75 75 LYS HB2 H 1 1.95 0.01 . 2 . . . . 75 LYS HB2 . 15072 1 576 . 1 1 75 75 LYS HB3 H 1 1.98 0.01 . 2 . . . . 75 LYS HB3 . 15072 1 577 . 1 1 75 75 LYS HG2 H 1 1.47 0.01 . 2 . . . . 75 LYS HG2 . 15072 1 578 . 1 1 75 75 LYS HE2 H 1 3.04 0.01 . 1 . . . . 75 LYS HE2 . 15072 1 579 . 1 1 75 75 LYS HE3 H 1 3.04 0.01 . 1 . . . . 75 LYS HE3 . 15072 1 580 . 1 1 75 75 LYS CB C 13 32.9 0.2 . 1 . . . . 75 LYS CB . 15072 1 581 . 1 1 75 75 LYS CG C 13 24.9 0.2 . 1 . . . . 75 LYS CG . 15072 1 582 . 1 1 75 75 LYS N N 15 118.6 0.2 . 1 . . . . 75 LYS N . 15072 1 583 . 1 1 76 76 GLU H H 1 7.85 0.01 . 1 . . . . 76 GLU H . 15072 1 584 . 1 1 76 76 GLU HA H 1 3.86 0.01 . 1 . . . . 76 GLU HA . 15072 1 585 . 1 1 76 76 GLU HB2 H 1 0.62 0.01 . 2 . . . . 76 GLU HB2 . 15072 1 586 . 1 1 76 76 GLU HG2 H 1 1.93 0.01 . 2 . . . . 76 GLU HG2 . 15072 1 587 . 1 1 76 76 GLU HG3 H 1 2.18 0.01 . 2 . . . . 76 GLU HG3 . 15072 1 588 . 1 1 76 76 GLU CA C 13 55.8 0.2 . 1 . . . . 76 GLU CA . 15072 1 589 . 1 1 76 76 GLU CB C 13 28.6 0.2 . 1 . . . . 76 GLU CB . 15072 1 590 . 1 1 76 76 GLU CG C 13 36.1 0.2 . 1 . . . . 76 GLU CG . 15072 1 591 . 1 1 76 76 GLU N N 15 115.7 0.2 . 1 . . . . 76 GLU N . 15072 1 592 . 1 1 77 77 LYS H H 1 7.66 0.01 . 1 . . . . 77 LYS H . 15072 1 593 . 1 1 77 77 LYS HA H 1 4.01 0.01 . 1 . . . . 77 LYS HA . 15072 1 594 . 1 1 77 77 LYS HG2 H 1 1.37 0.01 . 1 . . . . 77 LYS HG2 . 15072 1 595 . 1 1 77 77 LYS HG3 H 1 1.37 0.01 . 1 . . . . 77 LYS HG3 . 15072 1 596 . 1 1 77 77 LYS HD2 H 1 1.71 0.01 . 2 . . . . 77 LYS HD2 . 15072 1 597 . 1 1 77 77 LYS HE2 H 1 3.08 0.01 . 1 . . . . 77 LYS HE2 . 15072 1 598 . 1 1 77 77 LYS HE3 H 1 3.08 0.01 . 1 . . . . 77 LYS HE3 . 15072 1 599 . 1 1 77 77 LYS CG C 13 24.7 0.2 . 1 . . . . 77 LYS CG . 15072 1 600 . 1 1 77 77 LYS CD C 13 29.1 0.2 . 1 . . . . 77 LYS CD . 15072 1 601 . 1 1 77 77 LYS N N 15 115.4 0.2 . 1 . . . . 77 LYS N . 15072 1 602 . 1 1 78 78 PHE H H 1 7.43 0.01 . 1 . . . . 78 PHE H . 15072 1 603 . 1 1 78 78 PHE HA H 1 4.90 0.01 . 1 . . . . 78 PHE HA . 15072 1 604 . 1 1 78 78 PHE HB2 H 1 2.87 0.01 . 2 . . . . 78 PHE HB2 . 15072 1 605 . 1 1 78 78 PHE HD1 H 1 7.19 0.01 . 1 . . . . 78 PHE HD1 . 15072 1 606 . 1 1 78 78 PHE HD2 H 1 7.19 0.01 . 1 . . . . 78 PHE HD2 . 15072 1 607 . 1 1 78 78 PHE HE1 H 1 7.26 0.01 . 1 . . . . 78 PHE HE1 . 15072 1 608 . 1 1 78 78 PHE HE2 H 1 7.26 0.01 . 1 . . . . 78 PHE HE2 . 15072 1 609 . 1 1 78 78 PHE HZ H 1 6.99 0.01 . 1 . . . . 78 PHE HZ . 15072 1 610 . 1 1 78 78 PHE CB C 13 40.0 0.2 . 1 . . . . 78 PHE CB . 15072 1 611 . 1 1 78 78 PHE CD1 C 13 130.1 0.2 . 1 . . . . 78 PHE CD1 . 15072 1 612 . 1 1 78 78 PHE CD2 C 13 130.1 0.2 . 1 . . . . 78 PHE CD2 . 15072 1 613 . 1 1 78 78 PHE CE1 C 13 131.7 0.2 . 1 . . . . 78 PHE CE1 . 15072 1 614 . 1 1 78 78 PHE CE2 C 13 131.7 0.2 . 1 . . . . 78 PHE CE2 . 15072 1 615 . 1 1 78 78 PHE CZ C 13 129.7 0.2 . 1 . . . . 78 PHE CZ . 15072 1 616 . 1 1 78 78 PHE N N 15 117.0 0.2 . 1 . . . . 78 PHE N . 15072 1 617 . 1 1 79 79 SER H H 1 10.22 0.01 . 1 . . . . 79 SER H . 15072 1 618 . 1 1 79 79 SER N N 15 119.2 0.2 . 1 . . . . 79 SER N . 15072 1 619 . 1 1 80 80 PRO HA H 1 4.41 0.01 . 1 . . . . 80 PRO HA . 15072 1 620 . 1 1 80 80 PRO HB3 H 1 2.48 0.01 . 2 . . . . 80 PRO HB3 . 15072 1 621 . 1 1 80 80 PRO HG2 H 1 2.26 0.01 . 1 . . . . 80 PRO HG2 . 15072 1 622 . 1 1 80 80 PRO HG3 H 1 2.26 0.01 . 1 . . . . 80 PRO HG3 . 15072 1 623 . 1 1 80 80 PRO HD3 H 1 4.04 0.01 . 2 . . . . 80 PRO HD3 . 15072 1 624 . 1 1 80 80 PRO CA C 13 65.4 0.2 . 1 . . . . 80 PRO CA . 15072 1 625 . 1 1 80 80 PRO CB C 13 31.9 0.2 . 1 . . . . 80 PRO CB . 15072 1 626 . 1 1 80 80 PRO CG C 13 28.1 0.2 . 1 . . . . 80 PRO CG . 15072 1 627 . 1 1 80 80 PRO CD C 13 50.9 0.2 . 1 . . . . 80 PRO CD . 15072 1 628 . 1 1 81 81 LEU H H 1 5.72 0.01 . 1 . . . . 81 LEU H . 15072 1 629 . 1 1 81 81 LEU HB2 H 1 1.13 0.01 . 2 . . . . 81 LEU HB2 . 15072 1 630 . 1 1 81 81 LEU HD11 H 1 0.80 0.01 . 2 . . . . 81 LEU HD1 . 15072 1 631 . 1 1 81 81 LEU HD12 H 1 0.80 0.01 . 2 . . . . 81 LEU HD1 . 15072 1 632 . 1 1 81 81 LEU HD13 H 1 0.80 0.01 . 2 . . . . 81 LEU HD1 . 15072 1 633 . 1 1 81 81 LEU HD21 H 1 0.82 0.01 . 2 . . . . 81 LEU HD2 . 15072 1 634 . 1 1 81 81 LEU HD22 H 1 0.82 0.01 . 2 . . . . 81 LEU HD2 . 15072 1 635 . 1 1 81 81 LEU HD23 H 1 0.82 0.01 . 2 . . . . 81 LEU HD2 . 15072 1 636 . 1 1 81 81 LEU CB C 13 42.2 0.2 . 