data_4915 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 4915 _Entry.Title ; Structure and Function of the C-terminal PABC Domain of Human Poly(A)-binding Protein ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2000-12-09 _Entry.Accession_date 2000-12-12 _Entry.Last_release_date 2001-03-07 _Entry.Original_release_date 2001-03-07 _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 2.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype . _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 G. Kozlov . . . 4915 2 J.-F. Trempe . . . 4915 3 K. Khaleghpour . . . 4915 4 A. Kahvejian . . . 4915 5 I. Ekiel . . . 4915 6 K. Gehring . . . 4915 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 4915 coupling_constants 1 4915 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '1H chemical shifts' 833 4915 '13C chemical shifts' 504 4915 '15N chemical shifts' 126 4915 'coupling constants' 101 4915 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 . . 2001-03-07 2000-12-09 original author . 4915 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 4915 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code 21192642 _Citation.DOI . _Citation.PubMed_ID 11287632 _Citation.Full_citation . _Citation.Title ; Structure and Function of the C-terminal PABC Domain of Human Poly(A)-binding Protein ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Proc. Natl. Acad. Sci. U.S.A.' _Citation.Journal_name_full . _Citation.Journal_volume 98 _Citation.Journal_issue 8 _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 4409 _Citation.Page_last 4413 _Citation.Year 2001 _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 G. Kozlov . . . 4915 1 2 J.-F. Trempe . . . 4915 1 3 K. Khaleghpour . . . 4915 1 4 A. Kahvejian . . . 4915 1 5 I. Ekiel . . . 4915 1 6 K. Gehring . . . 4915 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID 'all-helical domain' 4915 1 'peptide-binding domain' 4915 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_system_PABP _Assembly.Sf_category assembly _Assembly.Sf_framecode system_PABP _Assembly.Entry_ID 4915 _Assembly.ID 1 _Assembly.Name 'Polyadenylate-binding protein 1' _Assembly.BMRB_code . _Assembly.Number_of_components . _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state 'not present' _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Assembly_type.Type _Assembly_type.Entry_ID _Assembly_type.Assembly_ID monomer 4915 1 stop_ 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 'Polyadenylate-binding protein 1' 1 $PABC . . . native . . . . . 4915 1 stop_ loop_ _Assembly_db_link.Author_supplied _Assembly_db_link.Database_code _Assembly_db_link.Accession_code _Assembly_db_link.Entry_mol_code _Assembly_db_link.Entry_mol_name _Assembly_db_link.Entry_experimental_method _Assembly_db_link.Entry_structure_resolution _Assembly_db_link.Entry_relation_type _Assembly_db_link.Entry_details _Assembly_db_link.Entry_ID _Assembly_db_link.Assembly_ID . PDB 1G9L . . . . . . 4915 1 stop_ loop_ _Assembly_common_name.Name _Assembly_common_name.Type _Assembly_common_name.Entry_ID _Assembly_common_name.Assembly_ID 'Polyadenylate-binding protein 1' system 4915 1 PABP abbreviation 4915 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_PABC _Entity.Sf_category entity _Entity.Sf_framecode PABC _Entity.Entry_ID 4915 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name 'C-terminal domain of PABP' _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; GPLGSAAAATPAVRTVPQYK YAAGVRNPQQHLNAQPQVTM QQPAVHVQGQEPLTASMLAS APPQEQKQMLGERLFPLIQA MHPTLAGKITGMLLEIDNSE LLHMLESPESLRSKVDEAVA VLQAHQAKEAAQKAVNSATG VPTV ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states . _Entity.Ambiguous_chem_comp_sites . _Entity.Nstd_monomer . _Entity.Nstd_chirality . _Entity.Nstd_linkage . _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 144 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic . _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 15271 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details 'The first five residues GPLGS are cloning artifacts.' _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-01-28 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 BMRB 10019 . polyA-binding_protein . . . . . 57.64 83 100.00 100.00 2.48e-49 . . . . 4915 1 2 no BMRB 7033 . "PABC domain" . . . . . 57.64 83 100.00 100.00 2.48e-49 . . . . 4915 1 3 no PDB 1G9L . "Solution Structure Of The Pabc Domain Of Human Poly(A) Binding Protein" . . . . . 100.00 144 100.00 100.00 8.08e-96 . . . . 4915 1 4 no PDB 1JGN . "Solution Structure Of The C-Terminal Pabc Domain Of Human Poly(A)-Binding Protein In Complex With The Peptide From Paip2" . . . . . 64.58 98 100.00 100.00 1.49e-56 . . . . 4915 1 5 no PDB 1JH4 . "Solution Structure Of The C-Terminal Pabc Domain Of Human Poly(A)-Binding Protein In Complex With The Peptide From Paip1" . . . . . 64.58 98 100.00 100.00 1.49e-56 . . . . 4915 1 6 no PDB 2RQG . "Structure Of Gspt1ERF3A-Pabc" . . . . . 57.64 83 100.00 100.00 2.48e-49 . . . . 4915 1 7 no PDB 2RQH . "Structure Of Gspt1ERF3A-Pabc" . . . . . 57.64 83 100.00 100.00 2.48e-49 . . . . 4915 1 8 no PDB 2X04 . "Crystal Structure Of The Pabc-Tnrc6c Complex" . . . . . 52.08 80 100.00 100.00 3.88e-43 . . . . 4915 1 9 no PDB 3KTP . "Structural Basis Of Gw182 Recognition By Poly(a)-binding Protein" . . . . . 57.64 88 100.00 100.00 1.07e-48 . . . . 4915 1 10 no PDB 3KTR . "Structural Basis Of Ataxin-2 Recognition By Poly(A)-Binding" . . . . . 57.64 88 100.00 100.00 1.07e-48 . . . . 4915 1 11 no PDB 3KUI . "Crystal Structure Of C-Terminal Domain Of Pabpc1 In Complex Binding Region Of Erf3a" . . . . . 57.64 88 100.00 100.00 1.07e-48 . . . . 4915 1 12 no PDB 3KUJ . "Crystal Structure Of C-Terminal Domain Of Pabpc1 In Complex With Binding Region Of Erf3a" . . . . . 57.64 88 100.00 100.00 1.07e-48 . . . . 4915 1 13 no PDB 3KUR . "Crystal Structure Of The Mlle Domain Of Poly(A)-Binding Protein" . . . . . 51.39 79 100.00 100.00 1.20e-42 . . . . 4915 1 14 no PDB 3KUS . "Crystal Structure Of The Mlle Domain Of Poly(A)-Binding Protein In Complex With The Binding Region Of Paip2" . . . . . 57.64 88 100.00 100.00 1.07e-48 . . . . 4915 1 15 no PDB 3KUT . "Crystal Structure Of The Mlle Domain Of Poly(a)-binding Protein In Complex With The Binding Region Of Paip2" . . . . . 57.64 88 100.00 100.00 1.07e-48 . . . . 4915 1 16 no PDB 3PKN . "Crystal Structure Of Mlle Domain Of Poly(A) Binding Protein In Complex With Pam2 Motif Of La-Related Protein 4 (Larp4)" . . . . . 57.64 88 100.00 100.00 1.07e-48 . . . . 4915 1 17 no PDB 3PTH . "The Pabc1 Mlle Domain Bound To The Variant Pam2 Motif Of Larp4b" . . . . . 54.86 82 100.00 100.00 1.81e-46 . . . . 4915 1 18 no DBJ BAC32110 . "unnamed protein product [Mus musculus]" . . . . . 99.31 636 97.20 98.60 3.41e-87 . . . . 4915 1 19 no DBJ BAC40951 . "unnamed protein product [Mus musculus]" . . . . . 99.31 636 97.20 98.60 3.10e-87 . . . . 4915 1 20 no DBJ BAC56450 . "similar to poly(A)-binding protein 1 [Bos taurus]" . . . . . 77.08 138 99.10 99.10 2.22e-70 . . . . 4915 1 21 no DBJ BAE21553 . "unnamed protein product [Mus musculus]" . . . . . 99.31 636 97.20 98.60 3.41e-87 . . . . 4915 1 22 no DBJ BAE30919 . "unnamed protein product [Mus musculus]" . . . . . 99.31 636 97.20 98.60 3.72e-87 . . . . 4915 1 23 no EMBL CAA46522 . "poly(A) binding protein [Mus musculus]" . . . . . 99.31 636 97.20 98.60 3.27e-87 . . . . 4915 1 24 no EMBL CAA68428 . "unnamed protein product [Homo sapiens]" . . . . . 99.31 633 97.90 98.60 8.18e-88 . . . . 4915 1 25 no EMBL CAB96752 . "polyadenylate-binding protein 1 [Bos taurus]" . . . . . 99.31 636 97.90 98.60 1.03e-87 . . . . 4915 1 26 no EMBL CAH91893 . "hypothetical protein [Pongo abelii]" . . . . . 99.31 636 97.90 98.60 1.01e-87 . . . . 4915 1 27 no EMBL CAH91953 . "hypothetical protein [Pongo abelii]" . . . . . 99.31 636 97.90 98.60 1.14e-87 . . . . 4915 1 28 no GB AAD08718 . "poly(A)-binding protein [Homo sapiens]" . . . . . 99.31 636 97.90 98.60 1.03e-87 . . . . 4915 1 29 no GB AAH03870 . "Poly(A) binding protein, cytoplasmic 1 [Mus musculus]" . . . . . 99.31 636 97.20 98.60 3.41e-87 . . . . 4915 1 30 no GB AAH11207 . "Poly(A) binding protein, cytoplasmic 1 [Mus musculus]" . . . . . 99.31 636 97.20 98.60 3.41e-87 . . . . 4915 1 31 no GB AAH15958 . "PABPC1 protein [Homo sapiens]" . . . . . 99.31 636 97.90 98.60 1.03e-87 . . . . 4915 1 32 no GB AAH23145 . "Poly(A) binding protein, cytoplasmic 1 [Mus musculus]" . . . . . 99.31 636 97.20 98.60 3.41e-87 . . . . 4915 1 33 no REF NP_001126097 . "polyadenylate-binding protein 1 [Pongo abelii]" . . . . . 99.31 636 97.90 98.60 1.01e-87 . . . . 4915 1 34 no REF NP_001128842 . "polyadenylate-binding protein 1 [Pongo abelii]" . . . . . 99.31 636 97.90 98.60 1.14e-87 . . . . 4915 1 35 no REF NP_001244826 . "polyadenylate-binding protein 1 [Macaca mulatta]" . . . . . 99.31 636 97.90 98.60 1.03e-87 . . . . 4915 1 36 no REF NP_002559 . "polyadenylate-binding protein 1 [Homo sapiens]" . . . . . 99.31 636 97.90 98.60 1.03e-87 . . . . 4915 1 37 no REF NP_032800 . "polyadenylate-binding protein 1 [Mus musculus]" . . . . . 99.31 636 97.20 98.60 3.41e-87 . . . . 4915 1 38 no SP P11940 . "RecName: Full=Polyadenylate-binding protein 1; Short=PABP-1; Short=Poly(A)-binding protein 1 [Homo sapiens]" . . . . . 99.31 636 97.90 98.60 1.03e-87 . . . . 4915 1 39 no SP P29341 . "RecName: Full=Polyadenylate-binding protein 1; Short=PABP-1; Short=Poly(A)-binding protein 1 [Mus musculus]" . . . . . 99.31 636 97.20 98.60 3.41e-87 . . . . 4915 1 40 no SP P61286 . "RecName: Full=Polyadenylate-binding protein 1; Short=PABP-1; Short=Poly(A)-binding protein 1 [Bos taurus]" . . . . . 99.31 636 97.90 98.60 1.03e-87 . . . . 4915 1 41 no SP Q5R8F7 . "RecName: Full=Polyadenylate-binding protein 1; Short=PABP-1; Short=Poly(A)-binding protein 1 [Pongo abelii]" . . . . . 99.31 636 97.90 98.60 1.14e-87 . . . . 4915 1 42 no TPG DAA22579 . "TPA: polyadenylate-binding protein 1 [Bos taurus]" . . . . . 99.31 636 97.90 98.60 1.03e-87 . . . . 4915 1 stop_ loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID 'C-terminal domain of PABP' common 4915 1 PABC abbreviation 4915 1 stop_ loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 . GLY . 4915 1 2 . PRO . 4915 1 3 . LEU . 4915 1 4 . GLY . 4915 1 5 . SER . 4915 1 6 . ALA . 4915 1 7 . ALA . 4915 1 8 . ALA . 4915 1 9 . ALA . 4915 1 10 . THR . 4915 1 11 . PRO . 4915 1 12 . ALA . 4915 1 13 . VAL . 4915 1 14 . ARG . 4915 1 15 . THR . 4915 1 16 . VAL . 4915 1 17 . PRO . 4915 1 18 . GLN . 4915 1 19 . TYR . 4915 1 20 . LYS . 4915 1 21 . TYR . 4915 1 22 . ALA . 4915 1 23 . ALA . 4915 1 24 . GLY . 4915 1 25 . VAL . 4915 1 26 . ARG . 4915 1 27 . ASN . 4915 1 28 . PRO . 4915 1 29 . GLN . 4915 1 30 . GLN . 4915 1 31 . HIS . 4915 1 32 . LEU . 4915 1 33 . ASN . 4915 1 34 . ALA . 4915 1 35 . GLN . 4915 1 36 . PRO . 4915 1 37 . GLN . 4915 1 38 . VAL . 4915 1 39 . THR . 4915 1 40 . MET . 4915 1 41 . GLN . 4915 1 42 . GLN . 4915 1 43 . PRO . 4915 1 44 . ALA . 4915 1 45 . VAL . 4915 1 46 . HIS . 4915 1 47 . VAL . 4915 1 48 . GLN . 4915 1 49 . GLY . 4915 1 50 . GLN . 4915 1 51 . GLU . 4915 1 52 . PRO . 4915 1 53 . LEU . 4915 1 54 . THR . 4915 1 55 . ALA . 4915 1 56 . SER . 4915 1 57 . MET . 4915 1 58 . LEU . 4915 1 59 . ALA . 4915 1 60 . SER . 4915 1 61 . ALA . 4915 1 62 . PRO . 4915 1 63 . PRO . 4915 1 64 . GLN . 4915 1 65 . GLU . 4915 1 66 . GLN . 4915 1 67 . LYS . 4915 1 68 . GLN . 4915 1 69 . MET . 4915 1 70 . LEU . 4915 1 71 . GLY . 4915 1 72 . GLU . 4915 1 73 . ARG . 4915 1 74 . LEU . 4915 1 75 . PHE . 4915 1 76 . PRO . 4915 1 77 . LEU . 4915 1 78 . ILE . 4915 1 79 . GLN . 4915 1 80 . ALA . 4915 1 81 . MET . 4915 1 82 . HIS . 4915 1 83 . PRO . 4915 1 84 . THR . 4915 1 85 . LEU . 4915 1 86 . ALA . 4915 1 87 . GLY . 4915 1 88 . LYS . 4915 1 89 . ILE . 4915 1 90 . THR . 4915 1 91 . GLY . 4915 1 92 . MET . 4915 1 93 . LEU . 4915 1 94 . LEU . 4915 1 95 . GLU . 4915 1 96 . ILE . 4915 1 97 . ASP . 4915 1 98 . ASN . 4915 1 99 . SER . 4915 1 100 . GLU . 4915 1 101 . LEU . 4915 1 102 . LEU . 4915 1 103 . HIS . 4915 1 104 . MET . 4915 1 105 . LEU . 4915 1 106 . GLU . 4915 1 107 . SER . 4915 1 108 . PRO . 4915 1 109 . GLU . 4915 1 110 . SER . 4915 1 111 . LEU . 4915 1 112 . ARG . 4915 1 113 . SER . 4915 1 114 . LYS . 4915 1 115 . VAL . 4915 1 116 . ASP . 4915 1 117 . GLU . 4915 1 118 . ALA . 4915 1 119 . VAL . 4915 1 120 . ALA . 4915 1 121 . VAL . 4915 1 122 . LEU . 4915 1 123 . GLN . 4915 1 124 . ALA . 4915 1 125 . HIS . 4915 1 126 . GLN . 4915 1 127 . ALA . 4915 1 128 . LYS . 4915 1 129 . GLU . 4915 1 130 . ALA . 4915 1 131 . ALA . 4915 1 132 . GLN . 4915 1 133 . LYS . 4915 1 134 . ALA . 4915 1 135 . VAL . 4915 1 136 . ASN . 4915 1 137 . SER . 4915 1 138 . ALA . 4915 1 139 . THR . 4915 1 140 . GLY . 4915 1 141 . VAL . 4915 1 142 . PRO . 4915 1 143 . THR . 4915 1 144 . VAL . 4915 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . GLY 1 1 4915 1 . PRO 2 2 4915 1 . LEU 3 3 4915 1 . GLY 4 4 4915 1 . SER 5 5 4915 1 . ALA 6 6 4915 1 . ALA 7 7 4915 1 . ALA 8 8 4915 1 . ALA 9 9 4915 1 . THR 10 10 4915 1 . PRO 11 11 4915 1 . ALA 12 12 4915 1 . VAL 13 13 4915 1 . ARG 14 14 4915 1 . THR 15 15 4915 1 . VAL 16 16 4915 1 . PRO 17 17 4915 1 . GLN 18 18 4915 1 . TYR 19 19 4915 1 . LYS 20 20 4915 1 . TYR 21 21 4915 1 . ALA 22 22 4915 1 . ALA 23 23 4915 1 . GLY 24 24 4915 1 . VAL 25 25 4915 1 . ARG 26 26 4915 1 . ASN 27 27 4915 1 . PRO 28 28 4915 1 . GLN 29 29 4915 1 . GLN 30 30 4915 1 . HIS 31 31 4915 1 . LEU 32 32 4915 1 . ASN 33 33 4915 1 . ALA 34 34 4915 1 . GLN 35 35 4915 1 . PRO 36 36 4915 1 . GLN 37 37 4915 1 . VAL 38 38 4915 1 . THR 39 39 4915 1 . MET 40 40 4915 1 . GLN 41 41 4915 1 . GLN 42 42 4915 1 . PRO 43 43 4915 1 . ALA 44 44 4915 1 . VAL 45 45 4915 1 . HIS 46 46 4915 1 . VAL 47 47 4915 1 . GLN 48 48 4915 1 . GLY 49 49 4915 1 . GLN 50 50 4915 1 . GLU 51 51 4915 1 . PRO 52 52 4915 1 . LEU 53 53 4915 1 . THR 54 54 4915 1 . ALA 55 55 4915 1 . SER 56 56 4915 1 . MET 57 57 4915 1 . LEU 58 58 4915 1 . ALA 59 59 4915 1 . SER 60 60 4915 1 . ALA 61 61 4915 1 . PRO 62 62 4915 1 . PRO 63 63 4915 1 . GLN 64 64 4915 1 . GLU 65 65 4915 1 . GLN 66 66 4915 1 . LYS 67 67 4915 1 . GLN 68 68 4915 1 . MET 69 69 4915 1 . LEU 70 70 4915 1 . GLY 71 71 4915 1 . GLU 72 72 4915 1 . ARG 73 73 4915 1 . LEU 74 74 4915 1 . PHE 75 75 4915 1 . PRO 76 76 4915 1 . LEU 77 77 4915 1 . ILE 78 78 4915 1 . GLN 79 79 4915 1 . ALA 80 80 4915 1 . MET 81 81 4915 1 . HIS 82 82 4915 1 . PRO 83 83 4915 1 . THR 84 84 4915 1 . LEU 85 85 4915 1 . ALA 86 86 4915 1 . GLY 87 87 4915 1 . LYS 88 88 4915 1 . ILE 89 89 4915 1 . THR 90 90 4915 1 . GLY 91 91 4915 1 . MET 92 92 4915 1 . LEU 93 93 4915 1 . LEU 94 94 4915 1 . GLU 95 95 4915 1 . ILE 96 96 4915 1 . ASP 97 97 4915 1 . ASN 98 98 4915 1 . SER 99 99 4915 1 . GLU 100 100 4915 1 . LEU 101 101 4915 1 . LEU 102 102 4915 1 . HIS 103 103 4915 1 . MET 104 104 4915 1 . LEU 105 105 4915 1 . GLU 106 106 4915 1 . SER 107 107 4915 1 . PRO 108 108 4915 1 . GLU 109 109 4915 1 . SER 110 110 4915 1 . LEU 111 111 4915 1 . ARG 112 112 4915 1 . SER 113 113 4915 1 . LYS 114 114 4915 1 . VAL 115 115 4915 1 . ASP 116 116 4915 1 . GLU 117 117 4915 1 . ALA 118 118 4915 1 . VAL 119 119 4915 1 . ALA 120 120 4915 1 . VAL 121 121 4915 1 . LEU 122 122 4915 1 . GLN 123 123 4915 1 . ALA 124 124 4915 1 . HIS 125 125 4915 1 . GLN 126 126 4915 1 . ALA 127 127 4915 1 . LYS 128 128 4915 1 . GLU 129 129 4915 1 . ALA 130 130 4915 1 . ALA 131 131 4915 1 . GLN 132 132 4915 1 . LYS 133 133 4915 1 . ALA 134 134 4915 1 . VAL 135 135 4915 1 . ASN 136 136 4915 1 . SER 137 137 4915 1 . ALA 138 138 4915 1 . THR 139 139 4915 1 . GLY 140 140 4915 1 . VAL 141 141 4915 1 . PRO 142 142 4915 1 . THR 143 143 4915 1 . VAL 144 144 4915 1 stop_ save_ #################### # Natural source # #################### save_natural_source _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source _Entity_natural_src_list.Entry_ID 4915 _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 $PABC . 9606 organism . 'Homo sapiens' human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . . . . . . . . . 4915 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 4915 _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 $PABC . 'recombinant technology' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 4915 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 4915 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system . _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 'C-terminal domain of PABP' [U-15N] . . 1 $PABC . . . 2.5 3.0 mM . . . . 4915 1 2 'phosphate buffer' . . . . . . . 50 . . mM . . . . 4915 1 3 NaCl . . . . . . . 0.1 . . M . . . . 4915 1 4 NaN3 . . . . . . . 1 . . mM . . . . 4915 1 5 H2O . . . . . . . 90 . . % . . . . 4915 1 6 D2O . . . . . . . 10 . . % . . . . 4915 1 stop_ save_ save_sample_2 _Sample.Sf_category sample _Sample.Sf_framecode sample_2 _Sample.Entry_ID 4915 _Sample.ID 2 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system . _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 'C-terminal domain of PABP' '[U-15N; U-13C]' . . 1 $PABC . . 3.0 . . mM . . . . 4915 2 2 'phosphate buffer' . . . . . . . 50 . . mM . . . . 4915 2 3 NaCl . . . . . . . 0.1 . . M . . . . 4915 2 4 NaN3 . . . . . . . 1 . . mM . . . . 4915 2 5 D2O . . . . . . . 100 . . % . . . . 4915 2 stop_ save_ save_sample_3 _Sample.Sf_category sample _Sample.Sf_framecode sample_3 _Sample.Entry_ID 4915 _Sample.ID 3 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system . _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 'C-terminal domain of PABP' . . . 1 $PABC . . 3.0 . . mM . . . . 4915 3 2 'phosphate buffer' . . . . . . . 50 . . mM . . . . 4915 3 3 NaCl . . . . . . . 0.1 . . M . . . . 4915 3 4 NaN3 . . . . . . . 1 . . mM . . . . 4915 3 5 H2O . . . . . . . 90 . . % . . . . 4915 3 6 D2O . . . . . . . 10 . . % . . . . 4915 3 stop_ save_ ####################### # Sample conditions # ####################### save_sample_cond_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_cond_1 _Sample_condition_list.Entry_ID 4915 _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 pH 6.3 0.1 n/a 4915 1 temperature 303 0.1 K 4915 1 'ionic strength' 0.2 . M 4915 1 pressure 1 . atm 4915 1 stop_ save_ ############################ # Computer software used # ############################ save_XWINNMR _Software.Sf_category software _Software.Sf_framecode XWINNMR _Software.Entry_ID 4915 _Software.ID 1 _Software.Name XWINNMR _Software.Version 2.1 _Software.Details 'Bruker Spectrospin' loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data collection' 4915 1 stop_ save_ save_GIFA _Software.Sf_category software _Software.Sf_framecode GIFA _Software.Entry_ID 4915 _Software.ID 2 _Software.Name GIFA _Software.Version 4.31 _Software.Details Delsuc loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data processing' 4915 2 stop_ save_ save_XEASY _Software.Sf_category software _Software.Sf_framecode XEASY _Software.Entry_ID 4915 _Software.ID 3 _Software.Name XEASY _Software.Version 1.3.13 _Software.Details Wuthrich loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 4915 3 stop_ save_ save_CNS _Software.Sf_category software _Software.Sf_framecode CNS _Software.Entry_ID 4915 _Software.ID 4 _Software.Name CNS _Software.Version 0.9 _Software.Details Brunger loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'structure solution' 4915 4 stop_ save_ save_ARIA _Software.Sf_category software _Software.Sf_framecode ARIA _Software.Entry_ID 4915 _Software.ID 5 _Software.Name ARIA _Software.Version 0.9 _Software.Details Nilges loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'structure solution' 4915 5 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_NMR_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_1 _NMR_spectrometer.Entry_ID 4915 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model DRX _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 500 save_ save_NMR_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_2 _NMR_spectrometer.Entry_ID 4915 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model UnityPlus _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ save_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode spectrometer_list _NMR_spectrometer_list.Entry_ID 4915 _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 NMR_spectrometer_1 Bruker DRX . 500 . . . 4915 1 2 NMR_spectrometer_2 Varian UnityPlus . 800 . . . 4915 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 4915 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '3D 15N-separated NOESY' . . . . . . . . . . . . . . . . 1 $sample_cond_1 . . . . . . . . . . . . . . . . . . . . . 4915 1 2 '3D 13C-separated NOESY' . . . . . . . . . . . . . . . . 1 $sample_cond_1 . . . . . . . . . . . . . . . . . . . . . 4915 1 3 '2D NOESY' . . . . . . . . . . . . . . . . 1 $sample_cond_1 . . . . . . . . . . . . . . . . . . . . . 4915 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_reference _Chem_shift_reference.Entry_ID 4915 _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 H 1 DSS 'methyl protons' . . . . ppm 0.0 . indirect . . . . 1 $entry_citation . . 1 $entry_citation 4915 1 N 15 DSS 'methyl protons' . . . . ppm 0.0 . indirect 0.101329118 . . . 1 $entry_citation . . 1 $entry_citation 4915 1 C 13 DSS 'methyl protons' . . . . ppm 0.0 . indirect 0.251449530 . . . 1 $entry_citation . . 1 $entry_citation 4915 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_chemical_shift_set_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode chemical_shift_set_1 _Assigned_chem_shift_list.Entry_ID 4915 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_cond_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference _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 $sample_1 . 4915 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 2 2 PRO CA C 13 62.5 0.20 . 1 . . . . . . . . 4915 1 2 . 1 1 2 2 PRO CB C 13 31.7 0.20 . 1 . . . . . . . . 4915 1 3 . 1 1 2 2 PRO C C 13 176.7 0.20 . 1 . . . . . . . . 4915 1 4 . 1 1 3 3 LEU N N 15 122.1 0.25 . 1 . . . . . . . . 4915 1 5 . 1 1 3 3 LEU H H 1 8.59 0.03 . 1 . . . . . . . . 4915 1 6 . 1 1 3 3 LEU CA C 13 54.9 0.20 . 1 . . . . . . . . 4915 1 7 . 1 1 3 3 LEU HA H 1 4.44 0.03 . 1 . . . . . . . . 4915 1 8 . 1 1 3 3 LEU CB C 13 41.7 0.20 . 1 . . . . . . . . 4915 1 9 . 1 1 3 3 LEU HB2 H 1 1.75 0.03 . 2 . . . . . . . . 4915 1 10 . 1 1 3 3 LEU HB3 H 1 1.69 0.03 . 2 . . . . . . . . 4915 1 11 . 1 1 3 3 LEU HD11 H 1 0.99 0.03 . 1 . . . . . . . . 4915 1 12 . 1 1 3 3 LEU HD12 H 1 0.99 0.03 . 1 . . . . . . . . 4915 1 13 . 1 1 3 3 LEU HD13 H 1 0.99 0.03 . 1 . . . . . . . . 4915 1 14 . 1 1 3 3 LEU HD21 H 1 0.99 0.03 . 1 . . . . . . . . 4915 1 15 . 1 1 3 3 LEU HD22 H 1 0.99 0.03 . 1 . . . . . . . . 4915 1 16 . 1 1 3 3 LEU HD23 H 1 0.99 0.03 . 1 . . . . . . . . 4915 1 17 . 1 1 3 3 LEU C C 13 177.6 0.20 . 1 . . . . . . . . 4915 1 18 . 1 1 4 4 GLY N N 15 109.7 0.25 . 1 . . . . . . . . 4915 1 19 . 1 1 4 4 GLY H H 1 8.49 0.03 . 1 . . . . . . . . 4915 1 20 . 1 1 4 4 GLY CA C 13 44.7 0.20 . 1 . . . . . . . . 4915 1 21 . 1 1 4 4 GLY HA2 H 1 4.06 0.03 . 1 . . . . . . . . 4915 1 22 . 1 1 4 4 GLY HA3 H 1 4.06 0.03 . 1 . . . . . . . . 4915 1 23 . 1 1 4 4 GLY C C 13 174.0 0.20 . 1 . . . . . . . . 4915 1 24 . 1 1 5 5 SER N N 15 115.5 0.25 . 1 . . . . . . . . 4915 1 25 . 1 1 5 5 SER H H 1 8.28 0.03 . 1 . . . . . . . . 4915 1 26 . 1 1 5 5 SER CA C 13 59.2 0.20 . 1 . . . . . . . . 4915 1 27 . 1 1 5 5 SER HA H 1 3.96 0.03 . 1 . . . . . . . . 4915 1 28 . 1 1 5 5 SER HB2 H 1 4.52 0.03 . 1 . . . . . . . . 4915 1 29 . 1 1 5 5 SER HB3 H 1 4.52 0.03 . 1 . . . . . . . . 4915 1 30 . 1 1 5 5 SER C C 13 174.2 0.20 . 1 . . . . . . . . 4915 1 31 . 1 1 8 8 ALA CA C 13 51.6 0.20 . 1 . . . . . . . . 4915 1 32 . 1 1 8 8 ALA CB C 13 18.8 0.20 . 1 . . . . . . . . 4915 1 33 . 1 1 8 8 ALA C C 13 177.2 0.20 . 1 . . . . . . . . 4915 1 34 . 1 1 9 9 ALA N N 15 123.0 0.25 . 1 . . . . . . . . 4915 1 35 . 1 1 9 9 ALA H H 1 8.26 0.03 . 1 . . . . . . . . 4915 1 36 . 1 1 9 9 ALA CA C 13 51.6 0.20 . 1 . . . . . . . . 4915 1 37 . 1 1 9 9 ALA HA H 1 4.43 0.03 . 1 . . . . . . . . 4915 1 38 . 1 1 9 9 ALA CB C 13 18.9 0.20 . 1 . . . . . . . . 4915 1 39 . 1 1 9 9 ALA HB1 H 1 1.46 0.03 . 1 . . . . . . . . 4915 1 40 . 1 1 9 9 ALA HB2 H 1 1.46 0.03 . 1 . . . . . . . . 4915 1 41 . 1 1 9 9 ALA HB3 H 1 1.46 0.03 . 1 . . . . . . . . 4915 1 42 . 1 1 9 9 ALA C C 13 177.1 0.20 . 1 . . . . . . . . 4915 1 43 . 1 1 10 10 THR N N 15 115.9 0.25 . 1 . . . . . . . . 4915 1 44 . 1 1 10 10 THR H H 1 8.18 0.03 . 1 . . . . . . . . 4915 1 45 . 1 1 10 10 THR CA C 13 59.2 0.20 . 1 . . . . . . . . 4915 1 46 . 1 1 11 11 PRO CD C 13 49.6 0.20 . 1 . . . . . . . . 4915 1 47 . 1 1 11 11 PRO CA C 13 62.5 0.20 . 1 . . . . . . . . 4915 1 48 . 1 1 11 11 PRO CB C 13 31.6 0.20 . 1 . . . . . . . . 4915 1 49 . 1 1 11 11 PRO CG C 13 26.3 0.20 . 1 . . . . . . . . 4915 1 50 . 1 1 11 11 PRO C C 13 176.1 0.20 . 1 . . . . . . . . 4915 1 51 . 1 1 12 12 ALA N N 15 124.3 0.25 . 1 . . . . . . . . 4915 1 52 . 1 1 12 12 ALA H H 1 8.42 0.03 . 1 . . . . . . . . 4915 1 53 . 1 1 12 12 ALA CA C 13 51.8 0.20 . 1 . . . . . . . . 4915 1 54 . 1 1 12 12 ALA HA H 1 4.38 0.03 . 1 . . . . . . . . 4915 1 55 . 1 1 12 12 ALA CB C 13 18.6 0.20 . 1 . . . . . . . . 4915 1 56 . 1 1 12 12 ALA HB1 H 1 1.45 0.03 . 1 . . . . . . . . 4915 1 57 . 1 1 12 12 ALA HB2 H 1 1.45 0.03 . 1 . . . . . . . . 4915 1 58 . 1 1 12 12 ALA HB3 H 1 1.45 0.03 . 1 . . . . . . . . 4915 1 59 . 1 1 12 12 ALA C C 13 177.4 0.20 . 1 . . . . . . . . 4915 1 60 . 1 1 13 13 VAL N N 15 119.2 0.25 . 1 . . . . . . . . 4915 1 61 . 1 1 13 13 VAL H H 1 8.14 0.03 . 1 . . . . . . . . 4915 1 62 . 1 1 13 13 VAL CA C 13 61.6 0.20 . 1 . . . . . . . . 4915 1 63 . 1 1 13 13 VAL HA H 1 4.17 0.03 . 1 . . . . . . . . 4915 1 64 . 1 1 13 13 VAL CB C 13 32.3 0.20 . 1 . . . . . . . . 4915 1 65 . 1 1 13 13 VAL HB H 1 2.12 0.03 . 1 . . . . . . . . 4915 1 66 . 1 1 13 13 VAL CG1 C 13 20.2 0.20 . 1 . . . . . . . . 4915 1 67 . 1 1 13 13 VAL HG11 H 1 1.01 0.03 . 1 . . . . . . . . 4915 1 68 . 1 1 13 13 VAL HG12 H 1 1.01 0.03 . 1 . . . . . . . . 4915 1 69 . 1 1 13 13 VAL HG13 H 1 1.01 0.03 . 1 . . . . . . . . 4915 1 70 . 1 1 13 13 VAL CG2 C 13 20.2 0.20 . 1 . . . . . . . . 4915 1 71 . 1 1 13 13 VAL HG21 H 1 1.01 0.03 . 1 . . . . . . . . 4915 1 72 . 1 1 13 13 VAL HG22 H 1 1.01 0.03 . 1 . . . . . . . . 4915 1 73 . 1 1 13 13 VAL HG23 H 1 1.01 0.03 . 1 . . . . . . . . 4915 1 74 . 1 1 13 13 VAL C C 13 175.6 0.20 . 1 . . . . . . . . 4915 1 75 . 1 1 14 14 ARG N N 15 124.7 0.25 . 1 . . . . . . . . 4915 1 76 . 1 1 14 14 ARG H H 1 8.49 0.03 . 1 . . . . . . . . 4915 1 77 . 1 1 14 14 ARG CA C 13 55.4 0.20 . 1 . . . . . . . . 4915 1 78 . 1 1 14 14 ARG HA H 1 4.50 0.03 . 1 . . . . . . . . 4915 1 79 . 1 1 14 14 ARG CB C 13 30.2 0.20 . 1 . . . . . . . . 4915 1 80 . 1 1 14 14 ARG HB2 H 1 1.92 0.03 . 2 . . . . . . . . 4915 1 81 . 1 1 14 14 ARG HB3 H 1 1.83 0.03 . 2 . . . . . . . . 4915 1 82 . 1 1 14 14 ARG HG2 H 1 1.69 0.03 . 1 . . . . . . . . 4915 1 83 . 1 1 14 14 ARG HG3 H 1 1.69 0.03 . 1 . . . . . . . . 4915 1 84 . 1 1 14 14 ARG HD2 H 1 3.27 0.03 . 1 . . . . . . . . 4915 1 85 . 1 1 14 14 ARG HD3 H 1 3.27 0.03 . 1 . . . . . . . . 4915 1 86 . 1 1 14 14 ARG C C 13 175.8 0.20 . 1 . . . . . . . . 4915 1 87 . 1 1 15 15 THR N N 15 116.3 0.25 . 1 . . . . . . . . 4915 1 88 . 1 1 15 15 THR H H 1 8.30 0.03 . 1 . . . . . . . . 4915 1 89 . 1 1 15 15 THR CA C 13 61.2 0.20 . 1 . . . . . . . . 4915 1 90 . 1 1 15 15 THR HA H 1 4.42 0.03 . 1 . . . . . . . . 4915 1 91 . 1 1 15 15 THR CB C 13 69.3 0.20 . 1 . . . . . . . . 4915 1 92 . 1 1 15 15 THR HB H 1 4.21 0.03 . 1 . . . . . . . . 4915 1 93 . 1 1 15 15 THR HG21 H 1 1.24 0.03 . 1 . . . . . . . . 4915 1 94 . 1 1 15 15 THR HG22 H 1 1.24 0.03 . 1 . . . . . . . . 4915 1 95 . 1 1 15 15 THR HG23 H 1 1.24 0.03 . 1 . . . . . . . . 4915 1 96 . 1 1 15 15 THR C C 13 173.8 0.20 . 1 . . . . . . . . 4915 1 97 . 1 1 16 16 VAL N N 15 123.6 0.25 . 1 . . . . . . . . 4915 1 98 . 1 1 16 16 VAL H H 1 8.25 0.03 . 1 . . . . . . . . 4915 1 99 . 1 1 16 16 VAL CA C 13 59.2 0.20 . 1 . . . . . . . . 4915 1 100 . 1 1 16 16 VAL HA H 1 4.51 0.03 . 1 . . . . . . . . 4915 1 101 . 1 1 16 16 VAL HB H 1 2.14 0.03 . 1 . . . . . . . . 4915 1 102 . 1 1 16 16 VAL HG11 H 1 1.02 0.03 . 1 . . . . . . . . 4915 1 103 . 1 1 16 16 VAL HG12 H 1 1.02 0.03 . 1 . . . . . . . . 4915 1 104 . 1 1 16 16 VAL HG13 H 1 1.02 0.03 . 1 . . . . . . . . 4915 1 105 . 1 1 16 16 VAL HG21 H 1 1.02 0.03 . 1 . . . . . . . . 4915 1 106 . 1 1 16 16 VAL HG22 H 1 1.02 0.03 . 1 . . . . . . . . 4915 1 107 . 1 1 16 16 VAL HG23 H 1 1.02 0.03 . 1 . . . . . . . . 4915 1 108 . 1 1 16 16 VAL C C 13 173.9 0.20 . 1 . . . . . . . . 4915 1 109 . 1 1 17 17 PRO CA C 13 62.5 0.20 . 1 . . . . . . . . 4915 1 110 . 1 1 17 17 PRO HA H 1 4.39 0.03 . 1 . . . . . . . . 4915 1 111 . 1 1 17 17 PRO CB C 13 31.6 0.20 . 1 . . . . . . . . 4915 1 112 . 1 1 17 17 PRO C C 13 175.3 0.20 . 1 . . . . . . . . 4915 1 113 . 1 1 18 18 GLN N N 15 120.1 0.25 . 1 . . . . . . . . 4915 1 114 . 1 1 18 18 GLN H H 1 8.43 0.03 . 1 . . . . . . . . 4915 1 115 . 1 1 18 18 GLN CA C 13 55.5 0.20 . 1 . . . . . . . . 4915 1 116 . 1 1 18 18 GLN HA H 1 4.28 0.03 . 1 . . . . . . . . 4915 1 117 . 1 1 18 18 GLN CB C 13 28.7 0.20 . 1 . . . . . . . . 4915 1 118 . 1 1 18 18 GLN HB2 H 1 2.01 0.03 . 2 . . . . . . . . 4915 1 119 . 1 1 18 18 GLN HB3 H 1 1.98 0.03 . 2 . . . . . . . . 4915 1 120 . 1 1 18 18 GLN CG C 13 33.5 0.20 . 1 . . . . . . . . 4915 1 121 . 1 1 18 18 GLN HG2 H 1 2.36 0.03 . 1 . . . . . . . . 4915 1 122 . 1 1 18 18 GLN HG3 H 1 2.36 0.03 . 1 . . . . . . . . 4915 1 123 . 1 1 18 18 GLN C C 13 176.2 0.20 . 1 . . . . . . . . 4915 1 124 . 1 1 19 19 TYR N N 15 120.9 0.25 . 1 . . . . . . . . 4915 1 125 . 1 1 19 19 TYR H H 1 8.16 0.03 . 1 . . . . . . . . 4915 1 126 . 1 1 19 19 TYR CA C 13 57.0 0.20 . 1 . . . . . . . . 4915 1 127 . 1 1 19 19 TYR HA H 1 4.57 0.03 . 1 . . . . . . . . 4915 1 128 . 1 1 19 19 TYR CB C 13 38.4 0.20 . 1 . . . . . . . . 4915 1 129 . 1 1 19 19 TYR HB2 H 1 2.98 0.03 . 2 . . . . . . . . 4915 1 130 . 1 1 19 19 TYR HB3 H 1 2.93 0.03 . 2 . . . . . . . . 4915 1 131 . 1 1 19 19 TYR HD1 H 1 7.10 0.03 . 3 . . . . . . . . 4915 1 132 . 1 1 19 19 TYR HE1 H 1 6.84 0.03 . 3 . . . . . . . . 4915 1 133 . 1 1 19 19 TYR C C 13 175.1 0.20 . 1 . . . . . . . . 4915 1 134 . 1 1 20 20 LYS N N 15 123.0 0.25 . 1 . . . . . . . . 4915 1 135 . 1 1 20 20 LYS H H 1 8.12 0.03 . 1 . . . . . . . . 4915 1 136 . 1 1 20 20 LYS CA C 13 55.6 0.20 . 1 . . . . . . . . 4915 1 137 . 1 1 20 20 LYS HA H 1 4.26 0.03 . 1 . . . . . . . . 4915 1 138 . 1 1 20 20 LYS CB C 13 32.7 0.20 . 1 . . . . . . . . 4915 1 139 . 1 1 20 20 LYS HB2 H 1 1.66 0.03 . 1 . . . . . . . . 4915 1 140 . 1 1 20 20 LYS HB3 H 1 1.66 0.03 . 