1 . . . . 81 LEU CB . 15072 1 637 . 1 1 81 81 LEU CD1 C 13 26.2 0.2 . 2 . . . . 81 LEU CD1 . 15072 1 638 . 1 1 81 81 LEU CD2 C 13 24.1 0.2 . 2 . . . . 81 LEU CD2 . 15072 1 639 . 1 1 82 82 THR H H 1 7.29 0.01 . 1 . . . . 82 THR H . 15072 1 640 . 1 1 82 82 THR HG21 H 1 0.50 0.01 . 1 . . . . 82 THR HG2 . 15072 1 641 . 1 1 82 82 THR HG22 H 1 0.50 0.01 . 1 . . . . 82 THR HG2 . 15072 1 642 . 1 1 82 82 THR HG23 H 1 0.50 0.01 . 1 . . . . 82 THR HG2 . 15072 1 643 . 1 1 82 82 THR CG2 C 13 23.0 0.2 . 1 . . . . 82 THR CG2 . 15072 1 644 . 1 1 82 82 THR N N 15 118.1 0.2 . 1 . . . . 82 THR N . 15072 1 645 . 1 1 83 83 SER H H 1 8.57 0.01 . 1 . . . . 83 SER H . 15072 1 646 . 1 1 83 83 SER HA H 1 3.99 0.01 . 1 . . . . 83 SER HA . 15072 1 647 . 1 1 83 83 SER CA C 13 62.7 0.2 . 1 . . . . 83 SER CA . 15072 1 648 . 1 1 83 83 SER N N 15 116.4 0.2 . 1 . . . . 83 SER N . 15072 1 649 . 1 1 84 84 ASN HD21 H 1 6.96 0.01 . 2 . . . . 84 ASN HD21 . 15072 1 650 . 1 1 84 84 ASN HD22 H 1 7.67 0.01 . 2 . . . . 84 ASN HD22 . 15072 1 651 . 1 1 84 84 ASN ND2 N 15 112.5 0.2 . 1 . . . . 84 ASN ND2 . 15072 1 652 . 1 1 85 85 LEU HB2 H 1 1.65 0.01 . 2 . . . . 85 LEU HB2 . 15072 1 653 . 1 1 85 85 LEU HD11 H 1 0.91 0.01 . 2 . . . . 85 LEU HD1 . 15072 1 654 . 1 1 85 85 LEU HD12 H 1 0.91 0.01 . 2 . . . . 85 LEU HD1 . 15072 1 655 . 1 1 85 85 LEU HD13 H 1 0.91 0.01 . 2 . . . . 85 LEU HD1 . 15072 1 656 . 1 1 85 85 LEU HD21 H 1 0.95 0.01 . 2 . . . . 85 LEU HD2 . 15072 1 657 . 1 1 85 85 LEU HD22 H 1 0.95 0.01 . 2 . . . . 85 LEU HD2 . 15072 1 658 . 1 1 85 85 LEU HD23 H 1 0.95 0.01 . 2 . . . . 85 LEU HD2 . 15072 1 659 . 1 1 85 85 LEU CB C 13 40.8 0.2 . 1 . . . . 85 LEU CB . 15072 1 660 . 1 1 85 85 LEU CD1 C 13 26.1 0.2 . 2 . . . . 85 LEU CD1 . 15072 1 661 . 1 1 85 85 LEU CD2 C 13 23.5 0.2 . 2 . . . . 85 LEU CD2 . 15072 1 662 . 1 1 86 86 ILE HA H 1 3.68 0.01 . 1 . . . . 86 ILE HA . 15072 1 663 . 1 1 86 86 ILE HB H 1 2.01 0.01 . 1 . . . . 86 ILE HB . 15072 1 664 . 1 1 86 86 ILE HG12 H 1 1.36 0.01 . 2 . . . . 86 ILE HG12 . 15072 1 665 . 1 1 86 86 ILE HG13 H 1 1.54 0.01 . 2 . . . . 86 ILE HG13 . 15072 1 666 . 1 1 86 86 ILE HG21 H 1 0.92 0.01 . 1 . . . . 86 ILE HG2 . 15072 1 667 . 1 1 86 86 ILE HG22 H 1 0.92 0.01 . 1 . . . . 86 ILE HG2 . 15072 1 668 . 1 1 86 86 ILE HG23 H 1 0.92 0.01 . 1 . . . . 86 ILE HG2 . 15072 1 669 . 1 1 86 86 ILE HD11 H 1 0.70 0.01 . 1 . . . . 86 ILE HD1 . 15072 1 670 . 1 1 86 86 ILE HD12 H 1 0.70 0.01 . 1 . . . . 86 ILE HD1 . 15072 1 671 . 1 1 86 86 ILE HD13 H 1 0.70 0.01 . 1 . . . . 86 ILE HD1 . 15072 1 672 . 1 1 86 86 ILE CA C 13 64.8 0.2 . 1 . . . . 86 ILE CA . 15072 1 673 . 1 1 86 86 ILE CB C 13 36.8 0.2 . 1 . . . . 86 ILE CB . 15072 1 674 . 1 1 86 86 ILE CG1 C 13 27.8 0.2 . 1 . . . . 86 ILE CG1 . 15072 1 675 . 1 1 86 86 ILE CG2 C 13 18.2 0.2 . 1 . . . . 86 ILE CG2 . 15072 1 676 . 1 1 86 86 ILE CD1 C 13 12.4 0.2 . 1 . . . . 86 ILE CD1 . 15072 1 677 . 1 1 87 87 ASN H H 1 8.07 0.01 . 1 . . . . 87 ASN H . 15072 1 678 . 1 1 87 87 ASN HA H 1 4.44 0.01 . 1 . . . . 87 ASN HA . 15072 1 679 . 1 1 87 87 ASN HB2 H 1 2.84 0.01 . 2 . . . . 87 ASN HB2 . 15072 1 680 . 1 1 87 87 ASN HB3 H 1 2.90 0.01 . 2 . . . . 87 ASN HB3 . 15072 1 681 . 1 1 87 87 ASN HD21 H 1 6.86 0.01 . 2 . . . . 87 ASN HD21 . 15072 1 682 . 1 1 87 87 ASN HD22 H 1 7.66 0.01 . 2 . . . . 87 ASN HD22 . 15072 1 683 . 1 1 87 87 ASN N N 15 117.9 0.2 . 1 . . . . 87 ASN N . 15072 1 684 . 1 1 87 87 ASN ND2 N 15 112.1 0.2 . 1 . . . . 87 ASN ND2 . 15072 1 685 . 1 1 88 88 LEU H H 1 8.19 0.01 . 1 . . . . 88 LEU H . 15072 1 686 . 1 1 88 88 LEU N N 15 122.9 0.2 . 1 . . . . 88 LEU N . 15072 1 687 . 1 1 89 89 LEU HA H 1 3.76 0.01 . 1 . . . . 89 LEU HA . 15072 1 688 . 1 1 89 89 LEU HB2 H 1 0.78 0.01 . 2 . . . . 89 LEU HB2 . 15072 1 689 . 1 1 89 89 LEU HD21 H 1 0.77 0.01 . 2 . . . . 89 LEU HD2 . 15072 1 690 . 1 1 89 89 LEU HD22 H 1 0.77 0.01 . 2 . . . . 89 LEU HD2 . 15072 1 691 . 1 1 89 89 LEU HD23 H 1 0.77 0.01 . 2 . . . . 89 LEU HD2 . 15072 1 692 . 1 1 89 89 LEU CA C 13 58.3 0.2 . 1 . . . . 89 LEU CA . 15072 1 693 . 1 1 89 89 LEU CB C 13 41.5 0.2 . 1 . . . . 89 LEU CB . 15072 1 694 . 1 1 89 89 LEU CD2 C 13 26.3 0.2 . 2 . . . . 89 LEU CD2 . 15072 1 695 . 1 1 90 90 ALA HB1 H 1 1.57 0.01 . 1 . . . . 90 ALA HB . 15072 1 696 . 1 1 90 90 ALA HB2 H 1 1.57 0.01 . 1 . . . . 90 ALA HB . 15072 1 697 . 1 1 90 90 ALA HB3 H 1 1.57 0.01 . 