1 . . . . . . . . 4915 1 141 . 1 1 20 20 LYS CG C 13 28.4 0.20 . 1 . . . . . . . . 4915 1 142 . 1 1 20 20 LYS HG2 H 1 1.28 0.03 . 1 . . . . . . . . 4915 1 143 . 1 1 20 20 LYS HG3 H 1 1.28 0.03 . 1 . . . . . . . . 4915 1 144 . 1 1 20 20 LYS HE2 H 1 3.00 0.03 . 1 . . . . . . . . 4915 1 145 . 1 1 20 20 LYS HE3 H 1 3.00 0.03 . 1 . . . . . . . . 4915 1 146 . 1 1 20 20 LYS C C 13 175.3 0.20 . 1 . . . . . . . . 4915 1 147 . 1 1 21 21 TYR N N 15 120.9 0.25 . 1 . . . . . . . . 4915 1 148 . 1 1 21 21 TYR H H 1 8.04 0.03 . 1 . . . . . . . . 4915 1 149 . 1 1 21 21 TYR CA C 13 57.0 0.20 . 1 . . . . . . . . 4915 1 150 . 1 1 21 21 TYR HA H 1 4.56 0.03 . 1 . . . . . . . . 4915 1 151 . 1 1 21 21 TYR CB C 13 38.2 0.20 . 1 . . . . . . . . 4915 1 152 . 1 1 21 21 TYR HB2 H 1 3.08 0.03 . 2 . . . . . . . . 4915 1 153 . 1 1 21 21 TYR HB3 H 1 2.93 0.03 . 2 . . . . . . . . 4915 1 154 . 1 1 21 21 TYR HD1 H 1 7.18 0.03 . 3 . . . . . . . . 4915 1 155 . 1 1 21 21 TYR HE1 H 1 6.87 0.03 . 3 . . . . . . . . 4915 1 156 . 1 1 21 21 TYR C C 13 175.1 0.20 . 1 . . . . . . . . 4915 1 157 . 1 1 22 22 ALA N N 15 125.7 0.25 . 1 . . . . . . . . 4915 1 158 . 1 1 22 22 ALA H H 1 8.16 0.03 . 1 . . . . . . . . 4915 1 159 . 1 1 22 22 ALA CA C 13 51.7 0.20 . 1 . . . . . . . . 4915 1 160 . 1 1 22 22 ALA HA H 1 4.31 0.03 . 1 . . . . . . . . 4915 1 161 . 1 1 22 22 ALA CB C 13 18.6 0.20 . 1 . . . . . . . . 4915 1 162 . 1 1 22 22 ALA HB1 H 1 1.40 0.03 . 1 . . . . . . . . 4915 1 163 . 1 1 22 22 ALA HB2 H 1 1.40 0.03 . 1 . . . . . . . . 4915 1 164 . 1 1 22 22 ALA HB3 H 1 1.40 0.03 . 1 . . . . . . . . 4915 1 165 . 1 1 22 22 ALA C C 13 176.5 0.20 . 1 . . . . . . . . 4915 1 166 . 1 1 23 23 ALA N N 15 122.8 0.25 . 1 . . . . . . . . 4915 1 167 . 1 1 23 23 ALA H H 1 8.19 0.03 . 1 . . . . . . . . 4915 1 168 . 1 1 23 23 ALA CA C 13 52.0 0.20 . 1 . . . . . . . . 4915 1 169 . 1 1 23 23 ALA HA H 1 4.34 0.03 . 1 . . . . . . . . 4915 1 170 . 1 1 23 23 ALA CB C 13 18.5 0.20 . 1 . . . . . . . . 4915 1 171 . 1 1 23 23 ALA HB1 H 1 1.46 0.03 . 1 . . . . . . . . 4915 1 172 . 1 1 23 23 ALA HB2 H 1 1.46 0.03 . 1 . . . . . . . . 4915 1 173 . 1 1 23 23 ALA HB3 H 1 1.46 0.03 . 1 . . . . . . . . 4915 1 174 . 1 1 23 23 ALA C C 13 177.9 0.20 . 1 . . . . . . . . 4915 1 175 . 1 1 24 24 GLY N N 15 107.6 0.25 . 1 . . . . . . . . 4915 1 176 . 1 1 24 24 GLY H H 1 8.36 0.03 . 1 . . . . . . . . 4915 1 177 . 1 1 24 24 GLY CA C 13 44.7 0.20 . 1 . . . . . . . . 4915 1 178 . 1 1 24 24 GLY HA2 H 1 4.01 0.03 . 1 . . . . . . . . 4915 1 179 . 1 1 24 24 GLY HA3 H 1 4.01 0.03 . 1 . . . . . . . . 4915 1 180 . 1 1 24 24 GLY C C 13 173.7 0.20 . 1 . . . . . . . . 4915 1 181 . 1 1 25 25 VAL N N 15 119.0 0.25 . 1 . . . . . . . . 4915 1 182 . 1 1 25 25 VAL H H 1 7.92 0.03 . 1 . . . . . . . . 4915 1 183 . 1 1 25 25 VAL CA C 13 61.8 0.20 . 1 . . . . . . . . 4915 1 184 . 1 1 25 25 VAL HA H 1 4.17 0.03 . 1 . . . . . . . . 4915 1 185 . 1 1 25 25 VAL CB C 13 32.0 0.20 . 1 . . . . . . . . 4915 1 186 . 1 1 25 25 VAL HB H 1 2.14 0.03 . 1 . . . . . . . . 4915 1 187 . 1 1 25 25 VAL HG11 H 1 0.97 0.03 . 1 . . . . . . . . 4915 1 188 . 1 1 25 25 VAL HG12 H 1 0.97 0.03 . 1 . . . . . . . . 4915 1 189 . 1 1 25 25 VAL HG13 H 1 0.97 0.03 . 1 . . . . . . . . 4915 1 190 . 1 1 25 25 VAL HG21 H 1 0.97 0.03 . 1 . . . . . . . . 4915 1 191 . 1 1 25 25 VAL HG22 H 1 0.97 0.03 . 1 . . . . . . . . 4915 1 192 . 1 1 25 25 VAL HG23 H 1 0.97 0.03 . 1 . . . . . . . . 4915 1 193 . 1 1 25 25 VAL C C 13 175.7 0.20 . 1 . . . . . . . . 4915 1 194 . 1 1 26 26 ARG N N 15 124.4 0.25 . 1 . . . . . . . . 4915 1 195 . 1 1 26 26 ARG H H 1 8.47 0.03 . 1 . . . . . . . . 4915 1 196 . 1 1 26 26 ARG CA C 13 55.4 0.20 . 1 . . . . . . . . 4915 1 197 . 1 1 26 26 ARG HA H 1 4.38 0.03 . 1 . . . . . . . . 4915 1 198 . 1 1 26 26 ARG CB C 13 30.2 0.20 . 1 . . . . . . . . 4915 1 199 . 1 1 26 26 ARG HB2 H 1 1.82 0.03 . 2 . . . . . . . . 4915 1 200 . 1 1 26 26 ARG HB3 H 1 1.66 0.03 . 2 . . . . . . . . 4915 1 201 . 1 1 26 26 ARG HG2 H 1 1.46 0.03 . 1 . . . . . . . . 4915 1 202 . 1 1 26 26 ARG HG3 H 1 1.46 0.03 . 1 . . . . . . . . 4915 1 203 . 1 1 26 26 ARG HD2 H 1 3.22 0.03 . 1 . . . . . . . . 4915 1 204 . 1 1 26 26 ARG HD3 H 1 3.22 0.03 . 1 . . . . . . . . 4915 1 205 . 1 1 26 26 ARG C C 13 175.3 0.20 . 1 . . . . . . . . 4915 1 206 . 1 1 27 27 ASN N N 15 120.5 0.25 . 1 . . . . . . . . 4915 1 207 . 1 1 27 27 ASN H H 1 8.54 0.03 . 1 . . . . . . . . 4915 1 208 . 1 1 27 27 ASN CA C 13 50.7 0.20 . 1 . . . . . . . . 4915 1 209 . 1 1 27 27 ASN HA H 1 5.00 0.03 . 1 . . . . . . . . 4915 1 210 . 1 1 27 27 ASN HB2 H 1 2.90 0.03 . 2 . . . . . . . . 4915 1 211 . 1 1 27 27 ASN HB3 H 1 2.77 0.03 . 2 . . . . . . . . 4915 1 212 . 1 1 27 27 ASN C C 13 173.2 0.20 . 1 . . . . . . . . 4915 1 213 . 1 1 28 28 PRO CA C 13 63.1 0.20 . 1 . . . . . . . . 4915 1 214 . 1 1 28 28 PRO HA H 1 4.43 0.03 . 1 . . . . . . . . 4915 1 215 . 1 1 28 28 PRO CB C 13 31.6 0.20 . 1 . . . . . . . . 4915 1 216 . 1 1 28 28 PRO C C 13 176.7 0.20 . 1 . . . . . . . . 4915 1 217 . 1 1 29 29 GLN N N 15 118.6 0.25 . 1 . . . . . . . . 4915 1 218 . 1 1 29 29 GLN H H 1 8.40 0.03 . 1 . . . . . . . . 4915 1 219 . 1 1 29 29 GLN CA C 13 55.4 0.20 . 1 . . . . . . . . 4915 1 220 . 1 1 29 29 GLN HA H 1 4.34 0.03 . 1 . . . . . . . . 4915 1 221 . 1 1 29 29 GLN CB C 13 28.6 0.20 . 1 . . . . . . . . 4915 1 222 . 1 1 29 29 GLN HB2 H 1 2.16 0.03 . 2 . . . . . . . . 4915 1 223 . 1 1 29 29 GLN HB3 H 1 2.04 0.03 . 2 . . . . . . . . 4915 1 224 . 1 1 29 29 GLN HG2 H 1 2.44 0.03 . 1 . . . . . . . . 4915 1 225 . 1 1 29 29 GLN HG3 H 1 2.44 0.03 . 1 . . . . . . . . 4915 1 226 . 1 1 29 29 GLN C C 13 175.8 0.20 . 1 . . . . . . . . 4915 1 227 . 1 1 30 30 GLN N N 15 120.3 0.25 . 1 . . . . . . . . 4915 1 228 . 1 1 30 30 GLN H H 1 8.21 0.03 . 1 . . . . . . . . 4915 1 229 . 1 1 30 30 GLN CA C 13 55.4 0.20 . 1 . . . . . . . . 4915 1 230 . 1 1 30 30 GLN HA H 1 4.31 0.03 . 1 . . . . . . . . 4915 1 231 . 1 1 30 30 GLN HB2 H 1 2.04 0.03 . 1 . . . . . . . . 4915 1 232 . 1 1 30 30 GLN HB3 H 1 2.04 0.03 . 1 . . . . . . . . 4915 1 233 . 1 1 30 30 GLN HG2 H 1 2.36 0.03 . 1 . . . . . . . . 4915 1 234 . 1 1 30 30 GLN HG3 H 1 2.36 0.03 . 1 . . . . . . . . 4915 1 235 . 1 1 30 30 GLN C C 13 175.3 0.20 . 1 . . . . . . . . 4915 1 236 . 1 1 31 31 HIS CA C 13 55.1 0.20 . 1 . . . . . . . . 4915 1 237 . 1 1 31 31 HIS CB C 13 28.9 0.20 . 1 . . . . . . . . 4915 1 238 . 1 1 32 32 LEU N N 15 122.7 0.25 . 1 . . . . . . . . 4915 1 239 . 1 1 32 32 LEU H H 1 8.49 0.03 . 1 . . . . . . . . 4915 1 240 . 1 1 32 32 LEU CA C 13 54.6 0.20 . 1 . . . . . . . . 4915 1 241 . 1 1 32 32 LEU CB C 13 41.6 0.20 . 1 . . . . . . . . 4915 1 242 . 1 1 32 32 LEU C C 13 176.7 0.20 . 1 . . . . . . . . 4915 1 243 . 1 1 33 33 ASN N N 15 119.0 0.25 . 1 . . . . . . . . 4915 1 244 . 1 1 33 33 ASN H H 1 8.52 0.03 . 1 . . . . . . . . 4915 1 245 . 1 1 33 33 ASN CA C 13 52.5 0.20 . 1 . . . . . . . . 4915 1 246 . 1 1 33 33 ASN HA H 1 4.75 0.03 . 1 . . . . . . . . 4915 1 247 . 1 1 33 33 ASN CB C 13 38.2 0.20 . 1 . . . . . . . . 4915 1 248 . 1 1 33 33 ASN HB2 H 1 2.92 0.03 . 2 . . . . . . . . 4915 1 249 . 1 1 33 33 ASN HB3 H 1 2.82 0.03 . 2 . . . . . . . . 4915 1 250 . 1 1 33 33 ASN C C 13 174.3 0.20 . 1 . . . . . . . . 4915 1 251 . 1 1 34 34 ALA N N 15 123.6 0.25 . 1 . . . . . . . . 4915 1 252 . 1 1 34 34 ALA H H 1 8.22 0.03 . 1 . . . . . . . . 4915 1 253 . 1 1 34 34 ALA CA C 13 51.8 0.20 . 1 . . . . . . . . 4915 1 254 . 1 1 34 34 ALA HA H 1 4.39 0.03 . 1 . . . . . . . . 4915 1 255 . 1 1 34 34 ALA CB C 13 18.8 0.20 . 1 . . . . . . . . 4915 1 256 . 1 1 34 34 ALA HB1 H 1 1.45 0.03 . 1 . . . . . . . . 4915 1 257 . 1 1 34 34 ALA HB2 H 1 1.45 0.03 . 1 . . . . . . . . 4915 1 258 . 1 1 34 34 ALA HB3 H 1 1.45 0.03 . 1 . . . . . . . . 4915 1 259 . 1 1 34 34 ALA C C 13 176.9 0.20 . 1 . . . . . . . . 4915 1 260 . 1 1 35 35 GLN N N 15 120.3 0.25 . 1 . . . . . . . . 4915 1 261 . 1 1 35 35 GLN H H 1 8.36 0.03 . 1 . . . . . . . . 4915 1 262 . 1 1 35 35 GLN CA C 13 53.1 0.20 . 1 . . . . . . . . 4915 1 263 . 1 1 35 35 GLN HA H 1 4.68 0.03 . 1 . . . . . . . . 4915 1 264 . 1 1 35 35 GLN HB2 H 1 2.17 0.03 . 2 . . . . . . . . 4915 1 265 . 1 1 35 35 GLN HB3 H 1 2.01 0.03 . 2 . . . . . . . . 4915 1 266 . 1 1 35 35 GLN HG2 H 1 2.46 0.03 . 1 . . . . . . . . 4915 1 267 . 1 1 35 35 GLN HG3 H 1 2.46 0.03 . 1 . . . . . . . . 4915 1 268 . 1 1 35 35 GLN C C 13 173.7 0.20 . 1 . . . . . . . . 4915 1 269 . 1 1 36 36 PRO CA C 13 62.7 0.20 . 1 . . . . . . . . 4915 1 270 . 1 1 36 36 PRO HA H 1 4.47 0.03 . 1 . . . . . . . . 4915 1 271 . 1 1 36 36 PRO CB C 13 31.6 0.20 . 1 . . . . . . . . 4915 1 272 . 1 1 36 36 PRO CG C 13 26.3 0.20 . 1 . . . . . . . . 4915 1 273 . 1 1 36 36 PRO C C 13 176.5 0.20 . 1 . . . . . . . . 4915 1 274 . 1 1 37 37 GLN N N 15 120.5 0.25 . 1 . . . . . . . . 4915 1 275 . 1 1 37 37 GLN H H 1 8.58 0.03 . 1 . . . . . . . . 4915 1 276 . 1 1 37 37 GLN CA C 13 55.3 0.20 . 1 . . . . . . . . 4915 1 277 . 1 1 37 37 GLN HA H 1 4.42 0.03 . 1 . . . . . . . . 4915 1 278 . 1 1 37 37 GLN CB C 13 28.9 0.20 . 1 . . . . . . . . 4915 1 279 . 1 1 37 37 GLN HB2 H 1 2.15 0.03 . 2 . . . . . . . . 4915 1 280 . 1 1 37 37 GLN HB3 H 1 2.06 0.03 . 2 . . . . . . . . 4915 1 281 . 1 1 37 37 GLN CG C 13 33.6 0.20 . 1 . . . . . . . . 4915 1 282 . 1 1 37 37 GLN HG2 H 1 2.46 0.03 . 1 . . . . . . . . 4915 1 283 . 1 1 37 37 GLN HG3 H 1 2.46 0.03 . 1 . . . . . . . . 4915 1 284 . 1 1 37 37 GLN C C 13 175.7 0.20 . 1 . . . . . . . . 4915 1 285 . 1 1 38 38 VAL N N 15 121.1 0.25 . 1 . . . . . . . . 4915 1 286 . 1 1 38 38 VAL H H 1 8.28 0.03 . 1 . . . . . . . . 4915 1 287 . 1 1 38 38 VAL CA C 13 61.7 0.20 . 1 . . . . . . . . 4915 1 288 . 1 1 38 38 VAL HA H 1 4.26 0.03 . 1 . . . . . . . . 4915 1 289 . 1 1 38 38 VAL CB C 13 32.3 0.20 . 1 . . . . . . . . 4915 1 290 . 1 1 38 38 VAL HB H 1 2.17 0.03 . 1 . . . . . . . . 4915 1 291 . 1 1 38 38 VAL CG1 C 13 20.2 0.20 . 1 . . . . . . . . 4915 1 292 . 1 1 38 38 VAL HG11 H 1 1.01 0.03 . 1 . . . . . . . . 4915 1 293 . 1 1 38 38 VAL HG12 H 1 1.01 0.03 . 1 . . . . . . . . 4915 1 294 . 1 1 38 38 VAL HG13 H 1 1.01 0.03 . 1 . . . . . . . . 4915 1 295 . 1 1 38 38 VAL CG2 C 13 20.2 0.20 . 1 . . . . . . . . 4915 1 296 . 1 1 38 38 VAL HG21 H 1 1.01 0.03 . 1 . . . . . . . . 4915 1 297 . 1 1 38 38 VAL HG22 H 1 1.01 0.03 . 1 . . . . . . . . 4915 1 298 . 1 1 38 38 VAL HG23 H 1 1.01 0.03 . 1 . . . . . . . . 4915 1 299 . 1 1 38 38 VAL C C 13 175.8 0.20 . 1 . . . . . . . . 4915 1 300 . 1 1 39 39 THR N N 15 117.6 0.25 . 1 . . . . . . . . 4915 1 301 . 1 1 39 39 THR H H 1 8.29 0.03 . 1 . . . . . . . . 4915 1 302 . 1 1 39 39 THR CA C 13 61.2 0.20 . 1 . . . . . . . . 4915 1 303 . 1 1 39 39 THR HA H 1 4.42 0.03 . 1 . . . . . . . . 4915 1 304 . 1 1 39 39 THR CB C 13 69.2 0.20 . 1 . . . . . . . . 4915 1 305 . 1 1 39 39 THR HB H 1 4.26 0.03 . 1 . . . . . . . . 4915 1 306 . 1 1 39 39 THR CG2 C 13 21.2 0.20 . 1 . . . . . . . . 4915 1 307 . 1 1 39 39 THR HG21 H 1 1.27 0.03 . 1 . . . . . . . . 4915 1 308 . 1 1 39 39 THR HG22 H 1 1.27 0.03 . 1 . . . . . . . . 4915 1 309 . 1 1 39 39 THR HG23 H 1 1.27 0.03 . 1 . . . . . . . . 4915 1 310 . 1 1 39 39 THR C C 13 174.0 0.20 . 1 . . . . . . . . 4915 1 311 . 1 1 40 40 MET N N 15 122.6 0.25 . 1 . . . . . . . . 4915 1 312 . 1 1 40 40 MET H H 1 8.44 0.03 . 1 . . . . . . . . 4915 1 313 . 1 1 40 40 MET CA C 13 55.0 0.20 . 1 . . . . . . . . 4915 1 314 . 1 1 40 40 MET HA H 1 4.55 0.03 . 1 . . . . . . . . 4915 1 315 . 1 1 40 40 MET CB C 13 32.2 0.20 . 1 . . . . . . . . 4915 1 316 . 1 1 40 40 MET HB2 H 1 2.14 0.03 . 2 . . . . . . . . 4915 1 317 . 1 1 40 40 MET HB3 H 1 2.07 0.03 . 2 . . . . . . . . 4915 1 318 . 1 1 40 40 MET HG2 H 1 2.64 0.03 . 2 . . . . . . . . 4915 1 319 . 1 1 40 40 MET HG3 H 1 2.60 0.03 . 2 . . . . . . . . 4915 1 320 . 1 1 40 40 MET CE C 13 16.5 0.20 . 1 . . . . . . . . 4915 1 321 . 1 1 40 40 MET HE1 H 1 2.16 0.03 . 1 . . . . . . . . 4915 1 322 . 1 1 40 40 MET HE2 H 1 2.16 0.03 . 1 . . . . . . . . 4915 1 323 . 1 1 40 40 MET HE3 H 1 2.16 0.03 . 1 . . . . . . . . 4915 1 324 . 1 1 40 40 MET C C 13 175.5 0.20 . 1 . . . . . . . . 4915 1 325 . 1 1 41 41 GLN N N 15 121.7 0.25 . 1 . . . . . . . . 4915 1 326 . 1 1 41 41 GLN H H 1 8.45 0.03 . 1 . . . . . . . . 4915 1 327 . 1 1 41 41 GLN CA C 13 55.1 0.20 . 1 . . . . . . . . 4915 1 328 . 1 1 41 41 GLN HA H 1 4.39 0.03 . 1 . . . . . . . . 4915 1 329 . 1 1 41 41 GLN HB2 H 1 2.15 0.03 . 2 . . . . . . . . 4915 1 330 . 1 1 41 41 GLN HB3 H 1 2.04 0.03 . 2 . . . . . . . . 4915 1 331 . 1 1 41 41 GLN HG2 H 1 2.43 0.03 . 1 . . . . . . . . 4915 1 332 . 1 1 41 41 GLN HG3 H 1 2.43 0.03 . 1 . . . . . . . . 4915 1 333 . 1 1 41 41 GLN C C 13 175.2 0.20 . 1 . . . . . . . . 4915 1 334 . 1 1 42 42 GLN N N 15 120.3 0.25 . 1 . . . . . . . . 4915 1 335 . 1 1 42 42 GLN H H 1 8.42 0.03 . 1 . . . . . . . . 4915 1 336 . 1 1 42 42 GLN HA H 1 4.28 0.03 . 1 . . . . . . . . 4915 1 337 . 1 1 42 42 GLN HB2 H 1 1.99 0.03 . 1 . . . . . . . . 4915 1 338 . 1 1 42 42 GLN HB3 H 1 1.99 0.03 . 1 . . . . . . . . 4915 1 339 . 1 1 42 42 GLN HG2 H 1 2.36 0.03 . 1 . . . . . . . . 4915 1 340 . 1 1 42 42 GLN HG3 H 1 2.36 0.03 . 1 . . . . . . . . 4915 1 341 . 1 1 42 42 GLN C C 13 176.2 0.20 . 1 . . . . . . . . 4915 1 342 . 1 1 43 43 PRO CD C 13 49.1 0.20 . 1 . . . . . . . . 4915 1 343 . 1 1 43 43 PRO CA C 13 62.5 0.20 . 1 . . . . . . . . 4915 1 344 . 1 1 43 43 PRO HA H 1 4.47 0.03 . 1 . . . . . . . . 4915 1 345 . 1 1 43 43 PRO CB C 13 31.6 0.20 . 1 . . . . . . . . 4915 1 346 . 1 1 43 43 PRO CG C 13 26.4 0.20 . 1 . . . . . . . . 4915 1 347 . 1 1 43 43 PRO C C 13 176.1 0.20 . 1 . . . . . . . . 4915 1 348 . 1 1 44 44 ALA N N 15 124.0 0.25 . 1 . . . . . . . . 4915 1 349 . 1 1 44 44 ALA H H 1 8.43 0.03 . 1 . . . . . . . . 4915 1 350 . 1 1 44 44 ALA CA C 13 51.7 0.20 . 1 . . . . . . . . 4915 1 351 . 1 1 44 44 ALA HA H 1 4.38 0.03 . 1 . . . . . . . . 4915 1 352 . 1 1 44 44 ALA CB C 13 18.7 0.20 . 1 . . . . . . . . 4915 1 353 . 1 1 44 44 ALA HB1 H 1 1.43 0.03 . 1 . . . . . . . . 4915 1 354 . 1 1 44 44 ALA HB2 H 1 1.43 0.03 . 1 . . . . . . . . 4915 1 355 . 1 1 44 44 ALA HB3 H 1 1.43 0.03 . 1 . . . . . . . . 4915 1 356 . 1 1 44 44 ALA C C 13 177.2 0.20 . 1 . . . . . . . . 4915 1 357 . 1 1 45 45 VAL N N 15 118.8 0.25 . 1 . . . . . . . . 4915 1 358 . 1 1 45 45 VAL H H 1 8.10 0.03 . 1 . . . . . . . . 4915 1 359 . 1 1 45 45 VAL CA C 13 61.3 0.20 . 1 . . . . . . . . 4915 1 360 . 1 1 45 45 VAL HA H 1 4.14 0.03 . 1 . . . . . . . . 4915 1 361 . 1 1 45 45 VAL CB C 13 32.2 0.20 . 1 . . . . . . . . 4915 1 362 . 1 1 45 45 VAL HB H 1 2.07 0.03 . 1 . . . . . . . . 4915 1 363 . 1 1 45 45 VAL CG1 C 13 20.1 0.20 . 1 . . . . . . . . 4915 1 364 . 1 1 45 45 VAL HG11 H 1 0.96 0.03 . 1 . . . . . . . . 4915 1 365 . 1 1 45 45 VAL HG12 H 1 0.96 0.03 . 1 . . . . . . . . 4915 1 366 . 1 1 45 45 VAL HG13 H 1 0.96 0.03 . 1 . . . . . . . . 4915 1 367 . 1 1 45 45 VAL CG2 C 13 20.1 0.20 . 1 . . . . . . . . 4915 1 368 . 1 1 45 45 VAL HG21 H 1 0.96 0.03 . 1 . . . . . . . . 4915 1 369 . 1 1 45 45 VAL HG22 H 1 0.96 0.03 . 1 . . . . . . . . 4915 1 370 . 1 1 45 45 VAL HG23 H 1 0.96 0.03 . 1 . . . . . . . . 4915 1 371 . 1 1 45 45 VAL C C 13 175.4 0.20 . 1 . . . . . . . . 4915 1 372 . 1 1 46 46 HIS N N 15 123.0 0.25 . 1 . . . . . . . . 4915 1 373 . 1 1 46 46 HIS H H 1 8.56 0.03 . 1 . . . . . . . . 4915 1 374 . 1 1 46 46 HIS CA C 13 54.9 0.20 . 1 . . . . . . . . 4915 1 375 . 1 1 46 46 HIS HA H 1 4.82 0.03 . 1 . . . . . . . . 4915 1 376 . 1 1 46 46 HIS CB C 13 29.4 0.20 . 1 . . . . . . . . 4915 1 377 . 1 1 46 46 HIS HB2 H 1 3.23 0.03 . 2 . . . . . . . . 4915 1 378 . 1 1 46 46 HIS HB3 H 1 3.17 0.03 . 2 . . . . . . . . 4915 1 379 . 1 1 46 46 HIS C C 13 174.2 0.20 . 1 . . . . . . . . 4915 1 380 . 1 1 47 47 VAL N N 15 122.4 0.25 . 1 . . . . . . . . 4915 1 381 . 1 1 47 47 VAL H H 1 8.27 0.03 . 1 . . . . . . . . 4915 1 382 . 1 1 47 47 VAL CA C 13 61.8 0.20 . 1 . . . . . . . . 4915 1 383 . 1 1 47 47 VAL HA H 1 4.16 0.03 . 1 . . . . . . . . 4915 1 384 . 1 1 47 47 VAL CB C 13 32.1 0.20 . 1 . . . . . . . . 4915 1 385 . 1 1 47 47 VAL HB H 1 2.09 0.03 . 1 . . . . . . . . 4915 1 386 . 1 1 47 47 VAL CG1 C 13 20.2 0.20 . 1 . . . . . . . . 4915 1 387 . 1 1 47 47 VAL HG11 H 1 0.98 0.03 . 1 . . . . . . . . 4915 1 388 . 1 1 47 47 VAL HG12 H 1 0.98 0.03 . 1 . . . . . . . . 4915 1 389 . 1 1 47 47 VAL HG13 H 1 0.98 0.03 . 1 . . . . . . . . 4915 1 390 . 1 1 47 47 VAL CG2 C 13 20.2 0.20 . 1 . . . . . . . . 4915 1 391 . 1 1 47 47 VAL HG21 H 1 0.98 0.03 . 1 . . . . . . . . 4915 1 392 . 1 1 47 47 VAL HG22 H 1 0.98 0.03 . 1 . . . . . . . . 4915 1 393 . 1 1 47 47 VAL HG23 H 1 0.98 0.03 . 1 . . . . . . . . 4915 1 394 . 1 1 47 47 VAL C C 13 175.5 0.20 . 1 . . . . . . . . 4915 1 395 . 1 1 48 48 GLN N N 15 124.4 0.25 . 1 . . . . . . . . 4915 1 396 . 1 1 48 48 GLN H H 1 8.62 0.03 . 1 . . . . . . . . 4915 1 397 . 1 1 48 48 GLN CA C 13 55.6 0.20 . 1 . . . . . . . . 4915 1 398 . 1 1 48 48 GLN HA H 1 4.38 0.03 . 1 . . . . . . . . 4915 1 399 . 1 1 48 48 GLN CB C 13 28.8 0.20 . 1 . . . . . . . . 4915 1 400 . 1 1 48 48 GLN HB2 H 1 2.17 0.03 . 2 . . . . . . . . 4915 1 401 . 1 1 48 48 GLN HB3 H 1 2.10 0.03 . 2 . . . . . . . . 4915 1 402 . 1 1 48 48 GLN CG C 13 32.9 0.20 . 1 . . . . . . . . 4915 1 403 . 1 1 48 48 GLN HG2 H 1 2.47 0.03 . 1 . . . . . . . . 4915 1 404 . 1 1 48 48 GLN HG3 H 1 2.47 0.03 . 1 . . . . . . . . 4915 1 405 . 1 1 48 48 GLN C C 13 176.0 0.20 . 1 . . . . . . . . 4915 1 406 . 1 1 49 49 GLY N N 15 110.7 0.25 . 1 . . . . . . . . 4915 1 407 . 1 1 49 49 GLY H H 1 8.62 0.03 . 1 . . . . . . . . 4915 1 408 . 1 1 49 49 GLY CA C 13 44.6 0.20 . 1 . . . . . . . . 4915 1 409 . 1 1 49 49 GLY HA2 H 1 4.04 0.03 . 1 . . . . . . . . 4915 1 410 . 1 1 49 49 GLY HA3 H 1 4.04 0.03 . 1 . . . . . . . . 4915 1 411 . 1 1 49 49 GLY C C 13 173.5 0.20 . 1 . . . . . . . . 4915 1 412 . 1 1 50 50 GLN N N 15 119.2 0.25 . 1 . . . . . . . . 4915 1 413 . 1 1 50 50 GLN H H 1 8.25 0.03 . 1 . . . . . . . . 4915 1 414 . 1 1 50 50 GLN CA C 13 54.9 0.20 . 1 . . . . . . . . 4915 1 415 . 1 1 50 50 GLN HA H 1 4.46 0.03 . 1 . . . . . . . . 4915 1 416 . 1 1 50 50 GLN CB C 13 29.3 0.20 . 1 . . . . . . . . 4915 1 417 . 1 1 50 50 GLN HB2 H 1 2.17 0.03 . 2 . . . . . . . . 4915 1 418 . 1 1 50 50 GLN HB3 H 1 2.00 0.03 . 2 . . . . . . . . 4915 1 419 . 1 1 50 50 GLN CG C 13 33.6 0.20 . 1 . . . . . . . . 4915 1 420 . 1 1 50 50 GLN HG2 H 1 2.38 0.03 . 1 . . . . . . . . 4915 1 421 . 1 1 50 50 GLN HG3 H 1 2.38 0.03 . 1 . . . . . . . . 4915 1 422 . 1 1 50 50 GLN C C 13 175.5 0.20 . 1 . . . . . . . . 4915 1 423 . 1 1 51 51 GLU N N 15 124.2 0.25 . 1 . . . . . . . . 4915 1 424 . 1 1 51 51 GLU H H 1 8.73 0.03 . 1 . . . . . . . . 4915 1 425 . 1 1 51 51 GLU CA C 13 54.3 0.20 . 1 . . . . . . . . 4915 1 426 . 1 1 51 51 GLU HA H 1 4.59 0.03 . 1 . . . . . . . . 4915 1 427 . 1 1 51 51 GLU HB2 H 1 2.12 0.03 . 2 . . . . . . . . 4915 1 428 . 1 1 51 51 GLU HB3 H 1 1.99 0.03 . 2 . . . . . . . . 4915 1 429 . 1 1 51 51 GLU HG2 H 1 2.38 0.03 . 1 . . . . . . . . 4915 1 430 . 1 1 51 51 GLU HG3 H 1 2.38 0.03 . 1 . . . . . . . . 4915 1 431 . 1 1 51 51 GLU C C 13 174.0 0.20 . 1 . . . . . . . . 4915 1 432 . 1 1 52 52 PRO CA C 13 62.5 0.20 . 1 . . . . . . . . 4915 1 433 . 1 1 52 52 PRO HA H 1 4.41 0.03 . 1 . . . . . . . . 4915 1 434 . 1 1 52 52 PRO CB C 13 31.8 0.20 . 1 . . . . . . . . 4915 1 435 . 1 1 52 52 PRO CG C 13 26.6 0.20 . 1 . . . . . . . . 4915 1 436 . 1 1 52 52 PRO C C 13 175.3 0.20 . 1 . . . . . . . . 4915 1 437 . 1 1 53 53 LEU N N 15 122.4 0.25 . 1 . . . . . . . . 4915 1 438 . 1 1 53 53 LEU H H 1 8.49 0.03 . 1 . . . . . . . . 4915 1 439 . 1 1 53 53 LEU CA C 13 54.3 0.20 . 1 . . . . . . . . 4915 1 440 . 1 1 53 53 LEU HA H 1 4.66 0.03 . 1 . . . . . . . . 4915 1 441 . 1 1 53 53 LEU CB C 13 42.5 0.20 . 1 . . . . . . . . 4915 1 442 . 1 1 53 53 LEU HB2 H 1 1.61 0.03 . 2 . . . . . . . . 4915 1 443 . 1 1 53 53 LEU HB3 H 1 1.45 0.03 . 2 . . . . . . . . 4915 1 444 . 1 1 53 53 LEU CD1 C 13 26.2 0.20 . 2 . . . . . . . . 4915 1 445 . 1 1 53 53 LEU HD11 H 1 0.98 0.03 . 2 . . . . . . . . 4915 1 446 . 1 1 53 53 LEU HD12 H 1 0.98 0.03 . 2 . . . . . . . . 4915 1 447 . 1 1 53 53 LEU HD13 H 1 0.98 0.03 . 2 . . . . . . . . 4915 1 448 . 1 1 53 53 LEU CD2 C 13 24.2 0.20 . 2 . . . . . . . . 4915 1 449 . 1 1 53 53 LEU HD21 H 1 0.88 0.03 . 2 . . . . . . . . 4915 1 450 . 1 1 53 53 LEU HD22 H 1 0.88 0.03 . 2 . . . . . . . . 4915 1 451 . 1 1 53 53 LEU HD23 H 1 0.88 0.03 . 2 . . . . . . . . 4915 1 452 . 1 1 53 53 LEU C C 13 175.8 0.20 . 1 . . . . . . . . 4915 1 453 . 1 1 54 54 THR N N 15 113.1 0.25 . 1 . . . . . . . . 4915 1 454 . 1 1 54 54 THR H H 1 7.43 0.03 . 1 . . . . . . . . 4915 1 455 . 1 1 54 54 THR CA C 13 58.7 0.20 . 1 . . . . . . . . 4915 1 456 . 1 1 54 54 THR HA H 1 4.76 0.03 . 1 . . . . . . . . 4915 1 457 . 1 1 54 54 THR CB C 13 71.5 0.20 . 1 . . . . . . . . 4915 1 458 . 1 1 54 54 THR HB H 1 4.71 0.03 . 1 . . . . . . . . 4915 1 459 . 1 1 54 54 THR CG2 C 13 21.1 0.20 . 1 . . . . . . . . 4915 1 460 . 1 1 54 54 THR HG21 H 1 1.31 0.03 . 1 . . . . . . . . 4915 1 461 . 1 1 54 54 THR HG22 H 1 1.31 0.03 . 1 . . . . . . . . 4915 1 462 . 1 1 54 54 THR HG23 H 1 1.31 0.03 . 1 . . . . . . . . 4915 1 463 . 1 1 54 54 THR C C 13 174.7 0.20 . 1 . . . . . . . . 4915 1 464 . 1 1 55 55 ALA N N 15 123.2 0.25 . 1 . . . . . . . . 4915 1 465 . 1 1 55 55 ALA H H 1 9.15 0.03 . 1 . . . . . . . . 4915 1 466 . 1 1 55 55 ALA CA C 13 54.6 0.20 . 1 . . . . . . . . 4915 1 467 . 1 1 55 55 ALA HA H 1 4.07 0.03 . 1 . . . . . . . . 4915 1 468 . 1 1 55 55 ALA CB C 13 17.2 0.20 . 1 . . . . . . . . 4915 1 469 . 1 1 55 55 ALA HB1 H 1 1.54 0.03 . 1 . . . . . . . . 4915 1 470 . 1 1 55 55 ALA HB2 H 1 1.54 0.03 . 1 . . . . . . . . 4915 1 471 . 1 1 55 55 ALA HB3 H 1 1.54 0.03 . 1 . . . . . . . . 4915 1 472 . 1 1 55 55 ALA C C 13 180.4 0.20 . 1 . . . . . . . . 4915 1 473 . 1 1 56 56 SER N N 15 112.8 0.25 . 1 . . . . . . . . 4915 1 474 . 1 1 56 56 SER H H 1 8.44 0.03 . 1 . . . . . . . . 4915 1 475 . 1 1 56 56 SER CA C 13 61.9 0.20 . 1 . . . . . . . . 4915 1 476 . 1 1 56 56 SER HA H 1 4.29 0.03 . 1 . . . . . . . . 4915 1 477 . 1 1 56 56 SER CB C 13 60.6 0.20 . 1 . . . . . . . . 4915 1 478 . 1 1 56 56 SER HB2 H 1 3.96 0.03 . 2 . . . . . . . . 4915 1 479 . 1 1 56 56 SER HB3 H 1 3.94 0.03 . 2 . . . . . . . . 4915 1 480 . 1 1 56 56 SER C C 13 176.5 0.20 . 1 . . . . . . . . 4915 1 481 . 1 1 57 57 MET N N 15 122.1 0.25 . 1 . . . . . . . . 4915 1 482 . 1 1 57 57 MET H H 1 7.72 0.03 . 1 . . . . . . . . 4915 1 483 . 1 1 57 57 MET CA C 13 57.8 0.20 . 1 . . . . . . . . 4915 1 484 . 1 1 57 57 MET HA H 1 4.21 0.03 . 1 . . . . . . . . 4915 1 485 . 1 1 57 57 MET CB C 13 33.2 0.20 . 1 . . . . . . . . 4915 1 486 . 1 1 57 57 MET HB2 H 1 2.21 0.03 . 2 . . . . . . . . 4915 1 487 . 1 1 57 57 MET HB3 H 1 2.27 0.03 . 2 . . . . . . . . 4915 1 488 . 1 1 57 57 MET CG C 13 30.7 0.20 . 1 . . . . . . . . 4915 1 489 . 1 1 57 57 MET HG2 H 1 2.69 0.03 . 2 . . . . . . . . 4915 1 490 . 1 1 57 57 MET HG3 H 1 2.61 0.03 . 2 . . . . . . . . 4915 1 491 . 1 1 57 57 MET CE C 13 16.5 0.20 . 1 . . . . . . . . 4915 1 492 . 1 1 57 57 MET HE1 H 1 2.19 0.03 . 1 . . . . . . . . 4915 1 493 . 1 1 57 57 MET HE2 H 1 2.19 0.03 . 1 . . . . . . . . 4915 1 494 . 1 1 57 57 MET HE3 H 1 2.19 0.03 . 1 . . . . . . . . 4915 1 495 . 1 1 57 57 MET C C 13 178.5 0.20 . 1 . . . . . . . . 4915 1 496 . 1 1 58 58 LEU N N 15 118.5 0.25 . 1 . . . . . . . . 4915 1 497 . 1 1 58 58 LEU H H 1 7.83 0.03 . 1 . . . . . . . . 4915 1 498 . 1 1 58 58 LEU CA C 13 57.0 0.20 . 1 . . . . . . . . 4915 1 499 . 1 1 58 58 LEU HA H 1 4.12 0.03 . 1 . . . . . . . . 4915 1 500 . 1 1 58 58 LEU CB C 13 41.5 0.20 . 1 . . . . . . . . 4915 1 501 . 1 1 58 58 LEU HB2 H 1 1.79 0.03 . 2 . . . . . . . . 4915 1 502 . 1 1 58 58 LEU HB3 H 1 1.72 0.03 . 2 . . . . . . . . 4915 1 503 . 1 1 58 58 LEU CD1 C 13 26.1 0.20 . 2 . . . . . . . . 4915 1 504 . 1 1 58 58 LEU HD11 H 1 0.98 0.03 . 1 . . . . . . . . 4915 1 505 . 1 1 58 58 LEU HD12 H 1 0.98 0.03 . 1 . . . . . . . . 4915 1 506 . 1 1 58 58 LEU HD13 H 1 0.98 0.03 . 1 . . . . . . . . 4915 1 507 . 1 1 58 58 LEU CD2 C 13 24.3 0.20 . 2 . . . . . . . . 4915 1 508 . 1 1 58 58 LEU HD21 H 1 0.98 0.03 . 1 . . . . . . . . 4915 1 509 . 1 1 58 58 LEU HD22 H 1 0.98 0.03 . 1 . . . . . . . . 4915 1 510 . 1 1 58 58 LEU HD23 H 1 0.98 0.03 . 1 . . . . . . . . 4915 1 511 . 1 1 58 58 LEU C C 13 177.6 0.20 . 1 . . . . . . . . 4915 1 512 . 1 1 59 59 ALA N N 15 116.8 0.25 . 1 . . . . . . . . 4915 1 513 . 1 1 59 59 ALA H H 1 7.86 0.03 . 1 . . . . . . . . 4915 1 514 . 1 1 59 59 ALA CA C 13 53.5 0.20 . 1 . . . . . . . . 4915 1 515 . 1 1 59 59 ALA HA H 1 4.16 0.03 . 1 . . . . . . . . 4915 1 516 . 1 1 59 59 ALA CB C 13 18.0 0.20 . 1 . . . . . . . . 4915 1 517 . 1 1 59 59 ALA HB1 H 1 1.57 0.03 . 1 . . . . . . . . 4915 1 518 . 1 1 59 59 ALA HB2 H 1 1.57 0.03 . 1 . . . . . . . . 4915 1 519 . 1 1 59 59 ALA HB3 H 1 1.57 0.03 . 1 . . . . . . . . 4915 1 520 . 1 1 59 59 ALA C C 13 178.3 0.20 . 1 . . . . . . . . 4915 1 521 . 1 1 60 60 SER N N 15 110.3 0.25 . 1 . . . . . . . . 4915 1 522 . 1 1 60 60 SER H H 1 7.49 0.03 . 1 . . . . . . . . 4915 1 523 . 1 1 60 60 SER CA C 13 58.1 0.20 . 1 . . . . . . . . 4915 1 524 . 1 1 60 60 SER HA H 1 4.50 0.03 . 1 . . . . . . . . 4915 1 525 . 1 1 60 60 SER CB C 13 63.3 0.20 . 1 . . . . . . . . 4915 1 526 . 1 1 60 60 SER HB2 H 1 4.02 0.03 . 2 . . . . . . . . 4915 1 527 . 1 1 60 60 SER HB3 H 1 4.07 0.03 . 2 . . . . . . . . 4915 1 528 . 1 1 60 60 SER C C 13 172.9 0.20 . 1 . . . . . . . . 4915 1 529 . 1 1 61 61 ALA N N 15 126.5 0.25 . 1 . . . . . . . . 4915 1 530 . 1 1 61 61 ALA H H 1 7.72 0.03 . 1 . . . . . . . . 4915 1 531 . 1 1 61 61 ALA CA C 13 49.1 0.20 . 1 . . . . . . . . 4915 1 532 . 1 1 61 61 ALA HA H 1 4.95 0.03 . 1 . . . . . . . . 4915 1 533 . 1 1 61 61 ALA HB1 H 1 1.50 0.03 . 1 . . . . . . . . 4915 1 534 . 1 1 61 61 ALA HB2 H 1 1.50 0.03 . 1 . . . . . . . . 4915 1 535 . 1 1 61 61 ALA HB3 H 1 1.50 0.03 . 1 . . . . . . . . 4915 1 536 . 1 1 61 61 ALA C C 13 174.4 0.20 . 1 . . . . . . . . 4915 1 537 . 1 1 63 63 PRO CA C 13 65.8 0.20 . 1 . . . . . . . . 4915 1 538 . 1 1 63 63 PRO CB C 13 31.7 0.20 . 1 . . . . . . . . 4915 1 539 . 1 1 63 63 PRO CG C 13 27.3 0.20 . 1 . . . . . . . . 4915 1 540 . 1 1 63 63 PRO C C 13 178.7 0.20 . 1 . . . . . . . . 4915 1 541 . 1 1 64 64 GLN N N 15 116.3 0.25 . 1 . . . . . . . . 4915 1 542 . 1 1 64 64 GLN H H 1 9.27 0.03 . 1 . . . . . . . . 4915 1 543 . 1 1 64 64 GLN CA C 13 58.3 0.20 . 1 . . . . . . . . 4915 1 544 . 1 1 64 64 GLN HA H 1 4.27 0.03 . 1 . . . . . . . . 4915 1 545 . 1 1 64 64 GLN CB C 13 27.1 0.20 . 1 . . . . . . . . 4915 1 546 . 1 1 64 64 GLN HB2 H 1 2.21 0.03 . 2 . . . . . . . . 4915 1 547 . 1 1 64 64 GLN HB3 H 1 2.12 0.03 . 2 . . . . . . . . 4915 1 548 . 1 1 64 64 GLN CG C 13 32.8 0.20 . 1 . . . . . . . . 4915 1 549 . 1 1 64 64 GLN HG2 H 1 2.62 0.03 . 2 . . . . . . . . 4915 1 550 . 1 1 64 64 GLN HG3 H 1 2.52 0.03 . 2 . . . . . . . . 4915 1 551 . 1 1 64 64 GLN C C 13 178.1 0.20 . 1 . . . . . . . . 4915 1 552 . 1 1 65 65 GLU N N 15 120.2 0.25 . 1 . . . . . . . . 4915 1 553 . 1 1 65 65 GLU H H 1 7.68 0.03 . 1 . . . . . . . . 4915 1 554 . 1 1 65 65 GLU CA C 13 57.6 0.20 . 1 . . . . . . . . 4915 1 555 . 1 1 65 65 GLU HA H 1 4.35 0.03 . 1 . . . . . . . . 4915 1 556 . 1 1 65 65 GLU CB C 13 29.2 0.20 . 1 . . . . . . . . 4915 1 557 . 1 1 65 65 GLU HB2 H 1 2.26 0.03 . 2 . . . . . . . . 4915 1 558 . 1 1 65 65 GLU HB3 H 1 2.17 0.03 . 2 . . . . . . . . 4915 1 559 . 1 1 65 65 GLU HG2 H 1 2.42 0.03 . 1 . . . . . . . . 4915 1 560 . 1 1 65 65 GLU HG3 H 1 2.42 0.03 . 1 . . . . . . . . 4915 1 561 . 1 1 65 65 GLU C C 13 178.1 0.20 . 1 . . . . . . . . 4915 1 562 . 1 1 66 66 GLN N N 15 118.8 0.25 . 1 . . . . . . . . 4915 1 563 . 1 1 66 66 GLN H H 1 8.12 0.03 . 1 . . . . . . . . 4915 1 564 . 1 1 66 66 GLN CA C 13 59.2 0.20 . 1 . . . . . . . . 4915 1 565 . 1 1 66 66 GLN HA H 1 4.25 0.03 . 1 . . . . . . . . 4915 1 566 . 1 1 66 66 GLN CB C 13 28.1 0.20 . 1 . . . . . . . . 4915 1 567 . 1 1 66 66 GLN HB2 H 1 2.52 0.03 . 2 . . . . . . . . 4915 1 568 . 1 1 66 66 GLN HB3 H 1 2.41 0.03 . 2 . . . . . . . . 4915 1 569 . 1 1 66 66 GLN CG C 13 33.6 0.20 . 1 . . . . . . . . 4915 1 570 . 1 1 66 66 GLN HG2 H 1 2.70 0.03 . 2 . . . . . . . . 4915 1 571 . 1 1 66 66 GLN HG3 H 1 2.60 0.03 . 2 . . . . . . . . 4915 1 572 . 1 1 66 66 GLN HE21 H 1 6.78 0.03 . 2 . . . . . . . . 4915 1 573 . 1 1 66 66 GLN HE22 H 1 7.68 0.03 . 2 . . . . . . . . 4915 1 574 . 1 1 66 66 GLN C C 13 177.1 0.20 . 1 . . . . . . . . 4915 1 575 . 1 1 67 67 LYS N N 15 113.4 0.25 . 1 . . . . . . . . 4915 1 576 . 1 1 67 67 LYS H H 1 7.62 0.03 . 1 . . . . . . . . 4915 1 577 . 1 1 67 67 LYS CA C 13 57.0 0.20 . 1 . . . . . . . . 4915 1 578 . 1 1 67 67 LYS HA H 1 4.13 0.03 . 1 . . . . . . . . 4915 1 579 . 1 1 67 67 LYS CB C 13 31.2 0.20 . 1 . . . . . . . . 4915 1 580 . 1 1 67 67 LYS HB2 H 1 2.20 0.03 . 2 . . . . . . . . 4915 1 581 . 1 1 67 67 LYS HB3 H 1 1.91 0.03 . 2 . . . . . . . . 4915 1 582 . 1 1 67 67 LYS CG C 13 23.3 0.20 . 1 . . . . . . . . 4915 1 583 . 1 1 67 67 LYS HG2 H 1 1.77 0.03 . 1 . . . . . . . . 4915 1 584 . 1 1 67 67 LYS HG3 H 1 1.77 0.03 . 1 . . . . . . . . 4915 1 585 . 1 1 67 67 LYS CD C 13 27.4 0.20 . 1 . . . . . . . . 4915 1 586 . 1 1 67 67 LYS C C 13 178.3 0.20 . 1 . . . . . . . . 4915 1 587 . 1 1 68 68 GLN N N 15 118.9 0.25 . 1 . . . . . . . . 4915 1 588 . 1 1 68 68 GLN H H 1 7.71 0.03 . 1 . . . . . . . . 4915 1 589 . 1 1 68 68 GLN CA C 13 58.6 0.20 . 1 . . . . . . . . 4915 1 590 . 1 1 68 68 GLN HA H 1 4.13 0.03 . 1 . . . . . . . . 4915 1 591 . 1 1 68 68 GLN CB C 13 27.6 0.20 . 1 . . . . . . . . 4915 1 592 . 1 1 68 68 GLN HB2 H 1 2.30 0.03 . 1 . . . . . . . . 4915 1 593 . 1 1 68 68 GLN HB3 H 1 2.30 0.03 . 1 . . . . . . . . 4915 1 594 . 1 1 68 68 GLN CG C 13 32.6 0.20 . 1 . . . . . . . . 4915 1 595 . 1 1 68 68 GLN HG2 H 1 2.53 0.03 . 1 . . . . . . . . 4915 1 596 . 1 1 68 68 GLN HG3 H 1 2.53 0.03 . 1 . . . . . . . . 4915 1 597 . 1 1 68 68 GLN C C 13 178.3 0.20 . 1 . . . . . . . . 4915 1 598 . 1 1 69 69 MET N N 15 118.6 0.25 . 1 . . . . . . . . 4915 1 599 . 1 1 69 69 MET H H 1 8.48 0.03 . 1 . . . . . . . . 4915 1 600 . 1 1 69 69 MET CA C 13 58.7 0.20 . 1 . . . . . . . . 4915 1 601 . 1 1 69 69 MET HA H 1 4.16 0.03 . 1 . . . . . . . . 4915 1 602 . 1 1 69 69 MET CB C 13 33.3 0.20 . 1 . . . . . . . . 4915 1 603 . 1 1 69 69 MET HB2 H 1 2.31 0.03 . 2 . . . . . . . . 4915 1 604 . 1 1 69 69 MET HB3 H 1 2.13 0.03 . 2 . . . . . . . . 4915 1 605 . 1 1 69 69 MET CG C 13 31.6 0.20 . 1 . . . . . . . . 4915 1 606 . 1 1 69 69 MET HG2 H 1 2.86 0.03 . 2 . . . . . . . . 4915 1 607 . 1 1 69 69 MET HG3 H 1 2.69 0.03 . 2 . . . . . . . . 4915 1 608 . 1 1 69 69 MET CE C 13 16.5 0.20 . 1 . . . . . . . . 4915 1 609 . 1 1 69 69 MET HE1 H 1 2.08 0.03 . 1 . . . . . . . . 4915 1 610 . 1 1 69 69 MET HE2 H 1 2.08 0.03 . 1 . . . . . . . . 4915 1 611 . 1 1 69 69 MET HE3 H 1 2.08 0.03 . 1 . . . . . . . . 4915 1 612 . 1 1 69 69 MET C C 13 179.2 0.20 . 