1 . . . . 90 ALA HB . 15072 1 698 . 1 1 90 90 ALA CB C 13 18.6 0.2 . 1 . . . . 90 ALA CB . 15072 1 699 . 1 1 91 91 GLU H H 1 8.80 0.01 . 1 . . . . 91 GLU H . 15072 1 700 . 1 1 91 91 GLU HB2 H 1 2.16 0.01 . 2 . . . . 91 GLU HB2 . 15072 1 701 . 1 1 91 91 GLU HG2 H 1 2.38 0.01 . 2 . . . . 91 GLU HG2 . 15072 1 702 . 1 1 91 91 GLU HG3 H 1 2.46 0.01 . 2 . . . . 91 GLU HG3 . 15072 1 703 . 1 1 91 91 GLU CG C 13 36.2 0.2 . 1 . . . . 91 GLU CG . 15072 1 704 . 1 1 91 91 GLU N N 15 120.7 0.2 . 1 . . . . 91 GLU N . 15072 1 705 . 1 1 92 92 ASN H H 1 7.95 0.01 . 1 . . . . 92 ASN H . 15072 1 706 . 1 1 92 92 ASN N N 15 114.1 0.2 . 1 . . . . 92 ASN N . 15072 1 707 . 1 1 93 93 GLY H H 1 7.86 0.01 . 1 . . . . 93 GLY H . 15072 1 708 . 1 1 93 93 GLY HA2 H 1 4.11 0.01 . 2 . . . . 93 GLY HA2 . 15072 1 709 . 1 1 93 93 GLY CA C 13 47.7 0.2 . 1 . . . . 93 GLY CA . 15072 1 710 . 1 1 93 93 GLY N N 15 109.1 0.2 . 1 . . . . 93 GLY N . 15072 1 711 . 1 1 94 94 ARG H H 1 8.69 0.01 . 1 . . . . 94 ARG H . 15072 1 712 . 1 1 94 94 ARG N N 15 116.4 0.2 . 1 . . . . 94 ARG N . 15072 1 713 . 1 1 95 95 LEU H H 1 8.54 0.01 . 1 . . . . 95 LEU H . 15072 1 714 . 1 1 95 95 LEU HA H 1 3.94 0.01 . 1 . . . . 95 LEU HA . 15072 1 715 . 1 1 95 95 LEU HG H 1 1.60 0.01 . 1 . . . . 95 LEU HG . 15072 1 716 . 1 1 95 95 LEU CA C 13 58.6 0.2 . 1 . . . . 95 LEU CA . 15072 1 717 . 1 1 95 95 LEU N N 15 122.7 0.2 . 1 . . . . 95 LEU N . 15072 1 718 . 1 1 96 96 THR H H 1 5.70 0.01 . 1 . . . . 96 THR H . 15072 1 719 . 1 1 96 96 THR HA H 1 4.09 0.01 . 1 . . . . 96 THR HA . 15072 1 720 . 1 1 96 96 THR HB H 1 4.32 0.01 . 1 . . . . 96 THR HB . 15072 1 721 . 1 1 96 96 THR HG21 H 1 1.32 0.01 . 1 . . . . 96 THR HG2 . 15072 1 722 . 1 1 96 96 THR HG22 H 1 1.32 0.01 . 1 . . . . 96 THR HG2 . 15072 1 723 . 1 1 96 96 THR HG23 H 1 1.32 0.01 . 1 . . . . 96 THR HG2 . 15072 1 724 . 1 1 96 96 THR CA C 13 64.7 0.2 . 1 . . . . 96 THR CA . 15072 1 725 . 1 1 96 96 THR CB C 13 68.5 0.2 . 1 . . . . 96 THR CB . 15072 1 726 . 1 1 96 96 THR CG2 C 13 22.0 0.2 . 1 . . . . 96 THR CG2 . 15072 1 727 . 1 1 97 97 ASN H H 1 7.81 0.01 . 1 . . . . 97 ASN H . 15072 1 728 . 1 1 97 97 ASN HA H 1 5.15 0.01 . 1 . . . . 97 ASN HA . 15072 1 729 . 1 1 97 97 ASN N N 15 117.1 0.2 . 1 . . . . 97 ASN N . 15072 1 730 . 1 1 98 98 THR H H 1 7.77 0.01 . 1 . . . . 98 THR H . 15072 1 731 . 1 1 98 98 THR HA H 1 3.67 0.01 . 1 . . . . 98 THR HA . 15072 1 732 . 1 1 98 98 THR HB H 1 4.11 0.01 . 1 . . . . 98 THR HB . 15072 1 733 . 1 1 98 98 THR HG21 H 1 1.03 0.01 . 1 . . . . 98 THR HG2 . 15072 1 734 . 1 1 98 98 THR HG22 H 1 1.03 0.01 . 1 . . . . 98 THR HG2 . 15072 1 735 . 1 1 98 98 THR HG23 H 1 1.03 0.01 . 1 . . . . 98 THR HG2 . 15072 1 736 . 1 1 98 98 THR CA C 13 69.9 0.2 . 1 . . . . 98 THR CA . 15072 1 737 . 1 1 98 98 THR CB C 13 65.7 0.2 . 1 . . . . 98 THR CB . 15072 1 738 . 1 1 98 98 THR CG2 C 13 22.3 0.2 . 1 . . . . 98 THR CG2 . 15072 1 739 . 1 1 98 98 THR N N 15 116.0 0.2 . 1 . . . . 98 THR N . 15072 1 740 . 1 1 99 99 PRO HA H 1 4.22 0.01 . 1 . . . . 99 PRO HA . 15072 1 741 . 1 1 99 99 PRO HB3 H 1 2.44 0.01 . 2 . . . . 99 PRO HB3 . 15072 1 742 . 1 1 99 99 PRO HD2 H 1 3.57 0.01 . 2 . . . . 99 PRO HD2 . 15072 1 743 . 1 1 99 99 PRO HD3 H 1 3.80 0.01 . 2 . . . . 99 PRO HD3 . 15072 1 744 . 1 1 99 99 PRO CA C 13 67.0 0.2 . 1 . . . . 99 PRO CA . 15072 1 745 . 1 1 99 99 PRO CB C 13 30.6 0.2 . 1 . . . . 99 PRO CB . 15072 1 746 . 1 1 99 99 PRO CD C 13 50.6 0.2 . 1 . . . . 99 PRO CD . 15072 1 747 . 1 1 100 100 ALA H H 1 7.57 0.01 . 1 . . . . 100 ALA H . 15072 1 748 . 1 1 100 100 ALA HB1 H 1 1.60 0.01 . 1 . . . . 100 ALA HB . 15072 1 749 . 1 1 100 100 ALA HB2 H 1 1.60 0.01 . 1 . . . . 100 ALA HB . 15072 1 750 . 1 1 100 100 ALA HB3 H 1 1.60 0.01 . 1 . . . . 100 ALA HB . 15072 1 751 . 1 1 100 100 ALA N N 15 120.0 0.2 . 1 . . . . 100 ALA N . 15072 1 752 . 1 1 101 101 VAL H H 1 7.91 0.01 . 1 . . . . 101 VAL H . 15072 1 753 . 1 1 101 101 VAL HA H 1 3.72 0.01 . 1 . . . . 101 VAL HA . 15072 1 754 . 1 1 101 101 VAL HG21 H 1 1.23 0.01 . 2 . . . . 101 VAL HG2 . 15072 1 755 . 1 1 101 101 VAL HG22 H 1 1.23 0.01 . 2 . . . . 101 VAL HG2 . 15072 1 756 . 1 1 101 101 VAL HG23 H 1 1.23 0.01 . 2 . . . . 101 VAL HG2 . 15072 1 757 . 1 1 101 101 VAL N N 15 120.9 0.2 . 1 . . . . 101 VAL N . 15072 1 758 . 1 1 102 102 ILE H H 1 8.28 0.01 . 1 . . . . 102 ILE H . 15072 1 759 . 1 1 102 102 ILE HA H 1 3.59 0.01 . 1 . . . . 102 ILE HA . 15072 1 760 . 1 1 102 102 ILE HB H 1 1.99 0.01 . 1 . . . . 102 ILE HB . 15072 1 761 . 1 1 102 102 ILE HG21 H 1 0.95 0.01 . 1 . . . . 102 ILE HG2 . 15072 1 762 . 1 1 102 102 ILE HG22 H 1 0.95 0.01 . 1 . . . . 102 ILE HG2 . 15072 1 763 . 1 1 102 102 ILE HG23 H 1 0.95 0.01 . 1 . . . . 102 ILE HG2 . 15072 1 764 . 1 1 102 102 ILE HD11 H 1 0.82 0.01 . 1 . . . . 102 ILE HD1 . 15072 1 765 . 1 1 102 102 ILE HD12 H 1 0.82 0.01 . 1 . . . . 102 ILE HD1 . 15072 1 766 . 1 1 102 102 ILE HD13 H 1 0.82 0.01 . 1 . . . . 102 ILE HD1 . 15072 1 767 . 1 1 102 102 ILE CB C 13 38.1 0.2 . 1 . . . . 102 ILE CB . 15072 1 768 . 1 1 102 102 ILE CG2 C 13 16.5 0.2 . 1 . . . . 102 ILE CG2 . 15072 1 769 . 1 1 102 102 ILE CD1 C 13 14.3 0.2 . 1 . . . . 102 ILE CD1 . 15072 1 770 . 1 1 102 102 ILE N N 15 119.6 0.2 . 1 . . . . 102 ILE N . 15072 1 771 . 1 1 103 103 SER H H 1 8.39 0.01 . 1 . . . . 103 SER H . 15072 1 772 . 1 1 103 103 SER HA H 1 4.30 0.01 . 1 . . . . 103 SER HA . 15072 1 773 . 1 1 103 103 SER CA C 13 61.8 0.2 . 1 . . . . 103 SER CA . 15072 1 774 . 1 1 103 103 SER N N 15 114.5 0.2 . 1 . . . . 103 SER N . 15072 1 775 . 1 1 104 104 ALA H H 1 8.17 0.01 . 1 . . . . 104 ALA H . 15072 1 776 . 1 1 104 104 ALA HB1 H 1 1.50 0.01 . 1 . . . . 104 ALA HB . 15072 1 777 . 1 1 104 104 ALA HB2 H 1 1.50 0.01 . 1 . . . . 104 ALA HB . 15072 1 778 . 1 1 104 104 ALA HB3 H 1 1.50 0.01 . 1 . . . . 104 ALA HB . 15072 1 779 . 1 1 104 104 ALA CB C 13 18.3 0.2 . 1 . . . . 104 ALA CB . 15072 1 780 . 1 1 104 104 ALA N N 15 124.5 0.2 . 1 . . . . 104 ALA N . 15072 1 781 . 1 1 105 105 PHE H H 1 8.72 0.01 . 1 . . . . 105 PHE H . 15072 1 782 . 1 1 105 105 PHE HB2 H 1 3.03 0.01 . 2 . . . . 105 PHE HB2 . 15072 1 783 . 1 1 105 105 PHE HD1 H 1 7.32 0.01 . 1 . . . . 105 PHE HD1 . 15072 1 784 . 1 1 105 105 PHE HD2 H 1 7.32 0.01 . 1 . . . . 105 PHE HD2 . 15072 1 785 . 1 1 105 105 PHE HE1 H 1 7.09 0.01 . 1 . . . . 105 PHE HE1 . 15072 1 786 . 1 1 105 105 PHE HE2 H 1 7.09 0.01 . 1 . . . . 105 PHE HE2 . 15072 1 787 . 1 1 105 105 PHE CB C 13 39.8 0.2 . 1 . . . . 105 PHE CB . 15072 1 788 . 1 1 105 105 PHE CD1 C 13 131.9 0.2 . 1 . . . . 105 PHE CD1 . 15072 1 789 . 1 1 105 105 PHE CD2 C 13 131.9 0.2 . 1 . . . . 105 PHE CD2 . 15072 1 790 . 1 1 105 105 PHE CE1 C 13 130.3 0.2 . 1 . . . . 105 PHE CE1 . 15072 1 791 . 1 1 105 105 PHE CE2 C 13 130.3 0.2 . 1 . . . . 105 PHE CE2 . 15072 1 792 . 1 1 105 105 PHE N N 15 120.2 0.2 . 1 . . . . 105 PHE N . 15072 1 793 . 1 1 106 106 SER H H 1 9.10 0.01 . 1 . . . . 106 SER H . 15072 1 794 . 1 1 106 106 SER HA H 1 4.21 0.01 . 1 . . . . 106 SER HA . 15072 1 795 . 1 1 106 106 SER HB2 H 1 4.29 0.01 . 1 . . . . 106 SER HB2 . 15072 1 796 . 1 1 106 106 SER HB3 H 1 4.29 0.01 . 1 . . . . 106 SER HB3 . 15072 1 797 . 1 1 106 106 SER CA C 13 62.9 0.2 . 1 . . . . 106 SER CA . 15072 1 798 . 1 1 106 106 SER N N 15 115.8 0.2 . 1 . . . . 106 SER N . 15072 1 799 . 1 1 107 107 THR H H 1 8.42 0.01 . 1 . . . . 107 THR H . 15072 1 800 . 1 1 107 107 THR HA H 1 4.01 0.01 . 1 . . . . 107 THR HA . 15072 1 801 . 1 1 107 107 THR HB H 1 4.44 0.01 . 1 . . . . 107 THR HB . 15072 1 802 . 1 1 107 107 THR HG21 H 1 1.23 0.01 . 1 . . . . 107 THR HG2 . 15072 1 803 . 1 1 107 107 THR HG22 H 1 1.23 0.01 . 1 . . . . 107 THR HG2 . 15072 1 804 . 1 1 107 107 THR HG23 H 1 1.23 0.01 . 1 . . . . 107 THR HG2 . 15072 1 805 . 1 1 107 107 THR CA C 13 67.4 0.2 . 1 . . . . 107 THR CA . 15072 1 806 . 1 1 107 107 THR CB C 13 68.3 0.2 . 1 . . . . 107 THR CB . 15072 1 807 . 1 1 107 107 THR CG2 C 13 21.6 0.2 . 1 . . . . 107 THR CG2 . 15072 1 808 . 1 1 107 107 THR N N 15 121.3 0.2 . 1 . . . . 107 THR N . 15072 1 809 . 1 1 108 108 MET HE1 H 1 2.16 0.01 . 1 . . . . 108 MET HE . 15072 1 810 . 1 1 108 108 MET HE2 H 1 2.16 0.01 . 1 . . . . 108 MET HE . 15072 1 811 . 1 1 108 108 MET HE3 H 1 2.16 0.01 . 1 . . . . 108 MET HE . 15072 1 812 . 1 1 108 108 MET CE C 13 16.9 0.2 . 1 . . . . 108 MET CE . 15072 1 813 . 1 1 109 109 MET HE1 H 1 2.16 0.01 . 1 . . . . 109 MET HE . 15072 1 814 . 1 1 109 109 MET HE2 H 1 2.16 0.01 . 1 . . . . 109 MET HE . 15072 1 815 . 1 1 109 109 MET HE3 H 1 2.16 0.01 . 1 . . . . 109 MET HE . 15072 1 816 . 1 1 109 109 MET CE C 13 16.9 0.2 . 1 . . . . 109 MET CE . 15072 1 817 . 1 1 110 110 SER H H 1 8.29 0.01 . 1 . . . . 110 SER H . 15072 1 818 . 