1 . . . . . . . . 4915 1 613 . 1 1 70 70 LEU N N 15 118.8 0.25 . 1 . . . . . . . . 4915 1 614 . 1 1 70 70 LEU H H 1 7.94 0.03 . 1 . . . . . . . . 4915 1 615 . 1 1 70 70 LEU CA C 13 57.6 0.20 . 1 . . . . . . . . 4915 1 616 . 1 1 70 70 LEU HA H 1 4.01 0.03 . 1 . . . . . . . . 4915 1 617 . 1 1 70 70 LEU CB C 13 41.5 0.20 . 1 . . . . . . . . 4915 1 618 . 1 1 70 70 LEU HB2 H 1 2.05 0.03 . 2 . . . . . . . . 4915 1 619 . 1 1 70 70 LEU HB3 H 1 1.23 0.03 . 2 . . . . . . . . 4915 1 620 . 1 1 70 70 LEU HG H 1 1.79 0.03 . 1 . . . . . . . . 4915 1 621 . 1 1 70 70 LEU CD1 C 13 25.3 0.20 . 2 . . . . . . . . 4915 1 622 . 1 1 70 70 LEU HD11 H 1 1.01 0.03 . 2 . . . . . . . . 4915 1 623 . 1 1 70 70 LEU HD12 H 1 1.01 0.03 . 2 . . . . . . . . 4915 1 624 . 1 1 70 70 LEU HD13 H 1 1.01 0.03 . 2 . . . . . . . . 4915 1 625 . 1 1 70 70 LEU CD2 C 13 23.3 0.20 . 2 . . . . . . . . 4915 1 626 . 1 1 70 70 LEU HD21 H 1 0.91 0.03 . 2 . . . . . . . . 4915 1 627 . 1 1 70 70 LEU HD22 H 1 0.91 0.03 . 2 . . . . . . . . 4915 1 628 . 1 1 70 70 LEU HD23 H 1 0.91 0.03 . 2 . . . . . . . . 4915 1 629 . 1 1 70 70 LEU C C 13 179.0 0.20 . 1 . . . . . . . . 4915 1 630 . 1 1 71 71 GLY N N 15 108.4 0.25 . 1 . . . . . . . . 4915 1 631 . 1 1 71 71 GLY H H 1 9.11 0.03 . 1 . . . . . . . . 4915 1 632 . 1 1 71 71 GLY CA C 13 47.8 0.20 . 1 . . . . . . . . 4915 1 633 . 1 1 71 71 GLY HA2 H 1 4.14 0.03 . 2 . . . . . . . . 4915 1 634 . 1 1 71 71 GLY HA3 H 1 3.67 0.03 . 2 . . . . . . . . 4915 1 635 . 1 1 71 71 GLY C C 13 175.0 0.20 . 1 . . . . . . . . 4915 1 636 . 1 1 72 72 GLU N N 15 118.9 0.25 . 1 . . . . . . . . 4915 1 637 . 1 1 72 72 GLU H H 1 8.25 0.03 . 1 . . . . . . . . 4915 1 638 . 1 1 72 72 GLU CA C 13 58.1 0.20 . 1 . . . . . . . . 4915 1 639 . 1 1 72 72 GLU HA H 1 4.24 0.03 . 1 . . . . . . . . 4915 1 640 . 1 1 72 72 GLU CB C 13 29.1 0.20 . 1 . . . . . . . . 4915 1 641 . 1 1 72 72 GLU HB2 H 1 2.23 0.03 . 1 . . . . . . . . 4915 1 642 . 1 1 72 72 GLU HB3 H 1 2.23 0.03 . 1 . . . . . . . . 4915 1 643 . 1 1 72 72 GLU CG C 13 35.6 0.20 . 1 . . . . . . . . 4915 1 644 . 1 1 72 72 GLU HG2 H 1 2.58 0.03 . 2 . . . . . . . . 4915 1 645 . 1 1 72 72 GLU HG3 H 1 2.52 0.03 . 2 . . . . . . . . 4915 1 646 . 1 1 72 72 GLU C C 13 178.1 0.20 . 1 . . . . . . . . 4915 1 647 . 1 1 73 73 ARG N N 15 115.3 0.25 . 1 . . . . . . . . 4915 1 648 . 1 1 73 73 ARG H H 1 7.25 0.03 . 1 . . . . . . . . 4915 1 649 . 1 1 73 73 ARG CA C 13 56.0 0.20 . 1 . . . . . . . . 4915 1 650 . 1 1 73 73 ARG HA H 1 4.47 0.03 . 1 . . . . . . . . 4915 1 651 . 1 1 73 73 ARG CB C 13 30.3 0.20 . 1 . . . . . . . . 4915 1 652 . 1 1 73 73 ARG HB2 H 1 2.07 0.03 . 2 . . . . . . . . 4915 1 653 . 1 1 73 73 ARG HB3 H 1 1.97 0.03 . 2 . . . . . . . . 4915 1 654 . 1 1 73 73 ARG CG C 13 27.3 0.20 . 1 . . . . . . . . 4915 1 655 . 1 1 73 73 ARG HG2 H 1 1.89 0.03 . 2 . . . . . . . . 4915 1 656 . 1 1 73 73 ARG CD C 13 41.9 0.20 . 1 . . . . . . . . 4915 1 657 . 1 1 73 73 ARG HD2 H 1 3.24 0.03 . 2 . . . . . . . . 4915 1 658 . 1 1 73 73 ARG HD3 H 1 3.30 0.03 . 2 . . . . . . . . 4915 1 659 . 1 1 73 73 ARG C C 13 177.6 0.20 . 1 . . . . . . . . 4915 1 660 . 1 1 74 74 LEU N N 15 118.8 0.25 . 1 . . . . . . . . 4915 1 661 . 1 1 74 74 LEU H H 1 8.59 0.03 . 1 . . . . . . . . 4915 1 662 . 1 1 74 74 LEU CA C 13 57.0 0.20 . 1 . . . . . . . . 4915 1 663 . 1 1 74 74 LEU HA H 1 4.16 0.03 . 1 . . . . . . . . 4915 1 664 . 1 1 74 74 LEU CB C 13 43.5 0.20 . 1 . . . . . . . . 4915 1 665 . 1 1 74 74 LEU HB2 H 1 1.91 0.03 . 2 . . . . . . . . 4915 1 666 . 1 1 74 74 LEU HB3 H 1 1.57 0.03 . 2 . . . . . . . . 4915 1 667 . 1 1 74 74 LEU HG H 1 1.82 0.03 . 1 . . . . . . . . 4915 1 668 . 1 1 74 74 LEU CD1 C 13 26.0 0.20 . 2 . . . . . . . . 4915 1 669 . 1 1 74 74 LEU HD11 H 1 0.91 0.03 . 1 . . . . . . . . 4915 1 670 . 1 1 74 74 LEU HD12 H 1 0.91 0.03 . 1 . . . . . . . . 4915 1 671 . 1 1 74 74 LEU HD13 H 1 0.91 0.03 . 1 . . . . . . . . 4915 1 672 . 1 1 74 74 LEU CD2 C 13 23.4 0.20 . 2 . . . . . . . . 4915 1 673 . 1 1 74 74 LEU HD21 H 1 0.91 0.03 . 1 . . . . . . . . 4915 1 674 . 1 1 74 74 LEU HD22 H 1 0.91 0.03 . 1 . . . . . . . . 4915 1 675 . 1 1 74 74 LEU HD23 H 1 0.91 0.03 . 1 . . . . . . . . 4915 1 676 . 1 1 74 74 LEU C C 13 177.8 0.20 . 1 . . . . . . . . 4915 1 677 . 1 1 75 75 PHE N N 15 117.2 0.25 . 1 . . . . . . . . 4915 1 678 . 1 1 75 75 PHE H H 1 8.54 0.03 . 1 . . . . . . . . 4915 1 679 . 1 1 75 75 PHE CA C 13 63.2 0.20 . 1 . . . . . . . . 4915 1 680 . 1 1 75 75 PHE HA H 1 4.41 0.03 . 1 . . . . . . . . 4915 1 681 . 1 1 75 75 PHE HB2 H 1 3.36 0.03 . 2 . . . . . . . . 4915 1 682 . 1 1 75 75 PHE HB3 H 1 3.24 0.03 . 2 . . . . . . . . 4915 1 683 . 1 1 75 75 PHE HD1 H 1 7.20 0.03 . 3 . . . . . . . . 4915 1 684 . 1 1 75 75 PHE HE1 H 1 7.35 0.03 . 3 . . . . . . . . 4915 1 685 . 1 1 75 75 PHE C C 13 173.1 0.20 . 1 . . . . . . . . 4915 1 686 . 1 1 76 76 PRO CA C 13 65.3 0.20 . 1 . . . . . . . . 4915 1 687 . 1 1 76 76 PRO HA H 1 4.27 0.03 . 1 . . . . . . . . 4915 1 688 . 1 1 76 76 PRO CB C 13 30.2 0.20 . 1 . . . . . . . . 4915 1 689 . 1 1 76 76 PRO CG C 13 27.3 0.20 . 1 . . . . . . . . 4915 1 690 . 1 1 76 76 PRO C C 13 179.1 0.20 . 1 . . . . . . . . 4915 1 691 . 1 1 77 77 LEU N N 15 116.3 0.25 . 1 . . . . . . . . 4915 1 692 . 1 1 77 77 LEU H H 1 6.91 0.03 . 1 . . . . . . . . 4915 1 693 . 1 1 77 77 LEU CA C 13 56.5 0.20 . 1 . . . . . . . . 4915 1 694 . 1 1 77 77 LEU HA H 1 4.16 0.03 . 1 . . . . . . . . 4915 1 695 . 1 1 77 77 LEU CB C 13 41.0 0.20 . 1 . . . . . . . . 4915 1 696 . 1 1 77 77 LEU HB2 H 1 2.13 0.03 . 2 . . . . . . . . 4915 1 697 . 1 1 77 77 LEU HB3 H 1 1.51 0.03 . 2 . . . . . . . . 4915 1 698 . 1 1 77 77 LEU HG H 1 1.29 0.03 . 1 . . . . . . . . 4915 1 699 . 1 1 77 77 LEU CD1 C 13 25.3 0.20 . 2 . . . . . . . . 4915 1 700 . 1 1 77 77 LEU HD11 H 1 1.05 0.03 . 2 . . . . . . . . 4915 1 701 . 1 1 77 77 LEU HD12 H 1 1.05 0.03 . 2 . . . . . . . . 4915 1 702 . 1 1 77 77 LEU HD13 H 1 1.05 0.03 . 2 . . . . . . . . 4915 1 703 . 1 1 77 77 LEU CD2 C 13 21.1 0.20 . 2 . . . . . . . . 4915 1 704 . 1 1 77 77 LEU HD21 H 1 0.96 0.03 . 2 . . . . . . . . 4915 1 705 . 1 1 77 77 LEU HD22 H 1 0.96 0.03 . 2 . . . . . . . . 4915 1 706 . 1 1 77 77 LEU HD23 H 1 0.96 0.03 . 2 . . . . . . . . 4915 1 707 . 1 1 77 77 LEU C C 13 179.2 0.20 . 1 . . . . . . . . 4915 1 708 . 1 1 78 78 ILE N N 15 119.5 0.25 . 1 . . . . . . . . 4915 1 709 . 1 1 78 78 ILE H H 1 7.96 0.03 . 1 . . . . . . . . 4915 1 710 . 1 1 78 78 ILE CA C 13 63.8 0.20 . 1 . . . . . . . . 4915 1 711 . 1 1 78 78 ILE HA H 1 3.74 0.03 . 1 . . . . . . . . 4915 1 712 . 1 1 78 78 ILE CB C 13 36.8 0.20 . 1 . . . . . . . . 4915 1 713 . 1 1 78 78 ILE HB H 1 1.82 0.03 . 1 . . . . . . . . 4915 1 714 . 1 1 78 78 ILE CG2 C 13 18.1 0.20 . 2 . . . . . . . . 4915 1 715 . 1 1 78 78 ILE HG21 H 1 0.98 0.03 . 1 . . . . . . . . 4915 1 716 . 1 1 78 78 ILE HG22 H 1 0.98 0.03 . 1 . . . . . . . . 4915 1 717 . 1 1 78 78 ILE HG23 H 1 0.98 0.03 . 1 . . . . . . . . 4915 1 718 . 1 1 78 78 ILE CG1 C 13 28.4 0.20 . 2 . . . . . . . . 4915 1 719 . 1 1 78 78 ILE HG12 H 1 1.85 0.03 . 2 . . . . . . . . 4915 1 720 . 1 1 78 78 ILE HG13 H 1 1.28 0.03 . 2 . . . . . . . . 4915 1 721 . 1 1 78 78 ILE CD1 C 13 13.9 0.20 . 1 . . . . . . . . 4915 1 722 . 1 1 78 78 ILE HD11 H 1 0.91 0.03 . 1 . . . . . . . . 4915 1 723 . 1 1 78 78 ILE HD12 H 1 0.91 0.03 . 1 . . . . . . . . 4915 1 724 . 1 1 78 78 ILE HD13 H 1 0.91 0.03 . 1 . . . . . . . . 4915 1 725 . 1 1 78 78 ILE C C 13 178.1 0.20 . 1 . . . . . . . . 4915 1 726 . 1 1 79 79 GLN N N 15 122.3 0.25 . 1 . . . . . . . . 4915 1 727 . 1 1 79 79 GLN H H 1 9.01 0.03 . 1 . . . . . . . . 4915 1 728 . 1 1 79 79 GLN CA C 13 58.3 0.20 . 1 . . . . . . . . 4915 1 729 . 1 1 79 79 GLN HA H 1 3.58 0.03 . 1 . . . . . . . . 4915 1 730 . 1 1 79 79 GLN CB C 13 27.7 0.20 . 1 . . . . . . . . 4915 1 731 . 1 1 79 79 GLN HB2 H 1 1.84 0.03 . 1 . . . . . . . . 4915 1 732 . 1 1 79 79 GLN HB3 H 1 1.84 0.03 . 1 . . . . . . . . 4915 1 733 . 1 1 79 79 GLN CG C 13 33.5 0.20 . 1 . . . . . . . . 4915 1 734 . 1 1 79 79 GLN HG2 H 1 2.16 0.03 . 1 . . . . . . . . 4915 1 735 . 1 1 79 79 GLN HG3 H 1 2.16 0.03 . 1 . . . . . . . . 4915 1 736 . 1 1 79 79 GLN C C 13 175.6 0.20 . 1 . . . . . . . . 4915 1 737 . 1 1 80 80 ALA N N 15 115.7 0.25 . 1 . . . . . . . . 4915 1 738 . 1 1 80 80 ALA H H 1 6.88 0.03 . 1 . . . . . . . . 4915 1 739 . 1 1 80 80 ALA CA C 13 53.1 0.20 . 1 . . . . . . . . 4915 1 740 . 1 1 80 80 ALA HA H 1 4.16 0.03 . 1 . . . . . . . . 4915 1 741 . 1 1 80 80 ALA CB C 13 17.8 0.20 . 1 . . . . . . . . 4915 1 742 . 1 1 80 80 ALA HB1 H 1 1.51 0.03 . 1 . . . . . . . . 4915 1 743 . 1 1 80 80 ALA HB2 H 1 1.51 0.03 . 1 . . . . . . . . 4915 1 744 . 1 1 80 80 ALA HB3 H 1 1.51 0.03 . 1 . . . . . . . . 4915 1 745 . 1 1 80 80 ALA C C 13 178.1 0.20 . 1 . . . . . . . . 4915 1 746 . 1 1 81 81 MET N N 15 114.6 0.25 . 1 . . . . . . . . 4915 1 747 . 1 1 81 81 MET H H 1 7.29 0.03 . 1 . . . . . . . . 4915 1 748 . 1 1 81 81 MET CA C 13 57.0 0.20 . 1 . . . . . . . . 4915 1 749 . 1 1 81 81 MET HA H 1 4.27 0.03 . 1 . . . . . . . . 4915 1 750 . 1 1 81 81 MET CB C 13 35.1 0.20 . 1 . . . . . . . . 4915 1 751 . 1 1 81 81 MET HB2 H 1 2.18 0.03 . 2 . . . . . . . . 4915 1 752 . 1 1 81 81 MET HB3 H 1 1.96 0.03 . 2 . . . . . . . . 4915 1 753 . 1 1 81 81 MET CG C 13 31.5 0.20 . 1 . . . . . . . . 4915 1 754 . 1 1 81 81 MET HG2 H 1 2.72 0.03 . 2 . . . . . . . . 4915 1 755 . 1 1 81 81 MET HG3 H 1 2.58 0.03 . 2 . . . . . . . . 4915 1 756 . 1 1 81 81 MET CE C 13 17.2 0.20 . 1 . . . . . . . . 4915 1 757 . 1 1 81 81 MET HE1 H 1 2.12 0.03 . 1 . . . . . . . . 4915 1 758 . 1 1 81 81 MET HE2 H 1 2.12 0.03 . 1 . . . . . . . . 4915 1 759 . 1 1 81 81 MET HE3 H 1 2.12 0.03 . 1 . . . . . . . . 4915 1 760 . 1 1 81 81 MET C C 13 175.9 0.20 . 1 . . . . . . . . 4915 1 761 . 1 1 82 82 HIS N N 15 115.8 0.25 . 1 . . . . . . . . 4915 1 762 . 1 1 82 82 HIS H H 1 8.18 0.03 . 1 . . . . . . . . 4915 1 763 . 1 1 82 82 HIS CA C 13 53.7 0.20 . 1 . . . . . . . . 4915 1 764 . 1 1 82 82 HIS HA H 1 4.96 0.03 . 1 . . . . . . . . 4915 1 765 . 1 1 82 82 HIS HB2 H 1 3.04 0.03 . 2 . . . . . . . . 4915 1 766 . 1 1 82 82 HIS HB3 H 1 2.58 0.03 . 2 . . . . . . . . 4915 1 767 . 1 1 82 82 HIS HD2 H 1 6.72 0.03 . 1 . . . . . . . . 4915 1 768 . 1 1 82 82 HIS HE1 H 1 8.03 0.03 . 1 . . . . . . . . 4915 1 769 . 1 1 82 82 HIS C C 13 177.2 0.20 . 1 . . . . . . . . 4915 1 770 . 1 1 83 83 PRO CA C 13 65.3 0.20 . 1 . . . . . . . . 4915 1 771 . 1 1 83 83 PRO CB C 13 31.3 0.20 . 1 . . . . . . . . 4915 1 772 . 1 1 83 83 PRO CG C 13 26.3 0.20 . 1 . . . . . . . . 4915 1 773 . 1 1 83 83 PRO C C 13 179.2 0.20 . 1 . . . . . . . . 4915 1 774 . 1 1 84 84 THR N N 15 108.4 0.25 . 1 . . . . . . . . 4915 1 775 . 1 1 84 84 THR H H 1 8.35 0.03 . 1 . . . . . . . . 4915 1 776 . 1 1 84 84 THR CA C 13 63.4 0.20 . 1 . . . . . . . . 4915 1 777 . 1 1 84 84 THR HA H 1 4.48 0.03 . 1 . . . . . . . . 4915 1 778 . 1 1 84 84 THR CB C 13 68.4 0.20 . 1 . . . . . . . . 4915 1 779 . 1 1 84 84 THR CG2 C 13 21.3 0.20 . 1 . . . . . . . . 4915 1 780 . 1 1 84 84 THR HG21 H 1 1.39 0.03 . 1 . . . . . . . . 4915 1 781 . 1 1 84 84 THR HG22 H 1 1.39 0.03 . 1 . . . . . . . . 4915 1 782 . 1 1 84 84 THR HG23 H 1 1.39 0.03 . 1 . . . . . . . . 4915 1 783 . 1 1 84 84 THR C C 13 175.8 0.20 . 1 . . . . . . . . 4915 1 784 . 1 1 85 85 LEU N N 15 119.6 0.25 . 1 . . . . . . . . 4915 1 785 . 1 1 85 85 LEU H H 1 7.76 0.03 . 1 . . . . . . . . 4915 1 786 . 1 1 85 85 LEU CA C 13 53.5 0.20 . 1 . . . . . . . . 4915 1 787 . 1 1 85 85 LEU HA H 1 4.15 0.03 . 1 . . . . . . . . 4915 1 788 . 1 1 85 85 LEU CB C 13 43.0 0.20 . 1 . . . . . . . . 4915 1 789 . 1 1 85 85 LEU HB2 H 1 2.27 0.03 . 2 . . . . . . . . 4915 1 790 . 1 1 85 85 LEU HB3 H 1 1.69 0.03 . 2 . . . . . . . . 4915 1 791 . 1 1 85 85 LEU CD1 C 13 25.2 0.20 . 2 . . . . . . . . 4915 1 792 . 1 1 85 85 LEU HD11 H 1 0.95 0.03 . 2 . . . . . . . . 4915 1 793 . 1 1 85 85 LEU HD12 H 1 0.95 0.03 . 2 . . . . . . . . 4915 1 794 . 1 1 85 85 LEU HD13 H 1 0.95 0.03 . 2 . . . . . . . . 4915 1 795 . 1 1 85 85 LEU CD2 C 13 22.2 0.20 . 2 . . . . . . . . 4915 1 796 . 1 1 85 85 LEU C C 13 176.9 0.20 . 1 . . . . . . . . 4915 1 797 . 1 1 86 86 ALA N N 15 121.2 0.25 . 1 . . . . . . . . 4915 1 798 . 1 1 86 86 ALA H H 1 7.51 0.03 . 1 . . . . . . . . 4915 1 799 . 1 1 86 86 ALA CA C 13 56.0 0.20 . 1 . . . . . . . . 4915 1 800 . 1 1 86 86 ALA HA H 1 3.91 0.03 . 1 . . . . . . . . 4915 1 801 . 1 1 86 86 ALA CB C 13 17.8 0.20 . 1 . . . . . . . . 4915 1 802 . 1 1 86 86 ALA HB1 H 1 1.29 0.03 . 1 . . . . . . . . 4915 1 803 . 1 1 86 86 ALA HB2 H 1 1.29 0.03 . 1 . . . . . . . . 4915 1 804 . 1 1 86 86 ALA HB3 H 1 1.29 0.03 . 1 . . . . . . . . 4915 1 805 . 1 1 86 86 ALA C C 13 179.7 0.20 . 1 . . . . . . . . 4915 1 806 . 1 1 87 87 GLY N N 15 109.5 0.25 . 1 . . . . . . . . 4915 1 807 . 1 1 87 87 GLY H H 1 9.34 0.03 . 1 . . . . . . . . 4915 1 808 . 1 1 87 87 GLY CA C 13 47.2 0.20 . 1 . . . . . . . . 4915 1 809 . 1 1 87 87 GLY C C 13 175.8 0.20 . 1 . . . . . . . . 4915 1 810 . 1 1 88 88 LYS N N 15 123.7 0.25 . 1 . . . . . . . . 4915 1 811 . 1 1 88 88 LYS H H 1 7.99 0.03 . 1 . . . . . . . . 4915 1 812 . 1 1 88 88 LYS CA C 13 58.1 0.20 . 1 . . . . . . . . 4915 1 813 . 1 1 88 88 LYS HA H 1 4.27 0.03 . 1 . . . . . . . . 4915 1 814 . 1 1 88 88 LYS CB C 13 32.4 0.20 . 1 . . . . . . . . 4915 1 815 . 1 1 88 88 LYS HB2 H 1 1.96 0.03 . 2 . . . . . . . . 4915 1 816 . 1 1 88 88 LYS HB3 H 1 1.67 0.03 . 2 . . . . . . . . 4915 1 817 . 1 1 88 88 LYS CG C 13 24.4 0.20 . 1 . . . . . . . . 4915 1 818 . 1 1 88 88 LYS HG2 H 1 1.80 0.03 . 1 . . . . . . . . 4915 1 819 . 1 1 88 88 LYS HG3 H 1 1.80 0.03 . 1 . . . . . . . . 4915 1 820 . 1 1 88 88 LYS CD C 13 28.5 0.20 . 1 . . . . . . . . 4915 1 821 . 1 1 88 88 LYS HE2 H 1 2.99 0.03 . 2 . . . . . . . . 4915 1 822 . 1 1 88 88 LYS HE3 H 1 3.06 0.03 . 2 . . . . . . . . 4915 1 823 . 1 1 88 88 LYS C C 13 179.4 0.20 . 1 . . . . . . . . 4915 1 824 . 1 1 89 89 ILE N N 15 118.4 0.25 . 1 . . . . . . . . 4915 1 825 . 1 1 89 89 ILE H H 1 8.74 0.03 . 1 . . . . . . . . 4915 1 826 . 1 1 89 89 ILE CA C 13 64.5 0.20 . 1 . . . . . . . . 4915 1 827 . 1 1 89 89 ILE HA H 1 3.75 0.03 . 1 . . . . . . . . 4915 1 828 . 1 1 89 89 ILE CB C 13 38.1 0.20 . 1 . . . . . . . . 4915 1 829 . 1 1 89 89 ILE HB H 1 1.76 0.03 . 1 . . . . . . . . 4915 1 830 . 1 1 89 89 ILE CG2 C 13 18.1 0.20 . 2 . . . . . . . . 4915 1 831 . 1 1 89 89 ILE HG21 H 1 1.02 0.03 . 1 . . . . . . . . 4915 1 832 . 1 1 89 89 ILE HG22 H 1 1.02 0.03 . 1 . . . . . . . . 4915 1 833 . 1 1 89 89 ILE HG23 H 1 1.02 0.03 . 1 . . . . . . . . 4915 1 834 . 1 1 89 89 ILE CG1 C 13 28.4 0.20 . 2 . . . . . . . . 4915 1 835 . 1 1 89 89 ILE HG12 H 1 1.67 0.03 . 2 . . . . . . . . 4915 1 836 . 1 1 89 89 ILE HG13 H 1 1.18 0.03 . 2 . . . . . . . . 4915 1 837 . 1 1 89 89 ILE CD1 C 13 14.9 0.20 . 1 . . . . . . . . 4915 1 838 . 1 1 89 89 ILE HD11 H 1 0.66 0.03 . 1 . . . . . . . . 4915 1 839 . 1 1 89 89 ILE HD12 H 1 0.66 0.03 . 1 . . . . . . . . 4915 1 840 . 1 1 89 89 ILE HD13 H 1 0.66 0.03 . 1 . . . . . . . . 4915 1 841 . 1 1 89 89 ILE C C 13 177.4 0.20 . 1 . . . . . . . . 4915 1 842 . 1 1 90 90 THR N N 15 116.3 0.25 . 1 . . . . . . . . 4915 1 843 . 1 1 90 90 THR H H 1 8.51 0.03 . 1 . . . . . . . . 4915 1 844 . 1 1 90 90 THR CA C 13 67.6 0.20 . 1 . . . . . . . . 4915 1 845 . 1 1 90 90 THR HA H 1 4.46 0.03 . 1 . . . . . . . . 4915 1 846 . 1 1 90 90 THR CB C 13 68.3 0.20 . 1 . . . . . . . . 4915 1 847 . 1 1 90 90 THR HB H 1 3.67 0.03 . 1 . . . . . . . . 4915 1 848 . 