1 1 110 110 SER HA H 1 4.30 0.01 . 1 . . . . 110 SER HA . 15072 1 819 . 1 1 110 110 SER CA C 13 62.1 0.2 . 1 . . . . 110 SER CA . 15072 1 820 . 1 1 110 110 SER N N 15 117.2 0.2 . 1 . . . . 110 SER N . 15072 1 821 . 1 1 111 111 VAL H H 1 7.81 0.01 . 1 . . . . 111 VAL H . 15072 1 822 . 1 1 111 111 VAL HA H 1 3.92 0.01 . 1 . . . . 111 VAL HA . 15072 1 823 . 1 1 111 111 VAL HG11 H 1 0.92 0.01 . 2 . . . . 111 VAL HG1 . 15072 1 824 . 1 1 111 111 VAL HG12 H 1 0.92 0.01 . 2 . . . . 111 VAL HG1 . 15072 1 825 . 1 1 111 111 VAL HG13 H 1 0.92 0.01 . 2 . . . . 111 VAL HG1 . 15072 1 826 . 1 1 111 111 VAL HG21 H 1 1.04 0.01 . 2 . . . . 111 VAL HG2 . 15072 1 827 . 1 1 111 111 VAL HG22 H 1 1.04 0.01 . 2 . . . . 111 VAL HG2 . 15072 1 828 . 1 1 111 111 VAL HG23 H 1 1.04 0.01 . 2 . . . . 111 VAL HG2 . 15072 1 829 . 1 1 111 111 VAL CA C 13 65.9 0.2 . 1 . . . . 111 VAL CA . 15072 1 830 . 1 1 111 111 VAL CG2 C 13 21.0 0.2 . 2 . . . . 111 VAL CG2 . 15072 1 831 . 1 1 111 111 VAL N N 15 121.6 0.2 . 1 . . . . 111 VAL N . 15072 1 832 . 1 1 112 112 HIS H H 1 8.35 0.01 . 1 . . . . 112 HIS H . 15072 1 833 . 1 1 112 112 HIS HE1 H 1 8.23 0.01 . 1 . . . . 112 HIS HE1 . 15072 1 834 . 1 1 112 112 HIS CE1 C 13 138.0 0.2 . 1 . . . . 112 HIS CE1 . 15072 1 835 . 1 1 112 112 HIS N N 15 121.2 0.2 . 1 . . . . 112 HIS N . 15072 1 836 . 1 1 113 113 ARG H H 1 8.17 0.01 . 1 . . . . 113 ARG H . 15072 1 837 . 1 1 113 113 ARG N N 15 116.6 0.2 . 1 . . . . 113 ARG N . 15072 1 838 . 1 1 114 114 GLY H H 1 8.05 0.01 . 1 . . . . 114 GLY H . 15072 1 839 . 1 1 114 114 GLY HA2 H 1 4.01 0.01 . 2 . . . . 114 GLY HA2 . 15072 1 840 . 1 1 114 114 GLY HA3 H 1 4.09 0.01 . 2 . . . . 114 GLY HA3 . 15072 1 841 . 1 1 114 114 GLY CA C 13 45.7 0.2 . 1 . . . . 114 GLY CA . 15072 1 842 . 1 1 114 114 GLY N N 15 108.3 0.2 . 1 . . . . 114 GLY N . 15072 1 843 . 1 1 115 115 GLU H H 1 8.07 0.01 . 1 . . . . 115 GLU H . 15072 1 844 . 1 1 115 115 GLU HG2 H 1 2.32 0.01 . 1 . . . . 115 GLU HG2 . 15072 1 845 . 1 1 115 115 GLU HG3 H 1 2.32 0.01 . 1 . . . . 115 GLU HG3 . 15072 1 846 . 1 1 115 115 GLU CG C 13 36.3 0.2 . 1 . . . . 115 GLU CG . 15072 1 847 . 1 1 115 115 GLU N N 15 119.7 0.2 . 1 . . . . 115 GLU N . 15072 1 848 . 1 1 116 116 VAL H H 1 7.99 0.01 . 1 . . . . 116 VAL H . 15072 1 849 . 1 1 116 116 VAL HA H 1 4.49 0.01 . 1 . . . . 116 VAL HA . 15072 1 850 . 1 1 116 116 VAL HG11 H 1 0.98 0.01 . 2 . . . . 116 VAL HG1 . 15072 1 851 . 1 1 116 116 VAL HG12 H 1 0.98 0.01 . 2 . . . . 116 VAL HG1 . 15072 1 852 . 1 1 116 116 VAL HG13 H 1 0.98 0.01 . 2 . . . . 116 VAL HG1 . 15072 1 853 . 1 1 116 116 VAL HG21 H 1 1.04 0.01 . 2 . . . . 116 VAL HG2 . 15072 1 854 . 1 1 116 116 VAL HG22 H 1 1.04 0.01 . 2 . . . . 116 VAL HG2 . 15072 1 855 . 1 1 116 116 VAL HG23 H 1 1.04 0.01 . 2 . . . . 116 VAL HG2 . 15072 1 856 . 1 1 116 116 VAL CA C 13 59.6 0.2 . 1 . . . . 116 VAL CA . 15072 1 857 . 1 1 116 116 VAL CG1 C 13 20.5 0.2 . 2 . . . . 116 VAL CG1 . 15072 1 858 . 1 1 116 116 VAL N N 15 121.0 0.2 . 1 . . . . 116 VAL N . 15072 1 859 . 1 1 117 117 PRO HA H 1 4.53 0.01 . 1 . . . . 117 PRO HA . 15072 1 860 . 1 1 117 117 PRO HB2 H 1 2.00 0.01 . 2 . . . . 117 PRO HB2 . 15072 1 861 . 1 1 117 117 PRO HB3 H 1 2.37 0.01 . 2 . . . . 117 PRO HB3 . 15072 1 862 . 1 1 117 117 PRO HD2 H 1 3.76 0.01 . 2 . . . . 117 PRO HD2 . 15072 1 863 . 1 1 117 117 PRO HD3 H 1 3.92 0.01 . 2 . . . . 117 PRO HD3 . 15072 1 864 . 1 1 117 117 PRO CA C 13 63.1 0.2 . 1 . . . . 117 PRO CA . 15072 1 865 . 1 1 117 117 PRO CB C 13 32.3 0.2 . 1 . . . . 117 PRO CB . 15072 1 866 . 1 1 117 117 PRO CD C 13 51.0 0.2 . 1 . . . . 117 PRO CD . 15072 1 867 . 1 1 118 118 CYS H H 1 8.58 0.01 . 1 . . . . 118 CYS H . 15072 1 868 . 1 1 118 118 CYS HA H 1 4.64 0.01 . 1 . . . . 118 CYS HA . 15072 1 869 . 1 1 118 118 CYS HB2 H 1 3.03 0.01 . 1 . . . . 118 CYS HB2 . 15072 1 870 . 1 1 118 118 CYS HB3 H 1 3.03 0.01 . 1 . . . . 118 CYS HB3 . 15072 1 871 . 1 1 118 118 CYS CA C 13 58.4 0.2 . 1 . . . . 118 CYS CA . 15072 1 872 . 1 1 118 118 CYS CB C 13 28.0 0.2 . 1 . . . . 118 CYS CB . 15072 1 873 . 1 1 118 118 CYS N N 15 119.9 0.2 . 1 . . . . 118 CYS N . 15072 1 874 . 1 1 119 119 THR H H 1 8.31 0.01 . 1 . . . . 119 THR H . 15072 1 875 . 1 1 119 119 THR HA H 1 4.48 0.01 . 1 . . . . 119 THR HA . 15072 1 876 . 1 1 119 119 THR HB H 1 4.33 0.01 . 1 . . . . 119 THR HB . 15072 1 877 . 