1 1 90 90 THR CG2 C 13 21.2 0.20 . 1 . . . . . . . . 4915 1 849 . 1 1 90 90 THR HG21 H 1 1.30 0.03 . 1 . . . . . . . . 4915 1 850 . 1 1 90 90 THR HG22 H 1 1.30 0.03 . 1 . . . . . . . . 4915 1 851 . 1 1 90 90 THR HG23 H 1 1.30 0.03 . 1 . . . . . . . . 4915 1 852 . 1 1 90 90 THR C C 13 175.3 0.20 . 1 . . . . . . . . 4915 1 853 . 1 1 91 91 GLY N N 15 104.3 0.25 . 1 . . . . . . . . 4915 1 854 . 1 1 91 91 GLY H H 1 7.74 0.03 . 1 . . . . . . . . 4915 1 855 . 1 1 91 91 GLY CA C 13 46.9 0.20 . 1 . . . . . . . . 4915 1 856 . 1 1 91 91 GLY HA2 H 1 4.03 0.03 . 2 . . . . . . . . 4915 1 857 . 1 1 91 91 GLY HA3 H 1 3.82 0.03 . 2 . . . . . . . . 4915 1 858 . 1 1 91 91 GLY C C 13 175.8 0.20 . 1 . . . . . . . . 4915 1 859 . 1 1 92 92 MET N N 15 119.3 0.25 . 1 . . . . . . . . 4915 1 860 . 1 1 92 92 MET H H 1 7.67 0.03 . 1 . . . . . . . . 4915 1 861 . 1 1 92 92 MET CA C 13 58.4 0.20 . 1 . . . . . . . . 4915 1 862 . 1 1 92 92 MET HA H 1 4.24 0.03 . 1 . . . . . . . . 4915 1 863 . 1 1 92 92 MET CB C 13 33.3 0.20 . 1 . . . . . . . . 4915 1 864 . 1 1 92 92 MET HB2 H 1 2.32 0.03 . 1 . . . . . . . . 4915 1 865 . 1 1 92 92 MET HB3 H 1 2.32 0.03 . 1 . . . . . . . . 4915 1 866 . 1 1 92 92 MET CG C 13 30.5 0.20 . 1 . . . . . . . . 4915 1 867 . 1 1 92 92 MET HG2 H 1 2.79 0.03 . 2 . . . . . . . . 4915 1 868 . 1 1 92 92 MET HG3 H 1 2.64 0.03 . 2 . . . . . . . . 4915 1 869 . 1 1 92 92 MET CE C 13 16.0 0.20 . 1 . . . . . . . . 4915 1 870 . 1 1 92 92 MET HE1 H 1 2.20 0.03 . 1 . . . . . . . . 4915 1 871 . 1 1 92 92 MET HE2 H 1 2.20 0.03 . 1 . . . . . . . . 4915 1 872 . 1 1 92 92 MET HE3 H 1 2.20 0.03 . 1 . . . . . . . . 4915 1 873 . 1 1 92 92 MET C C 13 179.2 0.20 . 1 . . . . . . . . 4915 1 874 . 1 1 93 93 LEU N N 15 120.4 0.25 . 1 . . . . . . . . 4915 1 875 . 1 1 93 93 LEU H H 1 8.45 0.03 . 1 . . . . . . . . 4915 1 876 . 1 1 93 93 LEU CA C 13 56.8 0.20 . 1 . . . . . . . . 4915 1 877 . 1 1 93 93 LEU HA H 1 4.23 0.03 . 1 . . . . . . . . 4915 1 878 . 1 1 93 93 LEU CB C 13 40.1 0.20 . 1 . . . . . . . . 4915 1 879 . 1 1 93 93 LEU HB2 H 1 2.05 0.03 . 2 . . . . . . . . 4915 1 880 . 1 1 93 93 LEU HB3 H 1 1.88 0.03 . 2 . . . . . . . . 4915 1 881 . 1 1 93 93 LEU CG C 13 27.4 0.20 . 1 . . . . . . . . 4915 1 882 . 1 1 93 93 LEU HG H 1 1.47 0.03 . 1 . . . . . . . . 4915 1 883 . 1 1 93 93 LEU CD1 C 13 25.3 0.20 . 2 . . . . . . . . 4915 1 884 . 1 1 93 93 LEU HD11 H 1 0.92 0.03 . 2 . . . . . . . . 4915 1 885 . 1 1 93 93 LEU HD12 H 1 0.92 0.03 . 2 . . . . . . . . 4915 1 886 . 1 1 93 93 LEU HD13 H 1 0.92 0.03 . 2 . . . . . . . . 4915 1 887 . 1 1 93 93 LEU CD2 C 13 23.3 0.20 . 2 . . . . . . . . 4915 1 888 . 1 1 93 93 LEU HD21 H 1 0.84 0.03 . 2 . . . . . . . . 4915 1 889 . 1 1 93 93 LEU HD22 H 1 0.84 0.03 . 2 . . . . . . . . 4915 1 890 . 1 1 93 93 LEU HD23 H 1 0.84 0.03 . 2 . . . . . . . . 4915 1 891 . 1 1 93 93 LEU C C 13 177.6 0.20 . 1 . . . . . . . . 4915 1 892 . 1 1 94 94 LEU N N 15 114.9 0.25 . 1 . . . . . . . . 4915 1 893 . 1 1 94 94 LEU H H 1 7.93 0.03 . 1 . . . . . . . . 4915 1 894 . 1 1 94 94 LEU CA C 13 56.1 0.20 . 1 . . . . . . . . 4915 1 895 . 1 1 94 94 LEU HA H 1 4.23 0.03 . 1 . . . . . . . . 4915 1 896 . 1 1 94 94 LEU CB C 13 41.0 0.20 . 1 . . . . . . . . 4915 1 897 . 1 1 94 94 LEU HB2 H 1 1.99 0.03 . 2 . . . . . . . . 4915 1 898 . 1 1 94 94 LEU HB3 H 1 1.66 0.03 . 2 . . . . . . . . 4915 1 899 . 1 1 94 94 LEU HG H 1 1.88 0.03 . 1 . . . . . . . . 4915 1 900 . 1 1 94 94 LEU CD1 C 13 25.2 0.20 . 2 . . . . . . . . 4915 1 901 . 1 1 94 94 LEU HD11 H 1 0.99 0.03 . 1 . . . . . . . . 4915 1 902 . 1 1 94 94 LEU HD12 H 1 0.99 0.03 . 1 . . . . . . . . 4915 1 903 . 1 1 94 94 LEU HD13 H 1 0.99 0.03 . 1 . . . . . . . . 4915 1 904 . 1 1 94 94 LEU CD2 C 13 22.3 0.20 . 2 . . . . . . . . 4915 1 905 . 1 1 94 94 LEU HD21 H 1 0.99 0.03 . 1 . . . . . . . . 4915 1 906 . 1 1 94 94 LEU HD22 H 1 0.99 0.03 . 1 . . . . . . . . 4915 1 907 . 1 1 94 94 LEU HD23 H 1 0.99 0.03 . 1 . . . . . . . . 4915 1 908 . 1 1 94 94 LEU C C 13 177.2 0.20 . 1 . . . . . . . . 4915 1 909 . 1 1 95 95 GLU N N 15 116.3 0.25 . 1 . . . . . . . . 4915 1 910 . 1 1 95 95 GLU H H 1 7.25 0.03 . 1 . . . . . . . . 4915 1 911 . 1 1 95 95 GLU CA C 13 56.8 0.20 . 1 . . . . . . . . 4915 1 912 . 1 1 95 95 GLU HA H 1 4.28 0.03 . 1 . . . . . . . . 4915 1 913 . 1 1 95 95 GLU CB C 13 29.6 0.20 . 1 . . . . . . . . 4915 1 914 . 1 1 95 95 GLU HB2 H 1 2.07 0.03 . 1 . . . . . . . . 4915 1 915 . 1 1 95 95 GLU HB3 H 1 2.07 0.03 . 1 . . . . . . . . 4915 1 916 . 1 1 95 95 GLU CG C 13 35.6 0.20 . 1 . . . . . . . . 4915 1 917 . 1 1 95 95 GLU HG2 H 1 2.60 0.03 . 2 . . . . . . . . 4915 1 918 . 1 1 95 95 GLU HG3 H 1 2.38 0.03 . 2 . . . . . . . . 4915 1 919 . 1 1 95 95 GLU C C 13 177.3 0.20 . 1 . . . . . . . . 4915 1 920 . 1 1 96 96 ILE N N 15 121.3 0.25 . 1 . . . . . . . . 4915 1 921 . 1 1 96 96 ILE H H 1 7.89 0.03 . 1 . . . . . . . . 4915 1 922 . 1 1 96 96 ILE CA C 13 61.2 0.20 . 1 . . . . . . . . 4915 1 923 . 1 1 96 96 ILE HA H 1 4.05 0.03 . 1 . . . . . . . . 4915 1 924 . 1 1 96 96 ILE CB C 13 36.9 0.20 . 1 . . . . . . . . 4915 1 925 . 1 1 96 96 ILE HB H 1 2.22 0.03 . 1 . . . . . . . . 4915 1 926 . 1 1 96 96 ILE CG2 C 13 16.1 0.20 . 2 . . . . . . . . 4915 1 927 . 1 1 96 96 ILE HG21 H 1 1.20 0.03 . 1 . . . . . . . . 4915 1 928 . 1 1 96 96 ILE HG22 H 1 1.20 0.03 . 1 . . . . . . . . 4915 1 929 . 1 1 96 96 ILE HG23 H 1 1.20 0.03 . 1 . . . . . . . . 4915 1 930 . 1 1 96 96 ILE CG1 C 13 27.3 0.20 . 2 . . . . . . . . 4915 1 931 . 1 1 96 96 ILE HG12 H 1 1.79 0.03 . 2 . . . . . . . . 4915 1 932 . 1 1 96 96 ILE HG13 H 1 1.45 0.03 . 2 . . . . . . . . 4915 1 933 . 1 1 96 96 ILE CD1 C 13 13.9 0.20 . 1 . . . . . . . . 4915 1 934 . 1 1 96 96 ILE HD11 H 1 0.99 0.03 . 1 . . . . . . . . 4915 1 935 . 1 1 96 96 ILE HD12 H 1 0.99 0.03 . 1 . . . . . . . . 4915 1 936 . 1 1 96 96 ILE HD13 H 1 0.99 0.03 . 1 . . . . . . . . 4915 1 937 . 1 1 96 96 ILE C C 13 172.6 0.20 . 1 . . . . . . . . 4915 1 938 . 1 1 97 97 ASP N N 15 119.3 0.25 . 1 . . . . . . . . 4915 1 939 . 1 1 97 97 ASP H H 1 7.87 0.03 . 1 . . . . . . . . 4915 1 940 . 1 1 97 97 ASP CA C 13 54.9 0.20 . 1 . . . . . . . . 4915 1 941 . 1 1 97 97 ASP HA H 1 4.39 0.03 . 1 . . . . . . . . 4915 1 942 . 1 1 97 97 ASP CB C 13 42.7 0.20 . 1 . . . . . . . . 4915 1 943 . 1 1 97 97 ASP HB2 H 1 2.85 0.03 . 2 . . . . . . . . 4915 1 944 . 1 1 97 97 ASP HB3 H 1 2.73 0.03 . 2 . . . . . . . . 4915 1 945 . 1 1 97 97 ASP C C 13 177.3 0.20 . 1 . . . . . . . . 4915 1 946 . 1 1 98 98 ASN N N 15 122.6 0.25 . 1 . . . . . . . . 4915 1 947 . 1 1 98 98 ASN H H 1 8.76 0.03 . 1 . . . . . . . . 4915 1 948 . 1 1 98 98 ASN CA C 13 55.6 0.20 . 1 . . . . . . . . 4915 1 949 . 1 1 98 98 ASN HA H 1 4.38 0.03 . 1 . . . . . . . . 4915 1 950 . 1 1 98 98 ASN CB C 13 37.0 0.20 . 1 . . . . . . . . 4915 1 951 . 1 1 98 98 ASN HB2 H 1 2.99 0.03 . 2 . . . . . . . . 4915 1 952 . 1 1 98 98 ASN HB3 H 1 2.64 0.03 . 2 . . . . . . . . 4915 1 953 . 1 1 98 98 ASN HD21 H 1 7.40 0.03 . 2 . . . . . . . . 4915 1 954 . 1 1 98 98 ASN HD22 H 1 6.59 0.03 . 2 . . . . . . . . 4915 1 955 . 1 1 98 98 ASN C C 13 176.9 0.20 . 1 . . . . . . . . 4915 1 956 . 1 1 99 99 SER N N 15 114.3 0.25 . 1 . . . . . . . . 4915 1 957 . 1 1 99 99 SER H H 1 8.70 0.03 . 1 . . . . . . . . 4915 1 958 . 1 1 99 99 SER CA C 13 61.3 0.20 . 1 . . . . . . . . 4915 1 959 . 1 1 99 99 SER HA H 1 4.21 0.03 . 1 . . . . . . . . 4915 1 960 . 1 1 99 99 SER CB C 13 61.8 0.20 . 1 . . . . . . . . 4915 1 961 . 1 1 99 99 SER HB2 H 1 4.03 0.03 . 1 . . . . . . . . 4915 1 962 . 1 1 99 99 SER HB3 H 1 4.03 0.03 . 1 . . . . . . . . 4915 1 963 . 1 1 99 99 SER C C 13 177.0 0.20 . 1 . . . . . . . . 4915 1 964 . 1 1 100 100 GLU N N 15 123.6 0.25 . 1 . . . . . . . . 4915 1 965 . 1 1 100 100 GLU H H 1 7.49 0.03 . 1 . . . . . . . . 4915 1 966 . 1 1 100 100 GLU CA C 13 58.1 0.20 . 1 . . . . . . . . 4915 1 967 . 1 1 100 100 GLU HA H 1 4.40 0.03 . 1 . . . . . . . . 4915 1 968 . 1 1 100 100 GLU CB C 13 28.7 0.20 . 1 . . . . . . . . 4915 1 969 . 1 1 100 100 GLU HB2 H 1 2.24 0.03 . 2 . . . . . . . . 4915 1 970 . 1 1 100 100 GLU HB3 H 1 2.19 0.03 . 2 . . . . . . . . 4915 1 971 . 1 1 100 100 GLU HG2 H 1 2.45 0.03 . 2 . . . . . . . . 4915 1 972 . 1 1 100 100 GLU HG3 H 1 2.39 0.03 . 2 . . . . . . . . 4915 1 973 . 1 1 100 100 GLU C C 13 179.0 0.20 . 1 . . . . . . . . 4915 1 974 . 1 1 101 101 LEU N N 15 120.9 0.25 . 1 . . . . . . . . 4915 1 975 . 1 1 101 101 LEU H H 1 8.04 0.03 . 1 . . . . . . . . 4915 1 976 . 1 1 101 101 LEU CA C 13 57.6 0.20 . 1 . . . . . . . . 4915 1 977 . 1 1 101 101 LEU HA H 1 4.33 0.03 . 1 . . . . . . . . 4915 1 978 . 1 1 101 101 LEU CB C 13 42.6 0.20 . 1 . . . . . . . . 4915 1 979 . 1 1 101 101 LEU HB2 H 1 1.67 0.03 . 2 . . . . . . . . 4915 1 980 . 1 1 101 101 LEU HB3 H 1 1.20 0.03 . 2 . . . . . . . . 4915 1 981 . 1 1 101 101 LEU HG H 1 1.41 0.03 . 1 . . . . . . . . 4915 1 982 . 1 1 101 101 LEU CD1 C 13 26.2 0.20 . 2 . . . . . . . . 4915 1 983 . 1 1 101 101 LEU HD11 H 1 0.96 0.03 . 1 . . . . . . . . 4915 1 984 . 1 1 101 101 LEU HD12 H 1 0.96 0.03 . 1 . . . . . . . . 4915 1 985 . 1 1 101 101 LEU HD13 H 1 0.96 0.03 . 1 . . . . . . . . 4915 1 986 . 1 1 101 101 LEU CD2 C 13 22.2 0.20 . 2 . . . . . . . . 4915 1 987 . 1 1 101 101 LEU HD21 H 1 0.96 0.03 . 1 . . . . . . . . 4915 1 988 . 1 1 101 101 LEU HD22 H 1 0.96 0.03 . 1 . . . . . . . . 4915 1 989 . 1 1 101 101 LEU HD23 H 1 0.96 0.03 . 1 . . . . . . . . 4915 1 990 . 1 1 101 101 LEU C C 13 178.5 0.20 . 1 . . . . . . . . 4915 1 991 . 1 1 102 102 LEU N N 15 117.6 0.25 . 1 . . . . . . . . 4915 1 992 . 1 1 102 102 LEU H H 1 8.38 0.03 . 1 . . . . . . . . 4915 1 993 . 1 1 102 102 LEU CA C 13 57.5 0.20 . 1 . . . . . . . . 4915 1 994 . 1 1 102 102 LEU HA H 1 4.02 0.03 . 1 . . . . . . . . 4915 1 995 . 1 1 102 102 LEU CB C 13 40.9 0.20 . 1 . . . . . . . . 4915 1 996 . 1 1 102 102 LEU HB2 H 1 1.83 0.03 . 2 . . . . . . . . 4915 1 997 . 1 1 102 102 LEU HB3 H 1 1.71 0.03 . 2 . . . . . . . . 4915 1 998 . 1 1 102 102 LEU HG H 1 1.75 0.03 . 1 . . . . . . . . 4915 1 999 . 1 1 102 102 LEU CD1 C 13 26.2 0.20 . 2 . . . . . . . . 4915 1 1000 . 1 1 102 102 LEU HD11 H 1 0.89 0.03 . 2 . . . . . . . . 4915 1 1001 . 1 1 102 102 LEU HD12 H 1 0.89 0.03 . 2 . . . . . . . . 4915 1 1002 . 1 1 102 102 LEU HD13 H 1 0.89 0.03 . 2 . . . . . . . . 4915 1 1003 . 1 1 102 102 LEU CD2 C 13 23.8 0.20 . 2 . . . . . . . . 4915 1 1004 . 1 1 102 102 LEU HD21 H 1 0.86 0.03 . 2 . . . . . . . . 4915 1 1005 . 1 1 102 102 LEU HD22 H 1 0.86 0.03 . 2 . . . . . . . . 4915 1 1006 . 1 1 102 102 LEU HD23 H 1 0.86 0.03 . 2 . . . . . . . . 4915 1 1007 . 1 1 102 102 LEU C C 13 179.5 0.20 . 1 . . . . . . . . 4915 1 1008 . 1 1 103 103 HIS N N 15 116.5 0.25 . 1 . . . . . . . . 4915 1 1009 . 1 1 103 103 HIS H H 1 7.52 0.03 . 1 . . . . . . . . 4915 1 1010 . 1 1 103 103 HIS CA C 13 57.7 0.20 . 1 . . . . . . . . 4915 1 1011 . 1 1 103 103 HIS HA H 1 4.63 0.03 . 1 . . . . . . . . 4915 1 1012 . 1 1 103 103 HIS CB C 13 27.6 0.20 . 1 . . . . . . . . 4915 1 1013 . 1 1 103 103 HIS HB2 H 1 3.60 0.03 . 2 . . . . . . . . 4915 1 1014 . 1 1 103 103 HIS HB3 H 1 3.43 0.03 . 2 . . . . . . . . 4915 1 1015 . 1 1 103 103 HIS HD2 H 1 7.44 0.03 . 1 . . . . . . . . 4915 1 1016 . 1 1 103 103 HIS C C 13 177.0 0.20 . 1 . . . . . . . . 4915 1 1017 . 1 1 104 104 MET N N 15 119.2 0.25 . 1 . . . . . . . . 4915 1 1018 . 1 1 104 104 MET H H 1 8.34 0.03 . 1 . . . . . . . . 4915 1 1019 . 1 1 104 104 MET CA C 13 58.8 0.20 . 1 . . . . . . . . 4915 1 1020 . 1 1 104 104 MET HA H 1 3.94 0.03 . 1 . . . . . . . . 4915 1 1021 . 1 1 104 104 MET CB C 13 32.8 0.20 . 1 . . . . . . . . 4915 1 1022 . 1 1 104 104 MET HB2 H 1 2.50 0.03 . 2 . . . . . . . . 4915 1 1023 . 1 1 104 104 MET HB3 H 1 2.45 0.03 . 2 . . . . . . . . 4915 1 1024 . 1 1 104 104 MET CG C 13 31.6 0.20 . 1 . . . . . . . . 4915 1 1025 . 1 1 104 104 MET HG2 H 1 2.83 0.03 . 1 . . . . . . . . 4915 1 1026 . 1 1 104 104 MET HG3 H 1 2.83 0.03 . 1 . . . . . . . . 4915 1 1027 . 1 1 104 104 MET CE C 13 17.6 0.20 . 1 . . . . . . . . 4915 1 1028 . 1 1 104 104 MET HE1 H 1 2.47 0.03 . 1 . . . . . . . . 4915 1 1029 . 1 1 104 104 MET HE2 H 1 2.47 0.03 . 1 . . . . . . . . 4915 1 1030 . 1 1 104 104 MET HE3 H 1 2.47 0.03 . 1 . . . . . . . . 4915 1 1031 . 1 1 104 104 MET C C 13 176.3 0.20 . 1 . . . . . . . . 4915 1 1032 . 1 1 105 105 LEU N N 15 115.5 0.25 . 1 . . . . . . . . 4915 1 1033 . 1 1 105 105 LEU H H 1 7.65 0.03 . 1 . . . . . . . . 4915 1 1034 . 1 1 105 105 LEU CA C 13 56.2 0.20 . 1 . . . . . . . . 4915 1 1035 . 1 1 105 105 LEU HA H 1 4.04 0.03 . 1 . . . . . . . . 4915 1 1036 . 1 1 105 105 LEU CB C 13 41.0 0.20 . 1 . . . . . . . . 4915 1 1037 . 1 1 105 105 LEU HB2 H 1 2.09 0.03 . 2 . . . . . . . . 4915 1 1038 . 1 1 105 105 LEU HB3 H 1 1.62 0.03 . 2 . . . . . . . . 4915 1 1039 . 1 1 105 105 LEU HG H 1 1.92 0.03 . 1 . . . . . . . . 4915 1 1040 . 1 1 105 105 LEU CD1 C 13 25.5 0.20 . 2 . . . . . . . . 4915 1 1041 . 1 1 105 105 LEU HD11 H 1 1.00 0.03 . 2 . . . . . . . . 4915 1 1042 . 1 1 105 105 LEU HD12 H 1 1.00 0.03 . 2 . . . . . . . . 4915 1 1043 . 1 1 105 105 LEU HD13 H 1 1.00 0.03 . 2 . . . . . . . . 4915 1 1044 . 1 1 105 105 LEU CD2 C 13 23.2 0.20 . 2 . . . . . . . . 4915 1 1045 . 1 1 105 105 LEU HD21 H 1 0.86 0.03 . 2 . . . . . . . . 4915 1 1046 . 1 1 105 105 LEU HD22 H 1 0.86 0.03 . 2 . . . . . . . . 4915 1 1047 . 1 1 105 105 LEU HD23 H 1 0.86 0.03 . 2 . . . . . . . . 4915 1 1048 . 1 1 105 105 LEU C C 13 178.0 0.20 . 1 . . . . . . . . 4915 1 1049 . 1 1 106 106 GLU N N 15 115.9 0.25 . 1 . . . . . . . . 4915 1 1050 . 1 1 106 106 GLU H H 1 7.37 0.03 . 1 . . . . . . . . 4915 1 1051 . 1 1 106 106 GLU CA C 13 55.5 0.20 . 1 . . . . . . . . 4915 1 1052 . 1 1 106 106 GLU HA H 1 4.52 0.03 . 1 . . . . . . . . 4915 1 1053 . 1 1 106 106 GLU CB C 13 30.2 0.20 . 1 . . . . . . . . 4915 1 1054 . 1 1 106 106 GLU HB2 H 1 2.21 0.03 . 1 . . . . . . . . 4915 1 1055 . 1 1 106 106 GLU HB3 H 1 2.21 0.03 . 1 . . . . . . . . 4915 1 1056 . 1 1 106 106 GLU CG C 13 35.4 0.20 . 1 . . . . . . . . 4915 1 1057 . 1 1 106 106 GLU HG2 H 1 2.48 0.03 . 1 . . . . . . . . 4915 1 1058 . 1 1 106 106 GLU HG3 H 1 2.48 0.03 . 1 . . . . . . . . 4915 1 1059 . 1 1 106 106 GLU C C 13 175.6 0.20 . 1 . . . . . . . . 4915 1 1060 . 1 1 107 107 SER N N 15 113.6 0.25 . 1 . . . . . . . . 4915 1 1061 . 1 1 107 107 SER H H 1 7.43 0.03 . 1 . . . . . . . . 4915 1 1062 . 1 1 107 107 SER CA C 13 53.2 0.20 . 1 . . . . . . . . 4915 1 1063 . 1 1 107 107 SER HA H 1 5.14 0.03 . 1 . . . . . . . . 4915 1 1064 . 1 1 107 107 SER HB2 H 1 3.67 0.03 . 2 . . . . . . . . 4915 1 1065 . 1 1 107 107 SER HB3 H 1 3.55 0.03 . 2 . . . . . . . . 4915 1 1066 . 1 1 107 107 SER C C 13 171.4 0.20 . 1 . . . . . . . . 4915 1 1067 . 1 1 108 108 PRO CA C 13 64.7 0.20 . 1 . . . . . . . . 4915 1 1068 . 1 1 108 108 PRO CB C 13 31.6 0.20 . 1 . . . . . . . . 4915 1 1069 . 1 1 108 108 PRO CG C 13 26.3 0.20 . 1 . . . . . . . . 4915 1 1070 . 1 1 108 108 PRO C C 13 178.9 0.20 . 1 . . . . . . . . 4915 1 1071 . 1 1 109 109 GLU N N 15 117.3 0.25 . 1 . . . . . . . . 4915 1 1072 . 1 1 109 109 GLU H H 1 9.07 0.03 . 1 . . . . . . . . 4915 1 1073 . 1 1 109 109 GLU CA C 13 59.2 0.20 . 1 . . . . . . . . 4915 1 1074 . 1 1 109 109 GLU HA H 1 4.20 0.03 . 1 . . . . . . . . 4915 1 1075 . 1 1 109 109 GLU CB C 13 28.3 0.20 . 1 . . . . . . . . 4915 1 1076 . 1 1 109 109 GLU HB2 H 1 2.11 0.03 . 1 . . . . . . . . 4915 1 1077 . 1 1 109 109 GLU HB3 H 1 2.11 0.03 . 1 . . . . . . . . 4915 1 1078 . 1 1 109 109 GLU CG C 13 35.6 0.20 . 1 . . . . . . . . 