1 1 119 119 THR HG21 H 1 1.27 0.01 . 1 . . . . 119 THR HG2 . 15072 1 878 . 1 1 119 119 THR HG22 H 1 1.27 0.01 . 1 . . . . 119 THR HG2 . 15072 1 879 . 1 1 119 119 THR HG23 H 1 1.27 0.01 . 1 . . . . 119 THR HG2 . 15072 1 880 . 1 1 119 119 THR CA C 13 61.9 0.2 . 1 . . . . 119 THR CA . 15072 1 881 . 1 1 119 119 THR CB C 13 70.0 0.2 . 1 . . . . 119 THR CB . 15072 1 882 . 1 1 119 119 THR CG2 C 13 21.7 0.2 . 1 . . . . 119 THR CG2 . 15072 1 883 . 1 1 119 119 THR N N 15 117.4 0.2 . 1 . . . . 119 THR N . 15072 1 884 . 1 1 120 120 VAL H H 1 7.82 0.01 . 1 . . . . 120 VAL H . 15072 1 885 . 1 1 120 120 VAL HA H 1 4.13 0.01 . 1 . . . . 120 VAL HA . 15072 1 886 . 1 1 120 120 VAL HG11 H 1 0.96 0.01 . 2 . . . . 120 VAL HG1 . 15072 1 887 . 1 1 120 120 VAL HG12 H 1 0.96 0.01 . 2 . . . . 120 VAL HG1 . 15072 1 888 . 1 1 120 120 VAL HG13 H 1 0.96 0.01 . 2 . . . . 120 VAL HG1 . 15072 1 889 . 1 1 120 120 VAL HG21 H 1 0.98 0.01 . 2 . . . . 120 VAL HG2 . 15072 1 890 . 1 1 120 120 VAL HG22 H 1 0.98 0.01 . 2 . . . . 120 VAL HG2 . 15072 1 891 . 1 1 120 120 VAL HG23 H 1 0.98 0.01 . 2 . . . . 120 VAL HG2 . 15072 1 892 . 1 1 120 120 VAL CA C 13 63.8 0.2 . 1 . . . . 120 VAL CA . 15072 1 893 . 1 1 120 120 VAL CG1 C 13 20.3 0.2 . 2 . . . . 120 VAL CG1 . 15072 1 894 . 1 1 120 120 VAL CG2 C 13 21.7 0.2 . 2 . . . . 120 VAL CG2 . 15072 1 895 . 1 1 120 120 VAL N N 15 126.4 0.2 . 1 . . . . 120 VAL N . 15072 1 896 . 2 2 1 1 GLN HA H 1 4.13 0.01 . 1 . . . . 1 GLN HA . 15072 1 897 . 2 2 1 1 GLN HB2 H 1 2.21 0.01 . 1 . . . . 1 GLN HB2 . 15072 1 898 . 2 2 1 1 GLN HB3 H 1 2.21 0.01 . 1 . . . . 1 GLN HB3 . 15072 1 899 . 2 2 1 1 GLN HG2 H 1 2.51 0.01 . 1 . . . . 1 GLN HG2 . 15072 1 900 . 2 2 1 1 GLN HG3 H 1 2.51 0.01 . 1 . . . . 1 GLN HG3 . 15072 1 901 . 2 2 2 2 LYS HA H 1 4.50 0.01 . 1 . . . . 2 LYS HA . 15072 1 902 . 2 2 2 2 LYS HB2 H 1 1.86 0.01 . 2 . . . . 2 LYS HB2 . 15072 1 903 . 2 2 2 2 LYS HB3 H 1 1.95 0.01 . 2 . . . . 2 LYS HB3 . 15072 1 904 . 2 2 2 2 LYS HG2 H 1 1.52 0.01 . 2 . . . . 2 LYS HG2 . 15072 1 905 . 2 2 2 2 LYS HG3 H 1 1.56 0.01 . 2 . . . . 2 LYS HG3 . 15072 1 906 . 2 2 2 2 LYS HD2 H 1 1.77 0.01 . 1 . . . . 2 LYS HD2 . 15072 1 907 . 2 2 2 2 LYS HD3 H 1 1.77 0.01 . 1 . . . . 2 LYS HD3 . 15072 1 908 . 2 2 2 2 LYS HE2 H 1 3.08 0.01 . 1 . . . . 2 LYS HE2 . 15072 1 909 . 2 2 2 2 LYS HE3 H 1 3.08 0.01 . 1 . . . . 2 LYS HE3 . 15072 1 910 . 2 2 3 3 THR H H 1 8.31 0.01 . 1 . . . . 3 THR H . 15072 1 911 . 2 2 3 3 THR HA H 1 4.47 0.01 . 1 . . . . 3 THR HA . 15072 1 912 . 2 2 3 3 THR HB H 1 4.33 0.01 . 1 . . . . 3 THR HB . 15072 1 913 . 2 2 3 3 THR HG21 H 1 1.29 0.01 . 1 . . . . 3 THR HG2 . 15072 1 914 . 2 2 3 3 THR HG22 H 1 1.29 0.01 . 1 . . . . 3 THR HG2 . 15072 1 915 . 2 2 3 3 THR HG23 H 1 1.29 0.01 . 1 . . . . 3 THR HG2 . 15072 1 916 . 2 2 4 4 GLY H H 1 8.58 0.01 . 1 . . . . 4 GLY H . 15072 1 917 . 2 2 4 4 GLY HA2 H 1 4.13 0.01 . 1 . . . . 4 GLY HA2 . 15072 1 918 . 2 2 4 4 GLY HA3 H 1 4.13 0.01 . 1 . . . . 4 GLY HA3 . 15072 1 919 . 2 2 5 5 THR H H 1 8.16 0.01 . 1 . . . . 5 THR H . 15072 1 920 . 2 2 5 5 THR HA H 1 4.42 0.01 . 1 . . . . 5 THR HA . 15072 1 921 . 2 2 5 5 THR HB H 1 4.30 0.01 . 1 . . . . 5 THR HB . 15072 1 922 . 2 2 5 5 THR HG21 H 1 1.28 0.01 . 1 . . . . 5 THR HG2 . 15072 1 923 . 2 2 5 5 THR HG22 H 1 1.28 0.01 . 1 . . . . 5 THR HG2 . 15072 1 924 . 2 2 5 5 THR HG23 H 1 1.28 0.01 . 1 . . . . 5 THR HG2 . 15072 1 925 . 2 2 6 6 ALA H H 1 8.40 0.01 . 1 . . . . 6 ALA H . 15072 1 926 . 2 2 6 6 ALA HA H 1 4.42 0.01 . 1 . . . . 6 ALA HA . 15072 1 927 . 2 2 6 6 ALA HB1 H 1 1.47 0.01 . 1 . . . . 6 ALA HB . 15072 1 928 . 2 2 6 6 ALA HB2 H 1 1.47 0.01 . 1 . . . . 6 ALA HB . 15072 1 929 . 2 2 6 6 ALA HB3 H 1 1.47 0.01 . 1 . . . . 6 ALA HB . 15072 1 930 . 2 2 7 7 GLU H H 1 8.40 0.01 . 1 . . . . 7 GLU H . 15072 1 931 . 2 2 7 7 GLU HA H 1 4.36 0.01 . 1 . . . . 7 GLU HA . 15072 1 932 . 2 2 7 7 GLU HB2 H 1 2.00 0.01 . 2 . . . . 7 GLU HB2 . 15072 1 933 . 2 2 7 7 GLU HB3 H 1 2.11 0.01 . 2 . . . . 7 GLU HB3 . 15072 1 934 . 2 2 7 7 GLU HG2 H 1 2.30 0.01 . 2 . . . . 7 GLU HG2 . 15072 1 935 . 2 2 7 7 GLU HG3 H 1 2.35 0.01 . 2 . . . . 7 GLU HG3 . 15072 1 936 . 2 2 8 8 VAL H H 1 8.25 0.01 . 1 . . . . 8 VAL H . 15072 1 937 . 2 2 8 8 VAL HA H 1 4.24 0.01 . 1 . . . . 8 VAL HA . 15072 1 938 . 2 2 8 8 VAL HB H 1 2.18 0.01 . 1 . . . . 8 VAL HB . 15072 1 939 . 2 2 8 8 VAL HG11 H 1 1.02 0.01 . 1 . . . . 8 VAL HG1 . 15072 1 940 . 2 2 8 8 VAL HG12 H 1 1.02 0.01 . 1 . . . . 8 VAL HG1 . 15072 1 941 . 2 2 8 8 VAL HG13 H 1 1.02 0.01 . 1 . . . . 8 VAL HG1 . 15072 1 942 . 2 2 8 8 VAL HG21 H 1 1.02 0.01 . 1 . . . . 8 VAL HG2 . 15072 1 943 . 2 2 8 8 VAL HG22 H 1 1.02 0.01 . 1 . . . . 8 VAL HG2 . 15072 1 944 . 2 2 8 8 VAL HG23 H 1 1.02 0.01 . 1 . . . . 8 VAL HG2 . 15072 1 945 . 2 2 9 9 SER H H 1 8.48 0.01 . 1 . . . . 9 SER H . 15072 1 946 . 2 2 9 9 SER HA H 1 4.57 0.01 . 1 . . . . 9 SER HA . 15072 1 947 . 2 2 9 9 SER HB2 H 1 3.93 0.01 . 2 . . . . 9 SER HB2 . 15072 1 948 . 2 2 9 9 SER HB3 H 1 3.96 0.01 . 1 . . . . 9 SER HB3 . 15072 1 949 . 2 2 10 10 SER H H 1 8.43 0.01 . 1 . . . . 10 SER H . 15072 1 950 . 2 2 10 10 SER HA H 1 4.55 0.01 . 1 . . . . 10 SER HA . 15072 1 951 . 2 2 10 10 SER HB2 H 1 3.93 0.01 . 2 . . . . 10 SER HB2 . 15072 1 952 . 2 2 10 10 SER HB3 H 1 3.96 0.01 . 2 . . . . 10 SER HB3 . 15072 1 953 . 2 2 11 11 ILE H H 1 8.15 0.01 . 1 . . . . 11 ILE H . 15072 1 954 . 2 2 11 11 ILE HA H 1 4.23 0.01 . 1 . . . . 11 ILE HA . 15072 1 955 . 2 2 11 11 ILE HB H 1 1.96 0.01 . 1 . . . . 11 ILE HB . 15072 1 956 . 2 2 11 11 ILE HG12 H 1 1.26 0.01 . 1 . . . . 11 ILE HG12 . 15072 1 957 . 2 2 11 11 ILE HG13 H 1 1.52 0.01 . 1 . . . . 11 ILE HG13 . 15072 1 958 . 2 2 11 11 ILE HG21 H 1 0.98 0.01 . 1 . . . . 11 ILE HG2 . 15072 1 959 . 2 2 11 11 ILE HG22 H 1 0.98 0.01 . 1 . . . . 11 ILE HG2 . 15072 1 960 . 2 2 11 11 ILE HG23 H 1 0.98 0.01 . 1 . . . . 11 ILE HG2 . 15072 1 961 . 2 2 11 11 ILE HD11 H 1 0.91 0.01 . 1 . . . . 11 ILE HD1 . 15072 1 962 . 2 2 11 11 ILE HD12 H 1 0.91 0.01 . 1 . . . . 11 ILE HD1 . 15072 1 963 . 2 2 11 11 ILE HD13 H 1 0.91 0.01 . 1 . . . . 11 ILE HD1 . 15072 1 964 . 2 2 12 12 LEU H H 1 8.25 0.01 . 1 . . . . 12 LEU H . 15072 1 965 . 2 2 12 12 LEU HA H 1 4.37 0.01 . 1 . . . . 12 LEU HA . 15072 1 966 . 2 2 12 12 LEU HB2 H 1 1.69 0.01 . 1 . . . . 12 LEU HB2 . 15072 1 967 . 2 2 12 12 LEU HB3 H 1 1.73 0.01 . 1 . . . . 12 LEU HB3 . 15072 1 968 . 2 2 12 12 LEU HD11 H 1 0.93 0.01 . 2 . . . . 12 LEU HD1 . 15072 1 969 . 2 2 12 12 LEU HD12 H 1 0.93 0.01 . 2 . . . . 12 LEU HD1 . 15072 1 970 . 2 2 12 12 LEU HD13 H 1 0.93 0.01 . 2 . . . . 12 LEU HD1 . 15072 1 971 . 2 2 12 12 LEU HD21 H 1 0.99 0.01 . 2 . . . . 12 LEU HD2 . 15072 1 972 . 2 2 12 12 LEU HD22 H 1 0.99 0.01 . 2 . . . . 12 LEU HD2 . 15072 1 973 . 2 2 12 12 LEU HD23 H 1 0.99 0.01 . 2 . . . . 12 LEU HD2 . 15072 1 974 . 2 2 13 13 GLU H H 1 8.34 0.01 . 1 . . . . 13 GLU H . 15072 1 975 . 2 2 13 13 GLU HA H 1 4.31 0.01 . 1 . . . . 13 GLU HA . 15072 1 976 . 2 2 13 13 GLU HB2 H 1 2.04 0.01 . 2 . . . . 13 GLU HB2 . 15072 1 977 . 2 2 13 13 GLU HB3 H 1 2.13 0.01 . 2 . . . . 13 GLU HB3 . 15072 1 978 . 2 2 13 13 GLU HG2 H 1 2.30 0.01 . 2 . . . . 13 GLU HG2 . 15072 1 979 . 2 2 13 13 GLU HG3 H 1 2.34 0.01 . 2 . . . . 13 GLU HG3 . 15072 1 980 . 2 2 14 14 GLU H H 1 8.37 0.01 . 1 . . . . 14 GLU H . 15072 1 981 . 2 2 14 14 GLU HA H 1 4.31 0.01 . 1 . . . . 14 GLU HA . 15072 1 982 . 2 2 14 14 GLU HB2 H 1 2.03 0.01 . 2 . . . . 14 GLU HB2 . 15072 1 983 . 2 2 14 14 GLU HB3 H 1 2.12 0.01 . 2 . . . . 14 GLU HB3 . 15072 1 984 . 2 2 14 14 GLU HG2 H 1 2.29 0.01 . 2 . . . . 14 GLU HG2 . 15072 1 985 . 2 2 14 14 GLU HG3 H 1 2.34 0.01 . 2 . . . . 14 GLU HG3 . 15072 1 986 . 2 2 15 15 ARG H H 1 8.35 0.01 . 1 . . . . 15 ARG H . 15072 1 987 . 2 2 15 15 ARG HA H 1 4.41 0.01 . 1 . . . . 15 ARG HA . 15072 1 988 . 2 2 15 15 ARG HB2 H 1 1.86 0.01 . 2 . . . . 15 ARG HB2 . 15072 1 989 . 2 2 15 15 ARG HB3 H 1 1.91 0.01 . 2 . . . . 15 ARG HB3 . 15072 1 990 . 2 2 15 15 ARG HG2 H 1 1.66 0.01 . 2 . . . . 15 ARG HG2 . 15072 1 991 . 2 2 15 15 ARG HG3 H 1 1.72 0.01 . 2 . . . . 15 ARG HG3 . 15072 1 992 . 2 2 15 15 ARG HD2 H 1 3.27 0.01 . 1 . . . . 15 ARG HD2 . 15072 1 993 . 2 2 15 15 ARG HD3 H 1 3.27 0.01 . 1 . . . . 15 ARG HD3 . 15072 1 994 . 2 2 15 15 ARG HE H 1 7.32 0.01 . 1 . . . . 15 ARG HE . 15072 1 995 . 2 2 16 16 ILE H H 1 8.26 0.01 . 1 . . . . 16 ILE H . 15072 1 996 . 2 2 16 16 ILE HA H 1 4.24 0.01 . 1 . . . . 16 ILE HA . 15072 1 997 . 2 2 16 16 ILE HB H 1 1.96 0.01 . 1 . . . . 16 ILE HB . 15072 1 998 . 2 2 16 16 ILE HG12 H 1 1.25 0.01 . 2 . . . . 16 ILE HG12 . 15072 1 999 . 2 2 16 16 ILE HG13 H 1 1.55 0.01 . 2 . . . . 16 ILE HG13 . 15072 1 1000 . 2 2 16 16 ILE HG21 H 1 0.97 0.01 . 1 . . . . 16 ILE HG2 . 