4915 1 1079 . 1 1 109 109 GLU HG2 H 1 2.45 0.03 . 2 . . . . . . . . 4915 1 1080 . 1 1 109 109 GLU HG3 H 1 2.42 0.03 . 2 . . . . . . . . 4915 1 1081 . 1 1 109 109 GLU C C 13 179.0 0.20 . 1 . . . . . . . . 4915 1 1082 . 1 1 110 110 SER N N 15 117.0 0.25 . 1 . . . . . . . . 4915 1 1083 . 1 1 110 110 SER H H 1 7.91 0.03 . 1 . . . . . . . . 4915 1 1084 . 1 1 110 110 SER CA C 13 60.9 0.20 . 1 . . . . . . . . 4915 1 1085 . 1 1 110 110 SER HA H 1 4.45 0.03 . 1 . . . . . . . . 4915 1 1086 . 1 1 110 110 SER CB C 13 62.3 0.20 . 1 . . . . . . . . 4915 1 1087 . 1 1 110 110 SER HB2 H 1 4.06 0.03 . 1 . . . . . . . . 4915 1 1088 . 1 1 110 110 SER HB3 H 1 4.06 0.03 . 1 . . . . . . . . 4915 1 1089 . 1 1 110 110 SER C C 13 176.2 0.20 . 1 . . . . . . . . 4915 1 1090 . 1 1 111 111 LEU N N 15 121.7 0.25 . 1 . . . . . . . . 4915 1 1091 . 1 1 111 111 LEU H H 1 8.01 0.03 . 1 . . . . . . . . 4915 1 1092 . 1 1 111 111 LEU CA C 13 57.6 0.20 . 1 . . . . . . . . 4915 1 1093 . 1 1 111 111 LEU HA H 1 4.24 0.03 . 1 . . . . . . . . 4915 1 1094 . 1 1 111 111 LEU CB C 13 39.9 0.20 . 1 . . . . . . . . 4915 1 1095 . 1 1 111 111 LEU HB2 H 1 2.02 0.03 . 2 . . . . . . . . 4915 1 1096 . 1 1 111 111 LEU HB3 H 1 1.88 0.03 . 2 . . . . . . . . 4915 1 1097 . 1 1 111 111 LEU CD1 C 13 26.3 0.20 . 1 . . . . . . . . 4915 1 1098 . 1 1 111 111 LEU HD11 H 1 0.86 0.03 . 1 . . . . . . . . 4915 1 1099 . 1 1 111 111 LEU HD12 H 1 0.86 0.03 . 1 . . . . . . . . 4915 1 1100 . 1 1 111 111 LEU HD13 H 1 0.86 0.03 . 1 . . . . . . . . 4915 1 1101 . 1 1 111 111 LEU CD2 C 13 26.3 0.20 . 1 . . . . . . . . 4915 1 1102 . 1 1 111 111 LEU HD21 H 1 0.86 0.03 . 1 . . . . . . . . 4915 1 1103 . 1 1 111 111 LEU HD22 H 1 0.86 0.03 . 1 . . . . . . . . 4915 1 1104 . 1 1 111 111 LEU HD23 H 1 0.86 0.03 . 1 . . . . . . . . 4915 1 1105 . 1 1 111 111 LEU C C 13 177.6 0.20 . 1 . . . . . . . . 4915 1 1106 . 1 1 112 112 ARG N N 15 117.4 0.25 . 1 . . . . . . . . 4915 1 1107 . 1 1 112 112 ARG H H 1 8.45 0.03 . 1 . . . . . . . . 4915 1 1108 . 1 1 112 112 ARG CA C 13 59.2 0.20 . 1 . . . . . . . . 4915 1 1109 . 1 1 112 112 ARG HA H 1 3.88 0.03 . 1 . . . . . . . . 4915 1 1110 . 1 1 112 112 ARG CB C 13 29.1 0.20 . 1 . . . . . . . . 4915 1 1111 . 1 1 112 112 ARG HB2 H 1 2.05 0.03 . 1 . . . . . . . . 4915 1 1112 . 1 1 112 112 ARG HB3 H 1 2.05 0.03 . 1 . . . . . . . . 4915 1 1113 . 1 1 112 112 ARG CG C 13 26.2 0.20 . 1 . . . . . . . . 4915 1 1114 . 1 1 112 112 ARG HG2 H 1 1.81 0.03 . 1 . . . . . . . . 4915 1 1115 . 1 1 112 112 ARG HG3 H 1 1.81 0.03 . 1 . . . . . . . . 4915 1 1116 . 1 1 112 112 ARG CD C 13 42.9 0.20 . 1 . . . . . . . . 4915 1 1117 . 1 1 112 112 ARG HD2 H 1 3.35 0.03 . 1 . . . . . . . . 4915 1 1118 . 1 1 112 112 ARG HD3 H 1 3.35 0.03 . 1 . . . . . . . . 4915 1 1119 . 1 1 112 112 ARG C C 13 177.4 0.20 . 1 . . . . . . . . 4915 1 1120 . 1 1 113 113 SER N N 15 111.7 0.25 . 1 . . . . . . . . 4915 1 1121 . 1 1 113 113 SER H H 1 7.82 0.03 . 1 . . . . . . . . 4915 1 1122 . 1 1 113 113 SER CA C 13 62.3 0.20 . 1 . . . . . . . . 4915 1 1123 . 1 1 113 113 SER HA H 1 4.40 0.03 . 1 . . . . . . . . 4915 1 1124 . 1 1 113 113 SER CB C 13 61.8 0.20 . 1 . . . . . . . . 4915 1 1125 . 1 1 113 113 SER HB2 H 1 4.12 0.03 . 1 . . . . . . . . 4915 1 1126 . 1 1 113 113 SER HB3 H 1 4.12 0.03 . 1 . . . . . . . . 4915 1 1127 . 1 1 113 113 SER C C 13 177.1 0.20 . 1 . . . . . . . . 4915 1 1128 . 1 1 114 114 LYS N N 15 120.9 0.25 . 1 . . . . . . . . 4915 1 1129 . 1 1 114 114 LYS H H 1 7.66 0.03 . 1 . . . . . . . . 4915 1 1130 . 1 1 114 114 LYS CA C 13 56.7 0.20 . 1 . . . . . . . . 4915 1 1131 . 1 1 114 114 LYS HA H 1 4.23 0.03 . 1 . . . . . . . . 4915 1 1132 . 1 1 114 114 LYS CB C 13 31.4 0.20 . 1 . . . . . . . . 4915 1 1133 . 1 1 114 114 LYS HB2 H 1 2.18 0.03 . 2 . . . . . . . . 4915 1 1134 . 1 1 114 114 LYS HB3 H 1 1.92 0.03 . 2 . . . . . . . . 4915 1 1135 . 1 1 114 114 LYS CG C 13 24.2 0.20 . 1 . . . . . . . . 4915 1 1136 . 1 1 114 114 LYS HG2 H 1 1.68 0.03 . 1 . . . . . . . . 4915 1 1137 . 1 1 114 114 LYS HG3 H 1 1.68 0.03 . 1 . . . . . . . . 4915 1 1138 . 1 1 114 114 LYS CD C 13 27.4 0.20 . 1 . . . . . . . . 4915 1 1139 . 1 1 114 114 LYS C C 13 179.3 0.20 . 1 . . . . . . . . 4915 1 1140 . 1 1 115 115 VAL N N 15 121.8 0.25 . 1 . . . . . . . . 4915 1 1141 . 1 1 115 115 VAL H H 1 8.82 0.03 . 1 . . . . . . . . 4915 1 1142 . 1 1 115 115 VAL CA C 13 66.8 0.20 . 1 . . . . . . . . 4915 1 1143 . 1 1 115 115 VAL HA H 1 3.60 0.03 . 1 . . . . . . . . 4915 1 1144 . 1 1 115 115 VAL CB C 13 31.0 0.20 . 1 . . . . . . . . 4915 1 1145 . 1 1 115 115 VAL HB H 1 2.39 0.03 . 1 . . . . . . . . 4915 1 1146 . 1 1 115 115 VAL CG1 C 13 24.2 0.20 . 1 . . . . . . . . 4915 1 1147 . 1 1 115 115 VAL HG11 H 1 1.12 0.03 . 2 . . . . . . . . 4915 1 1148 . 1 1 115 115 VAL HG12 H 1 1.12 0.03 . 2 . . . . . . . . 4915 1 1149 . 1 1 115 115 VAL HG13 H 1 1.12 0.03 . 2 . . . . . . . . 4915 1 1150 . 1 1 115 115 VAL CG2 C 13 21.3 0.20 . 1 . . . . . . . . 4915 1 1151 . 1 1 115 115 VAL HG21 H 1 1.20 0.03 . 2 . . . . . . . . 4915 1 1152 . 1 1 115 115 VAL HG22 H 1 1.20 0.03 . 2 . . . . . . . . 4915 1 1153 . 1 1 115 115 VAL HG23 H 1 1.20 0.03 . 2 . . . . . . . . 4915 1 1154 . 1 1 115 115 VAL C C 13 176.7 0.20 . 1 . . . . . . . . 4915 1 1155 . 1 1 116 116 ASP N N 15 119.7 0.25 . 1 . . . . . . . . 4915 1 1156 . 1 1 116 116 ASP H H 1 8.74 0.03 . 1 . . . . . . . . 4915 1 1157 . 1 1 116 116 ASP CA C 13 57.0 0.20 . 1 . . . . . . . . 4915 1 1158 . 1 1 116 116 ASP HA H 1 4.46 0.03 . 1 . . . . . . . . 4915 1 1159 . 1 1 116 116 ASP CB C 13 39.0 0.20 . 1 . . . . . . . . 4915 1 1160 . 1 1 116 116 ASP HB2 H 1 2.96 0.03 . 2 . . . . . . . . 4915 1 1161 . 1 1 116 116 ASP HB3 H 1 2.72 0.03 . 2 . . . . . . . . 4915 1 1162 . 1 1 116 116 ASP C C 13 179.5 0.20 . 1 . . . . . . . . 4915 1 1163 . 1 1 117 117 GLU N N 15 120.3 0.25 . 1 . . . . . . . . 4915 1 1164 . 1 1 117 117 GLU H H 1 7.74 0.03 . 1 . . . . . . . . 4915 1 1165 . 1 1 117 117 GLU CA C 13 58.7 0.20 . 1 . . . . . . . . 4915 1 1166 . 1 1 117 117 GLU HA H 1 4.17 0.03 . 1 . . . . . . . . 4915 1 1167 . 1 1 117 117 GLU CB C 13 29.4 0.20 . 1 . . . . . . . . 4915 1 1168 . 1 1 117 117 GLU HB2 H 1 2.30 0.03 . 2 . . . . . . . . 4915 1 1169 . 1 1 117 117 GLU HB3 H 1 2.27 0.03 . 2 . . . . . . . . 4915 1 1170 . 1 1 117 117 GLU CG C 13 35.6 0.20 . 1 . . . . . . . . 4915 1 1171 . 1 1 117 117 GLU HG2 H 1 2.58 0.03 . 1 . . . . . . . . 4915 1 1172 . 1 1 117 117 GLU HG3 H 1 2.58 0.03 . 1 . . . . . . . . 4915 1 1173 . 1 1 117 117 GLU C C 13 177.9 0.20 . 1 . . . . . . . . 4915 1 1174 . 1 1 118 118 ALA N N 15 122.8 0.25 . 1 . . . . . . . . 4915 1 1175 . 1 1 118 118 ALA H H 1 8.03 0.03 . 1 . . . . . . . . 4915 1 1176 . 1 1 118 118 ALA CA C 13 54.5 0.20 . 1 . . . . . . . . 4915 1 1177 . 1 1 118 118 ALA HA H 1 4.20 0.03 . 1 . . . . . . . . 4915 1 1178 . 1 1 118 118 ALA HB1 H 1 1.67 0.03 . 1 . . . . . . . . 4915 1 1179 . 1 1 118 118 ALA HB2 H 1 1.67 0.03 . 1 . . . . . . . . 4915 1 1180 . 1 1 118 118 ALA HB3 H 1 1.67 0.03 . 1 . . . . . . . . 4915 1 1181 . 1 1 118 118 ALA CB C 13 17.8 0.20 . 1 . . . . . . . . 4915 1 1182 . 1 1 118 118 ALA C C 13 179.2 0.20 . 1 . . . . . . . . 4915 1 1183 . 1 1 119 119 VAL N N 15 117.9 0.25 . 1 . . . . . . . . 4915 1 1184 . 1 1 119 119 VAL H H 1 8.80 0.03 . 1 . . . . . . . . 4915 1 1185 . 1 1 119 119 VAL CA C 13 66.6 0.20 . 1 . . . . . . . . 4915 1 1186 . 1 1 119 119 VAL HA H 1 3.38 0.03 . 1 . . . . . . . . 4915 1 1187 . 1 1 119 119 VAL CB C 13 31.0 0.20 . 1 . . . . . . . . 4915 1 1188 . 1 1 119 119 VAL HB H 1 2.10 0.03 . 1 . . . . . . . . 4915 1 1189 . 1 1 119 119 VAL CG1 C 13 23.3 0.20 . 1 . . . . . . . . 4915 1 1190 . 1 1 119 119 VAL HG11 H 1 0.63 0.03 . 2 . . . . . . . . 4915 1 1191 . 1 1 119 119 VAL HG12 H 1 0.63 0.03 . 2 . . . . . . . . 4915 1 1192 . 1 1 119 119 VAL HG13 H 1 0.63 0.03 . 2 . . . . . . . . 4915 1 1193 . 1 1 119 119 VAL CG2 C 13 20.1 0.20 . 1 . . . . . . . . 4915 1 1194 . 1 1 119 119 VAL HG21 H 1 0.81 0.03 . 2 . . . . . . . . 4915 1 1195 . 1 1 119 119 VAL HG22 H 1 0.81 0.03 . 2 . . . . . . . . 4915 1 1196 . 1 1 119 119 VAL HG23 H 1 0.81 0.03 . 2 . . . . . . . . 4915 1 1197 . 1 1 119 119 VAL C C 13 177.2 0.20 . 1 . . . . . . . . 4915 1 1198 . 1 1 120 120 ALA N N 15 120.6 0.25 . 1 . . . . . . . . 4915 1 1199 . 1 1 120 120 ALA H H 1 7.66 0.03 . 1 . . . . . . . . 4915 1 1200 . 1 1 120 120 ALA CA C 13 54.6 0.20 . 1 . . . . . . . . 4915 1 1201 . 1 1 120 120 ALA HA H 1 4.23 0.03 . 1 . . . . . . . . 4915 1 1202 . 1 1 120 120 ALA CB C 13 17.1 0.20 . 1 . . . . . . . . 4915 1 1203 . 1 1 120 120 ALA HB1 H 1 1.62 0.03 . 1 . . . . . . . . 4915 1 1204 . 1 1 120 120 ALA HB2 H 1 1.62 0.03 . 1 . . . . . . . . 4915 1 1205 . 1 1 120 120 ALA HB3 H 1 1.62 0.03 . 1 . . . . . . . . 4915 1 1206 . 1 1 120 120 ALA C C 13 180.9 0.20 . 1 . . . . . . . . 4915 1 1207 . 1 1 121 121 VAL N N 15 119.8 0.25 . 1 . . . . . . . . 4915 1 1208 . 1 1 121 121 VAL H H 1 7.84 0.03 . 1 . . . . . . . . 4915 1 1209 . 1 1 121 121 VAL CA C 13 65.7 0.20 . 1 . . . . . . . . 4915 1 1210 . 1 1 121 121 VAL HA H 1 3.81 0.03 . 1 . . . . . . . . 4915 1 1211 . 1 1 121 121 VAL CB C 13 31.3 0.20 . 1 . . . . . . . . 4915 1 1212 . 1 1 121 121 VAL HB H 1 2.33 0.03 . 1 . . . . . . . . 4915 1 1213 . 1 1 121 121 VAL CG1 C 13 21.9 0.20 . 1 . . . . . . . . 4915 1 1214 . 1 1 121 121 VAL HG11 H 1 1.18 0.03 . 2 . . . . . . . . 4915 1 1215 . 1 1 121 121 VAL HG12 H 1 1.18 0.03 . 2 . . . . . . . . 4915 1 1216 . 1 1 121 121 VAL HG13 H 1 1.18 0.03 . 2 . . . . . . . . 4915 1 1217 . 1 1 121 121 VAL CG2 C 13 20.6 0.20 . 1 . . . . . . . . 4915 1 1218 . 1 1 121 121 VAL HG21 H 1 0.98 0.03 . 2 . . . . . . . . 4915 1 1219 . 1 1 121 121 VAL HG22 H 1 0.98 0.03 . 2 . . . . . . . . 4915 1 1220 . 1 1 121 121 VAL HG23 H 1 0.98 0.03 . 2 . . . . . . . . 4915 1 1221 . 1 1 121 121 VAL C C 13 178.5 0.20 . 1 . . . . . . . . 4915 1 1222 . 1 1 122 122 LEU N N 15 121.0 0.25 . 1 . . . . . . . . 4915 1 1223 . 1 1 122 122 LEU H H 1 8.39 0.03 . 1 . . . . . . . . 4915 1 1224 . 1 1 122 122 LEU CA C 13 57.4 0.20 . 1 . . . . . . . . 4915 1 1225 . 1 1 122 122 LEU HA H 1 4.14 0.03 . 1 . . . . . . . . 4915 1 1226 . 1 1 122 122 LEU CB C 13 41.1 0.20 . 1 . . . . . . . . 4915 1 1227 . 1 1 122 122 LEU HB2 H 1 1.98 0.03 . 2 . . . . . . . . 4915 1 1228 . 1 1 122 122 LEU HB3 H 1 1.61 0.03 . 2 . . . . . . . . 4915 1 1229 . 1 1 122 122 LEU HG H 1 1.88 0.03 . 1 . . . . . . . . 4915 1 1230 . 1 1 122 122 LEU CD1 C 13 26.2 0.20 . 2 . . . . . . . . 4915 1 1231 . 1 1 122 122 LEU HD11 H 1 0.89 0.03 . 2 . . . . . . . . 4915 1 1232 . 1 1 122 122 LEU HD12 H 1 0.89 0.03 . 2 . . . . . . . . 4915 1 1233 . 1 1 122 122 LEU HD13 H 1 0.89 0.03 . 2 . . . . . . . . 4915 1 1234 . 1 1 122 122 LEU CD2 C 13 23.3 0.20 . 2 . . . . . . . . 4915 1 1235 . 1 1 122 122 LEU HD21 H 1 0.96 0.03 . 2 . . . . . . . . 4915 1 1236 . 1 1 122 122 LEU HD22 H 1 0.96 0.03 . 2 . . . . . . . . 4915 1 1237 . 1 1 122 122 LEU HD23 H 1 0.96 0.03 . 2 . . . . . . . . 4915 1 1238 . 1 1 122 122 LEU C C 13 179.7 0.20 . 1 . . . . . . . . 4915 1 1239 . 1 1 123 123 GLN N N 15 117.8 0.25 . 1 . . . . . . . . 4915 1 1240 . 1 1 123 123 GLN H H 1 8.70 0.03 . 1 . . . . . . . . 4915 1 1241 . 1 1 123 123 GLN CA C 13 57.5 0.20 . 1 . . . . . . . . 4915 1 1242 . 1 1 123 123 GLN HA H 1 4.24 0.03 . 1 . . . . . . . . 4915 1 1243 . 1 1 123 123 GLN CB C 13 27.7 0.20 . 1 . . . . . . . . 4915 1 1244 . 1 1 123 123 GLN HB2 H 1 2.24 0.03 . 2 . . . . . . . . 4915 1 1245 . 1 1 123 123 GLN HB3 H 1 2.17 0.03 . 2 . . . . . . . . 4915 1 1246 . 1 1 123 123 GLN CG C 13 33.6 0.20 . 1 . . . . . . . . 4915 1 1247 . 1 1 123 123 GLN HG2 H 1 2.63 0.03 . 2 . . . . . . . . 4915 1 1248 . 1 1 123 123 GLN HG3 H 1 2.44 0.03 . 2 . . . . . . . . 4915 1 1249 . 1 1 123 123 GLN HE21 H 1 7.34 0.03 . 1 . . . . . . . . 4915 1 1250 . 1 1 123 123 GLN HE22 H 1 6.86 0.03 . 1 . . . . . . . . 4915 1 1251 . 1 1 123 123 GLN C C 13 177.8 0.20 . 1 . . . . . . . . 4915 1 1252 . 1 1 124 124 ALA N N 15 122.5 0.25 . 1 . . . . . . . . 4915 1 1253 . 1 1 124 124 ALA H H 1 7.88 0.03 . 1 . . . . . . . . 4915 1 1254 . 1 1 124 124 ALA CA C 13 53.8 0.20 . 1 . . . . . . . . 4915 1 1255 . 1 1 124 124 ALA HA H 1 4.34 0.03 . 1 . . . . . . . . 4915 1 1256 . 1 1 124 124 ALA CB C 13 17.6 0.20 . 1 . . . . . . . . 4915 1 1257 . 1 1 124 124 ALA HB1 H 1 1.59 0.03 . 1 . . . . . . . . 4915 1 1258 . 1 1 124 124 ALA HB2 H 1 1.59 0.03 . 1 . . . . . . . . 4915 1 1259 . 1 1 124 124 ALA HB3 H 1 1.59 0.03 . 1 . . . . . . . . 4915 1 1260 . 1 1 125 125 HIS N N 15 117.4 0.25 . 1 . . . . . . . . 4915 1 1261 . 1 1 125 125 HIS H H 1 8.24 0.03 . 1 . . . . . . . . 4915 1 1262 . 1 1 125 125 HIS CA C 13 57.0 0.20 . 1 . . . . . . . . 4915 1 1263 . 1 1 125 125 HIS HA H 1 4.57 0.03 . 1 . . . . . . . . 4915 1 1264 . 1 1 125 125 HIS CB C 13 28.9 0.20 . 1 . . . . . . . . 4915 1 1265 . 1 1 125 125 HIS HB2 H 1 3.38 0.03 . 2 . . . . . . . . 4915 1 1266 . 1 1 125 125 HIS HB3 H 1 3.31 0.03 . 2 . . . . . . . . 4915 1 1267 . 1 1 125 125 HIS HD2 H 1 7.26 0.03 . 1 . . . . . . . . 4915 1 1268 . 1 1 125 125 HIS C C 13 176.0 0.20 . 1 . . . . . . . . 4915 1 1269 . 1 1 126 126 GLN N N 15 119.6 0.25 . 1 . . . . . . . . 4915 1 1270 . 1 1 126 126 GLN H H 1 8.24 0.03 . 1 . . . . . . . . 4915 1 1271 . 1 1 126 126 GLN CA C 13 55.1 0.20 . 1 . . . . . . . . 4915 1 1272 . 1 1 126 126 GLN HA H 1 4.26 0.03 . 1 . . . . . . . . 4915 1 1273 . 1 1 126 126 GLN CB C 13 29.2 0.20 . 1 . . . . . . . . 4915 1 1274 . 1 1 126 126 GLN HB2 H 1 2.38 0.03 . 2 . . . . . . . . 4915 1 1275 . 1 1 126 126 GLN HB3 H 1 2.21 0.03 . 2 . . . . . . . . 4915 1 1276 . 1 1 126 126 GLN HG2 H 1 2.58 0.03 . 2 . . . . . . . . 4915 1 1277 . 1 1 126 126 GLN HG3 H 1 2.50 0.03 . 2 . . . . . . . . 4915 1 1278 . 1 1 126 126 GLN C C 13 176.9 0.20 . 1 . . . . . . . . 4915 1 1279 . 1 1 127 127 ALA N N 15 123.0 0.25 . 1 . . . . . . . . 4915 1 1280 . 1 1 127 127 ALA H H 1 8.27 0.03 . 1 . . . . . . . . 4915 1 1281 . 1 1 127 127 ALA CA C 13 53.0 0.20 . 1 . . . . . . . . 4915 1 1282 . 1 1 127 127 ALA HA H 1 4.31 0.03 . 1 . . . . . . . . 4915 1 1283 . 1 1 127 127 ALA CB C 13 17.8 0.20 . 1 . . . . . . . . 4915 1 1284 . 1 1 127 127 ALA HB1 H 1 1.53 0.03 . 1 . . . . . . . . 4915 1 1285 . 1 1 127 127 ALA HB2 H 1 1.53 0.03 . 1 . . . . . . . . 4915 1 1286 . 1 1 127 127 ALA HB3 H 1 1.53 0.03 . 1 . . . . . . . . 4915 1 1287 . 1 1 127 127 ALA C C 13 178.8 0.20 . 1 . . . . . . . . 4915 1 1288 . 1 1 128 128 LYS N N 15 119.8 0.25 . 1 . . . . . . . . 4915 1 1289 . 1 1 128 128 LYS H H 1 8.07 0.03 . 1 . . . . . . . . 4915 1 1290 . 1 1 128 128 LYS CA C 13 57.1 0.20 . 1 . . . . . . . . 4915 1 1291 . 1 1 128 128 LYS HA H 1 4.27 0.03 . 1 . . . . . . . . 4915 1 1292 . 1 1 128 128 LYS CB C 13 32.1 0.20 . 1 . . . . . . . . 4915 1 1293 . 1 1 128 128 LYS HB2 H 1 1.96 0.03 . 1 . . . . . . . . 4915 1 1294 . 1 1 128 128 LYS HB3 H 1 1.96 0.03 . 1 . . . . . . . . 4915 1 1295 . 1 1 128 128 LYS CG C 13 24.3 0.20 . 1 . . . . . . . . 4915 1 1296 . 1 1 128 128 LYS HG2 H 1 1.76 0.03 . 2 . . . . . . . . 4915 1 1297 . 1 1 128 128 LYS HG3 H 1 1.60 0.03 . 2 . . . . . . . . 4915 1 1298 . 1 1 128 128 LYS CD C 13 28.4 0.20 . 1 . . . . . . . . 4915 1 1299 . 1 1 128 128 LYS HD2 H 1 1.51 0.03 . 1 . . . . . . . . 4915 1 1300 . 1 1 128 128 LYS HD3 H 1 1.51 0.03 . 1 . . . . . . . . 4915 1 1301 . 1 1 128 128 LYS HE2 H 1 3.05 0.03 . 1 . . . . . . . . 4915 1 1302 . 1 1 128 128 LYS HE3 H 1 3.05 0.03 . 1 . . . . . . . . 4915 1 1303 . 1 1 128 128 LYS C C 13 177.6 0.20 . 1 . . . . . . . . 4915 1 1304 . 1 1 129 129 GLU N N 15 120.1 0.25 . 