15072 1 1001 . 2 2 16 16 ILE HG22 H 1 0.97 0.01 . 1 . . . . 16 ILE HG2 . 15072 1 1002 . 2 2 16 16 ILE HG23 H 1 0.97 0.01 . 1 . . . . 16 ILE HG2 . 15072 1 1003 . 2 2 16 16 ILE HD11 H 1 0.92 0.01 . 1 . . . . 16 ILE HD1 . 15072 1 1004 . 2 2 16 16 ILE HD12 H 1 0.92 0.01 . 1 . . . . 16 ILE HD1 . 15072 1 1005 . 2 2 16 16 ILE HD13 H 1 0.92 0.01 . 1 . . . . 16 ILE HD1 . 15072 1 1006 . 2 2 17 17 LEU H H 1 8.42 0.01 . 1 . . . . 17 LEU H . 15072 1 1007 . 2 2 17 17 LEU HA H 1 4.42 0.01 . 1 . . . . 17 LEU HA . 15072 1 1008 . 2 2 17 17 LEU HB2 H 1 1.71 0.01 . 1 . . . . 17 LEU HB2 . 15072 1 1009 . 2 2 17 17 LEU HB3 H 1 1.78 0.01 . 1 . . . . 17 LEU HB3 . 15072 1 1010 . 2 2 17 17 LEU HD11 H 1 0.94 0.01 . 2 . . . . 17 LEU HD1 . 15072 1 1011 . 2 2 17 17 LEU HD12 H 1 0.94 0.01 . 2 . . . . 17 LEU HD1 . 15072 1 1012 . 2 2 17 17 LEU HD13 H 1 0.94 0.01 . 2 . . . . 17 LEU HD1 . 15072 1 1013 . 2 2 17 17 LEU HD21 H 1 0.98 0.01 . 2 . . . . 17 LEU HD2 . 15072 1 1014 . 2 2 17 17 LEU HD22 H 1 0.98 0.01 . 2 . . . . 17 LEU HD2 . 15072 1 1015 . 2 2 17 17 LEU HD23 H 1 0.98 0.01 . 2 . . . . 17 LEU HD2 . 15072 1 1016 . 2 2 18 18 GLY H H 1 8.44 0.01 . 1 . . . . 18 GLY H . 15072 1 1017 . 2 2 18 18 GLY HA2 H 1 4.03 0.01 . 1 . . . . 18 GLY HA2 . 15072 1 1018 . 2 2 18 18 GLY HA3 H 1 4.03 0.01 . 1 . . . . 18 GLY HA3 . 15072 1 1019 . 2 2 19 19 ALA H H 1 8.19 0.01 . 1 . . . . 19 ALA H . 15072 1 1020 . 2 2 19 19 ALA HA H 1 4.40 0.01 . 1 . . . . 19 ALA HA . 15072 1 1021 . 2 2 19 19 ALA HB1 H 1 1.46 0.01 . 1 . . . . 19 ALA HB . 15072 1 1022 . 2 2 19 19 ALA HB2 H 1 1.46 0.01 . 1 . . . . 19 ALA HB . 15072 1 1023 . 2 2 19 19 ALA HB3 H 1 1.46 0.01 . 1 . . . . 19 ALA HB . 15072 1 1024 . 2 2 20 20 ASP H H 1 8.48 0.01 . 1 . . . . 20 ASP H . 15072 1 1025 . 2 2 20 20 ASP HA H 1 4.74 0.01 . 1 . . . . 20 ASP HA . 15072 1 1026 . 2 2 20 20 ASP HB2 H 1 2.73 0.01 . 2 . . . . 20 ASP HB2 . 15072 1 1027 . 2 2 20 20 ASP HB3 H 1 2.83 0.01 . 2 . . . . 20 ASP HB3 . 15072 1 1028 . 2 2 21 21 THR H H 1 8.15 0.01 . 1 . . . . 21 THR H . 15072 1 1029 . 2 2 21 21 THR HA H 1 4.44 0.01 . 1 . . . . 21 THR HA . 15072 1 1030 . 2 2 21 21 THR HB H 1 4.32 0.01 . 1 . . . . 21 THR HB . 15072 1 1031 . 2 2 21 21 THR HG21 H 1 1.29 0.01 . 1 . . . . 21 THR HG2 . 15072 1 1032 . 2 2 21 21 THR HG22 H 1 1.29 0.01 . 1 . . . . 21 THR HG2 . 15072 1 1033 . 2 2 21 21 THR HG23 H 1 1.29 0.01 . 1 . . . . 21 THR HG2 . 15072 1 1034 . 2 2 22 22 SER H H 1 8.46 0.01 . 1 . . . . 22 SER H . 15072 1 1035 . 2 2 22 22 SER HA H 1 4.55 0.01 . 1 . . . . 22 SER HA . 15072 1 1036 . 2 2 22 22 SER HB2 H 1 3.96 0.01 . 1 . . . . 22 SER HB2 . 15072 1 1037 . 2 2 22 22 SER HB3 H 1 3.96 0.01 . 1 . . . . 22 SER HB3 . 15072 1 1038 . 2 2 23 23 VAL H H 1 8.06 0.01 . 1 . . . . 23 VAL H . 15072 1 1039 . 2 2 23 23 VAL HA H 1 4.20 0.01 . 1 . . . . 23 VAL HA . 15072 1 1040 . 2 2 23 23 VAL HB H 1 2.15 0.01 . 1 . . . . 23 VAL HB . 15072 1 1041 . 2 2 23 23 VAL HG11 H 1 0.99 0.01 . 1 . . . . 23 VAL HG1 . 15072 1 1042 . 2 2 23 23 VAL HG12 H 1 0.99 0.01 . 1 . . . . 23 VAL HG1 . 15072 1 1043 . 2 2 23 23 VAL HG13 H 1 0.99 0.01 . 1 . . . . 23 VAL HG1 . 15072 1 1044 . 2 2 23 23 VAL HG21 H 1 0.99 0.01 . 1 . . . . 23 VAL HG2 . 15072 1 1045 . 2 2 23 23 VAL HG22 H 1 0.99 0.01 . 1 . . . . 23 VAL HG2 . 15072 1 1046 . 2 2 23 23 VAL HG23 H 1 0.99 0.01 . 1 . . . . 23 VAL HG2 . 15072 1 1047 . 2 2 24 24 ASP H H 1 8.39 0.01 . 1 . . . . 24 ASP H . 15072 1 1048 . 2 2 24 24 ASP HA H 1 4.70 0.01 . 1 . . . . 24 ASP HA . 15072 1 1049 . 2 2 24 24 ASP HB2 H 1 2.66 0.01 . 1 . . . . 24 ASP HB2 . 15072 1 1050 . 2 2 24 24 ASP HB3 H 1 2.81 0.01 . 1 . . . . 24 ASP HB3 . 15072 1 1051 . 2 2 25 25 LEU H H 1 8.38 0.01 . 1 . . . . 25 LEU H . 15072 1 1052 . 2 2 25 25 LEU HA H 1 4.35 0.01 . 1 . . . . 25 LEU HA . 15072 1 1053 . 2 2 25 25 LEU HB2 H 1 1.72 0.01 . 1 . . . . 25 LEU HB2 . 15072 1 1054 . 2 2 25 25 LEU HB3 H 1 1.77 0.01 . 1 . . . . 25 LEU HB3 . 15072 1 1055 . 2 2 25 25 LEU HD11 H 1 0.94 0.01 . 2 . . . . 25 LEU HD1 . 15072 1 1056 . 2 2 25 25 LEU HD12 H 1 0.94 0.01 . 2 . . . . 25 LEU HD1 . 15072 1 1057 . 2 2 25 25 LEU HD13 H 1 0.94 0.01 . 2 . . . . 25 LEU HD1 . 15072 1 1058 . 2 2 25 25 LEU HD21 H 1 1.00 0.01 . 2 . . . . 25 LEU HD2 . 15072 1 1059 . 2 2 25 25 LEU HD22 H 1 1.00 0.01 . 2 . . . . 25 LEU HD2 . 15072 1 1060 . 2 2 25 25 LEU HD23 H 1 1.00 0.01 . 2 . . . . 25 LEU HD2 . 15072 1 stop_ save_