1 . . . . . . . . 4915 1 1305 . 1 1 129 129 GLU H H 1 8.25 0.03 . 1 . . . . . . . . 4915 1 1306 . 1 1 129 129 GLU CA C 13 57.0 0.20 . 1 . . . . . . . . 4915 1 1307 . 1 1 129 129 GLU HA H 1 4.21 0.03 . 1 . . . . . . . . 4915 1 1308 . 1 1 129 129 GLU CB C 13 29.1 0.20 . 1 . . . . . . . . 4915 1 1309 . 1 1 129 129 GLU HB2 H 1 2.08 0.03 . 1 . . . . . . . . 4915 1 1310 . 1 1 129 129 GLU HB3 H 1 2.08 0.03 . 1 . . . . . . . . 4915 1 1311 . 1 1 129 129 GLU CG C 13 35.5 0.20 . 1 . . . . . . . . 4915 1 1312 . 1 1 129 129 GLU HG2 H 1 2.37 0.03 . 2 . . . . . . . . 4915 1 1313 . 1 1 129 129 GLU HG3 H 1 2.30 0.03 . 2 . . . . . . . . 4915 1 1314 . 1 1 129 129 GLU C C 13 177.2 0.20 . 1 . . . . . . . . 4915 1 1315 . 1 1 130 130 ALA N N 15 122.8 0.25 . 1 . . . . . . . . 4915 1 1316 . 1 1 130 130 ALA H H 1 8.20 0.03 . 1 . . . . . . . . 4915 1 1317 . 1 1 130 130 ALA CA C 13 52.9 0.20 . 1 . . . . . . . . 4915 1 1318 . 1 1 130 130 ALA HA H 1 4.32 0.03 . 1 . . . . . . . . 4915 1 1319 . 1 1 130 130 ALA CB C 13 18.2 0.20 . 1 . . . . . . . . 4915 1 1320 . 1 1 130 130 ALA HB1 H 1 1.51 0.03 . 1 . . . . . . . . 4915 1 1321 . 1 1 130 130 ALA HB2 H 1 1.51 0.03 . 1 . . . . . . . . 4915 1 1322 . 1 1 130 130 ALA HB3 H 1 1.51 0.03 . 1 . . . . . . . . 4915 1 1323 . 1 1 130 130 ALA C C 13 178.1 0.20 . 1 . . . . . . . . 4915 1 1324 . 1 1 131 131 ALA N N 15 121.5 0.25 . 1 . . . . . . . . 4915 1 1325 . 1 1 131 131 ALA H H 1 8.05 0.03 . 1 . . . . . . . . 4915 1 1326 . 1 1 131 131 ALA CA C 13 52.7 0.20 . 1 . . . . . . . . 4915 1 1327 . 1 1 131 131 ALA HA H 1 4.33 0.03 . 1 . . . . . . . . 4915 1 1328 . 1 1 131 131 ALA CB C 13 18.2 0.20 . 1 . . . . . . . . 4915 1 1329 . 1 1 131 131 ALA HB1 H 1 1.53 0.03 . 1 . . . . . . . . 4915 1 1330 . 1 1 131 131 ALA HB2 H 1 1.53 0.03 . 1 . . . . . . . . 4915 1 1331 . 1 1 131 131 ALA HB3 H 1 1.53 0.03 . 1 . . . . . . . . 4915 1 1332 . 1 1 131 131 ALA C C 13 178.3 0.20 . 1 . . . . . . . . 4915 1 1333 . 1 1 132 132 GLN N N 15 118.0 0.25 . 1 . . . . . . . . 4915 1 1334 . 1 1 132 132 GLN H H 1 8.12 0.03 . 1 . . . . . . . . 4915 1 1335 . 1 1 132 132 GLN CA C 13 55.5 0.20 . 1 . . . . . . . . 4915 1 1336 . 1 1 132 132 GLN HA H 1 4.32 0.03 . 1 . . . . . . . . 4915 1 1337 . 1 1 132 132 GLN CB C 13 28.8 0.20 . 1 . . . . . . . . 4915 1 1338 . 1 1 132 132 GLN HB2 H 1 2.15 0.03 . 2 . . . . . . . . 4915 1 1339 . 1 1 132 132 GLN HB3 H 1 2.22 0.03 . 2 . . . . . . . . 4915 1 1340 . 1 1 132 132 GLN HG2 H 1 2.50 0.03 . 1 . . . . . . . . 4915 1 1341 . 1 1 132 132 GLN HG3 H 1 2.50 0.03 . 1 . . . . . . . . 4915 1 1342 . 1 1 132 132 GLN C C 13 176.2 0.20 . 1 . . . . . . . . 4915 1 1343 . 1 1 133 133 LYS N N 15 120.9 0.25 . 1 . . . . . . . . 4915 1 1344 . 1 1 133 133 LYS H H 1 8.15 0.03 . 1 . . . . . . . . 4915 1 1345 . 1 1 133 133 LYS CA C 13 56.1 0.20 . 1 . . . . . . . . 4915 1 1346 . 1 1 133 133 LYS HA H 1 4.33 0.03 . 1 . . . . . . . . 4915 1 1347 . 1 1 133 133 LYS CB C 13 32.2 0.20 . 1 . . . . . . . . 4915 1 1348 . 1 1 133 133 LYS HB2 H 1 1.93 0.03 . 2 . . . . . . . . 4915 1 1349 . 1 1 133 133 LYS HB3 H 1 1.88 0.03 . 2 . . . . . . . . 4915 1 1350 . 1 1 133 133 LYS CG C 13 24.3 0.20 . 1 . . . . . . . . 4915 1 1351 . 1 1 133 133 LYS HG2 H 1 1.56 0.03 . 2 . . . . . . . . 4915 1 1352 . 1 1 133 133 LYS HG3 H 1 1.51 0.03 . 2 . . . . . . . . 4915 1 1353 . 1 1 133 133 LYS CD C 13 28.4 0.20 . 1 . . . . . . . . 4915 1 1354 . 1 1 133 133 LYS HD2 H 1 1.77 0.03 . 1 . . . . . . . . 4915 1 1355 . 1 1 133 133 LYS HD3 H 1 1.77 0.03 . 1 . . . . . . . . 4915 1 1356 . 1 1 133 133 LYS HE2 H 1 3.07 0.03 . 1 . . . . . . . . 4915 1 1357 . 1 1 133 133 LYS HE3 H 1 3.07 0.03 . 1 . . . . . . . . 4915 1 1358 . 1 1 133 133 LYS C C 13 176.2 0.20 . 1 . . . . . . . . 4915 1 1359 . 1 1 134 134 ALA N N 15 124.0 0.25 . 1 . . . . . . . . 4915 1 1360 . 1 1 134 134 ALA H H 1 8.17 0.03 . 1 . . . . . . . . 4915 1 1361 . 1 1 134 134 ALA CA C 13 52.0 0.20 . 1 . . . . . . . . 4915 1 1362 . 1 1 134 134 ALA HA H 1 4.40 0.03 . 1 . . . . . . . . 4915 1 1363 . 1 1 134 134 ALA CB C 13 18.5 0.20 . 1 . . . . . . . . 4915 1 1364 . 1 1 134 134 ALA HB1 H 1 1.49 0.03 . 1 . . . . . . . . 4915 1 1365 . 1 1 134 134 ALA HB2 H 1 1.49 0.03 . 1 . . . . . . . . 4915 1 1366 . 1 1 134 134 ALA HB3 H 1 1.49 0.03 . 1 . . . . . . . . 4915 1 1367 . 1 1 134 134 ALA C C 13 177.6 0.20 . 1 . . . . . . . . 4915 1 1368 . 1 1 135 135 VAL N N 15 118.6 0.25 . 1 . . . . . . . . 4915 1 1369 . 1 1 135 135 VAL H H 1 8.07 0.03 . 1 . . . . . . . . 4915 1 1370 . 1 1 135 135 VAL CA C 13 62.0 0.20 . 1 . . . . . . . . 4915 1 1371 . 1 1 135 135 VAL HA H 1 4.14 0.03 . 1 . . . . . . . . 4915 1 1372 . 1 1 135 135 VAL CB C 13 32.1 0.20 . 1 . . . . . . . . 4915 1 1373 . 1 1 135 135 VAL HB H 1 2.16 0.03 . 1 . . . . . . . . 4915 1 1374 . 1 1 135 135 VAL CG1 C 13 20.1 0.20 . 1 . . . . . . . . 4915 1 1375 . 1 1 135 135 VAL HG11 H 1 1.02 0.03 . 1 . . . . . . . . 4915 1 1376 . 1 1 135 135 VAL HG12 H 1 1.02 0.03 . 1 . . . . . . . . 4915 1 1377 . 1 1 135 135 VAL HG13 H 1 1.02 0.03 . 1 . . . . . . . . 4915 1 1378 . 1 1 135 135 VAL CG2 C 13 20.1 0.20 . 1 . . . . . . . . 4915 1 1379 . 1 1 135 135 VAL HG21 H 1 1.02 0.03 . 1 . . . . . . . . 4915 1 1380 . 1 1 135 135 VAL HG22 H 1 1.02 0.03 . 1 . . . . . . . . 4915 1 1381 . 1 1 135 135 VAL HG23 H 1 1.02 0.03 . 1 . . . . . . . . 4915 1 1382 . 1 1 135 135 VAL C C 13 175.8 0.20 . 1 . . . . . . . . 4915 1 1383 . 1 1 136 136 ASN N N 15 121.7 0.25 . 1 . . . . . . . . 4915 1 1384 . 1 1 136 136 ASN H H 1 8.48 0.03 . 1 . . . . . . . . 4915 1 1385 . 1 1 136 136 ASN CA C 13 52.7 0.20 . 1 . . . . . . . . 4915 1 1386 . 1 1 136 136 ASN HA H 1 4.82 0.03 . 1 . . . . . . . . 4915 1 1387 . 1 1 136 136 ASN CB C 13 38.4 0.20 . 1 . . . . . . . . 4915 1 1388 . 1 1 136 136 ASN HB2 H 1 2.96 0.03 . 2 . . . . . . . . 4915 1 1389 . 1 1 136 136 ASN HB3 H 1 2.87 0.03 . 2 . . . . . . . . 4915 1 1390 . 1 1 136 136 ASN C C 13 175.0 0.20 . 1 . . . . . . . . 4915 1 1391 . 1 1 137 137 SER N N 15 116.3 0.25 . 1 . . . . . . . . 4915 1 1392 . 1 1 137 137 SER H H 1 8.35 0.03 . 1 . . . . . . . . 4915 1 1393 . 1 1 137 137 SER CA C 13 57.9 0.20 . 1 . . . . . . . . 4915 1 1394 . 1 1 137 137 SER HA H 1 4.50 0.03 . 1 . . . . . . . . 4915 1 1395 . 1 1 137 137 SER CB C 13 63.3 0.20 . 1 . . . . . . . . 4915 1 1396 . 1 1 137 137 SER HB2 H 1 4.00 0.03 . 2 . . . . . . . . 4915 1 1397 . 1 1 137 137 SER HB3 H 1 3.96 0.03 . 2 . . . . . . . . 4915 1 1398 . 1 1 137 137 SER C C 13 174.1 0.20 . 1 . . . . . . . . 4915 1 1399 . 1 1 138 138 ALA N N 15 125.5 0.25 . 1 . . . . . . . . 4915 1 1400 . 1 1 138 138 ALA H H 1 8.43 0.03 . 1 . . . . . . . . 4915 1 1401 . 1 1 138 138 ALA CA C 13 52.2 0.20 . 1 . . . . . . . . 4915 1 1402 . 1 1 138 138 ALA HA H 1 4.49 0.03 . 1 . . . . . . . . 4915 1 1403 . 1 1 138 138 ALA CB C 13 18.6 0.20 . 1 . . . . . . . . 4915 1 1404 . 1 1 138 138 ALA HB1 H 1 1.51 0.03 . 1 . . . . . . . . 4915 1 1405 . 1 1 138 138 ALA HB2 H 1 1.51 0.03 . 1 . . . . . . . . 4915 1 1406 . 1 1 138 138 ALA HB3 H 1 1.51 0.03 . 1 . . . . . . . . 4915 1 1407 . 1 1 138 138 ALA C C 13 177.7 0.20 . 1 . . . . . . . . 4915 1 1408 . 1 1 139 139 THR N N 15 111.5 0.25 . 1 . . . . . . . . 4915 1 1409 . 1 1 139 139 THR H H 1 8.11 0.03 . 1 . . . . . . . . 4915 1 1410 . 1 1 139 139 THR CA C 13 61.3 0.20 . 1 . . . . . . . . 4915 1 1411 . 1 1 139 139 THR HA H 1 4.43 0.03 . 1 . . . . . . . . 4915 1 1412 . 1 1 139 139 THR CB C 13 69.1 0.20 . 1 . . . . . . . . 4915 1 1413 . 1 1 139 139 THR HB H 1 4.37 0.03 . 1 . . . . . . . . 4915 1 1414 . 1 1 139 139 THR CG2 C 13 21.2 0.20 . 1 . . . . . . . . 4915 1 1415 . 1 1 139 139 THR HG21 H 1 1.30 0.03 . 1 . . . . . . . . 4915 1 1416 . 1 1 139 139 THR HG22 H 1 1.30 0.03 . 1 . . . . . . . . 4915 1 1417 . 1 1 139 139 THR HG23 H 1 1.30 0.03 . 1 . . . . . . . . 4915 1 1418 . 1 1 139 139 THR C C 13 174.9 0.20 . 1 . . . . . . . . 4915 1 1419 . 1 1 140 140 GLY N N 15 110.8 0.25 . 1 . . . . . . . . 4915 1 1420 . 1 1 140 140 GLY H H 1 8.37 0.03 . 1 . . . . . . . . 4915 1 1421 . 1 1 140 140 GLY CA C 13 44.6 0.20 . 1 . . . . . . . . 4915 1 1422 . 1 1 140 140 GLY HA2 H 1 4.07 0.03 . 2 . . . . . . . . 4915 1 1423 . 1 1 140 140 GLY HA3 H 1 4.03 0.03 . 2 . . . . . . . . 4915 1 1424 . 1 1 140 140 GLY C C 13 173.4 0.20 . 1 . . . . . . . . 4915 1 1425 . 1 1 141 141 VAL N N 15 120.3 0.25 . 1 . . . . . . . . 4915 1 1426 . 1 1 141 141 VAL H H 1 8.00 0.03 . 1 . . . . . . . . 4915 1 1427 . 1 1 141 141 VAL CA C 13 57.9 0.20 . 1 . . . . . . . . 4915 1 1428 . 1 1 141 141 VAL HA H 1 4.53 0.03 . 1 . . . . . . . . 4915 1 1429 . 1 1 141 141 VAL HB H 1 2.16 0.03 . 1 . . . . . . . . 4915 1 1430 . 1 1 141 141 VAL HG11 H 1 1.07 0.03 . 2 . . . . . . . . 4915 1 1431 . 1 1 141 141 VAL HG12 H 1 1.07 0.03 . 2 . . . . . . . . 4915 1 1432 . 1 1 141 141 VAL HG13 H 1 1.07 0.03 . 2 . . . . . . . . 4915 1 1433 . 1 1 141 141 VAL HG21 H 1 0.99 0.03 . 2 . . . . . . . . 4915 1 1434 . 1 1 141 141 VAL HG22 H 1 0.99 0.03 . 2 . . . . . . . . 4915 1 1435 . 1 1 141 141 VAL HG23 H 1 0.99 0.03 . 2 . . . . . . . . 4915 1 1436 . 1 1 141 141 VAL C C 13 174.2 0.20 . 1 . . . . . . . . 4915 1 1437 . 1 1 142 142 PRO CD C 13 50.1 0.20 . 1 . . . . . . . . 4915 1 1438 . 1 1 142 142 PRO CA C 13 62.6 0.20 . 1 . . . . . . . . 4915 1 1439 . 1 1 142 142 PRO CB C 13 31.6 0.20 . 1 . . . . . . . . 4915 1 1440 . 1 1 142 142 PRO CG C 13 26.4 0.20 . 1 . . . . . . . . 4915 1 1441 . 1 1 142 142 PRO C C 13 176.6 0.20 . 1 . . . . . . . . 4915 1 1442 . 1 1 143 143 THR N N 15 115.3 0.25 . 1 . . . . . . . . 4915 1 1443 . 1 1 143 143 THR H H 1 8.38 0.03 . 1 . . . . . . . . 4915 1 1444 . 1 1 143 143 THR CA C 13 61.2 0.20 . 1 . . . . . . . . 4915 1 1445 . 1 1 143 143 THR HA H 1 4.42 0.03 . 1 . . . . . . . . 4915 1 1446 . 1 1 143 143 THR CB C 13 69.3 0.20 . 1 . . . . . . . . 4915 1 1447 . 1 1 143 143 THR HB H 1 4.30 0.03 . 1 . . . . . . . . 4915 1 1448 . 1 1 143 143 THR CG2 C 13 21.2 0.20 . 1 . . . . . . . . 4915 1 1449 . 1 1 143 143 THR HG21 H 1 1.32 0.03 . 1 . . . . . . . . 4915 1 1450 . 1 1 143 143 THR HG22 H 1 1.32 0.03 . 1 . . . . . . . . 4915 1 1451 . 1 1 143 143 THR HG23 H 1 1.32 0.03 . 1 . . . . . . . . 4915 1 1452 . 1 1 143 143 THR C C 13 173.5 0.20 . 1 . . . . . . . . 4915 1 1453 . 1 1 144 144 VAL N N 15 125.9 0.25 . 1 . . . . . . . . 4915 1 1454 . 1 1 144 144 VAL H H 1 7.79 0.03 . 1 . . . . . . . . 4915 1 1455 . 1 1 144 144 VAL HA H 1 4.14 0.03 . 1 . . . . . . . . 4915 1 1456 . 1 1 144 144 VAL HB H 1 2.15 0.03 . 1 . . . . . . . . 4915 1 1457 . 1 1 144 144 VAL HG11 H 1 0.97 0.03 . 1 . . . . . . . . 4915 1 1458 . 1 1 144 144 VAL HG12 H 1 0.97 0.03 . 1 . . . . . . . . 4915 1 1459 . 1 1 144 144 VAL HG13 H 1 0.97 0.03 . 1 . . . . . . . . 4915 1 1460 . 1 1 144 144 VAL HG21 H 1 0.97 0.03 . 1 . . . . . . . . 4915 1 1461 . 1 1 144 144 VAL HG22 H 1 0.97 0.03 . 1 . . . . . . . . 4915 1 1462 . 1 1 144 144 VAL HG23 H 1 0.97 0.03 . 1 . . . . . . . . 4915 1 1463 . 1 1 144 144 VAL C C 13 180.5 0.20 . 1 . . . . . . . . 4915 1 stop_ save_ ######################## # Coupling constants # ######################## save_J_values _Coupling_constant_list.Sf_category coupling_constants _Coupling_constant_list.Sf_framecode J_values _Coupling_constant_list.Entry_ID 4915 _Coupling_constant_list.ID 1 _Coupling_constant_list.Sample_condition_list_ID 1 _Coupling_constant_list.Sample_condition_list_label $sample_cond_1 _Coupling_constant_list.Spectrometer_frequency_1H . _Coupling_constant_list.Details . _Coupling_constant_list.Text_data_format . _Coupling_constant_list.Text_data . loop_ _Coupling_constant_experiment.Experiment_ID _Coupling_constant_experiment.Experiment_name _Coupling_constant_experiment.Sample_ID _Coupling_constant_experiment.Sample_label _Coupling_constant_experiment.Sample_state _Coupling_constant_experiment.Entry_ID _Coupling_constant_experiment.Coupling_constant_list_ID . . 1 $sample_1 . 4915 1 stop_ loop_ _Coupling_constant.ID _Coupling_constant.Code _Coupling_constant.Assembly_atom_ID_1 _Coupling_constant.Entity_assembly_ID_1 _Coupling_constant.Entity_ID_1 _Coupling_constant.Comp_index_ID_1 _Coupling_constant.Seq_ID_1 _Coupling_constant.Comp_ID_1 _Coupling_constant.Atom_ID_1 _Coupling_constant.Atom_type_1 _Coupling_constant.Atom_isotope_number_1 _Coupling_constant.Ambiguity_code_1 _Coupling_constant.Assembly_atom_ID_2 _Coupling_constant.Entity_assembly_ID_2 _Coupling_constant.Entity_ID_2 _Coupling_constant.Comp_index_ID_2 _Coupling_constant.Seq_ID_2 _Coupling_constant.Comp_ID_2 _Coupling_constant.Atom_ID_2 _Coupling_constant.Atom_type_2 _Coupling_constant.Atom_isotope_number_2 _Coupling_constant.Ambiguity_code_2 _Coupling_constant.Val _Coupling_constant.Val_min _Coupling_constant.Val_max _Coupling_constant.Val_err _Coupling_constant.Resonance_ID_1 _Coupling_constant.Resonance_ID_2 _Coupling_constant.Auth_entity_assembly_ID_1 _Coupling_constant.Auth_seq_ID_1 _Coupling_constant.Auth_comp_ID_1 _Coupling_constant.Auth_atom_ID_1 _Coupling_constant.Auth_entity_assembly_ID_2 _Coupling_constant.Auth_seq_ID_2 _Coupling_constant.Auth_comp_ID_2 _Coupling_constant.Auth_atom_ID_2 _Coupling_constant.Details _Coupling_constant.Entry_ID _Coupling_constant.Coupling_constant_list_ID 1 3JHNHA . 1 1 3 3 LEU HA . . . . 1 1 3 3 LEU H . . . 7.1 7.05 7.1 . . . . . . . . . . . . 4915 1 2 3JHNHA . 1 1 4 4 GLY HA . . . . 1 1 4 4 GLY H . . . 7.8 7.8 7.86 . . . . . . . . . . . . 4915 1 3 3JHNHA . 1 1 5 5 SER HA . . . . 1 1 5 5 SER H . . . 7.9 7.86 7.91 . . . . . . . . . . . . 4915 1 4 3JHNHA . 1 1 12 12 ALA HA . . . . 1 1 12 12 ALA H . . . 7.1 6.88 7.39 . . . . . . . . . . . . 4915 1 5 3JHNHA . 1 1 13 13 VAL HA . . . . 1 1 13 13 VAL H . . . 7.9 7.9 7.99 . . . . . . . . . . . . 4915 1 6 3JHNHA . 1 1 14 14 ARG HA . . . . 1 1 14 14 ARG H . . . 7.1 7.04 7.08 . . . . . . . . . . . . 4915 1 7 3JHNHA . 1 1 15 15 THR HA . . . . 1 1 15 15 THR H . . . 8.3 8.33 8.37 . . . . . . . . . . . . 4915 1 8 3JHNHA . 1 1 16 16 VAL HA . . . . 1 1 16 16 VAL H . . . 8.7 8.69 8.79 . . . . . . . . . . . . 4915 1 9 3JHNHA . 1 1 18 18 GLN HA . . . . 1 1 18 18 GLN H . . . 7.2 7.25 7.18 . . . . . . . . . . . . 4915 1 10 3JHNHA . 1 1 19 19 TYR HA . . . . 1 1 19 19 TYR H . . . 4.4 4.42 4.41 . . . . . . . . . . . . 4915 1 11 3JHNHA . 1 1 20 20 LYS HA . . . . 1 1 20 20 LYS H . . . 7.4 7.5 7.28 . . . . . . . . . . . . 4915 1 12 3JHNHA . 1 1 21 21 TYR HA . . . . 1 1 21 21 TYR H . . . 6.3 6.29 6.3 . . . . . . . . . . . . 4915 1 13 3JHNHA . 1 1 22 22 ALA HA . . . . 1 1 22 22 ALA H . . . 6.7 6.67 6.71 . . . . . . . . . . . . 4915 1 14 3JHNHA . 1 1 23 23 ALA HA . . . . 1 1 23 23 ALA H . . . 5.8 5.56 5.98 . . . . . . . . . . . . 4915 1 15 3JHNHA . 1 1 24 24 GLY HA . . . . 1 1 24 24 GLY H . . . 7.8 7.79 7.91 . . . . . . . . . . . . 4915 1 16 3JHNHA . 1 1 25 25 VAL HA . . . . 1 1 25 25 VAL H . . . 8.3 8.24 8.3 . . . . . . . . . . . . 4915 1 17 3JHNHA . 1 1 26 26 ARG HA . . . . 1 1 26 26 ARG H . . . 6.9 6.91 6.89 . . . . . . . . . . . . 4915 1 18 3JHNHA . 1 1 27 27 ASN HA . . . . 1 1 27 27 ASN H . . . 7.1 7.12 7.13 . . . . . . . . . . . . 4915 1 19 3JHNHA . 1 1 29 29 GLN HA . . . . 1 1 29 29 GLN H . . . 7.1 7.06 7.05 . . . . . . . . . . . . 4915 1 20 3JHNHA . 1 1 30 30 GLN HA . . . . 1 1 30 30 GLN H . . . 7.1 7 7.19 . . . . . . . . . . . . 4915 1 21 3JHNHA . 1 1 32 32 LEU HA . . . . 1 1 32 32 LEU H . . . 7.0 6.98 7.1 . . . . . . . . . . . . 4915 1 22 3JHNHA . 1 1 33 33 ASN HA . . . . 1 1 33 33 ASN H . . . 7.9 7.93 7.94 . . . . . . . . . . . . 4915 1 23 3JHNHA . 1 1 34 34 ALA HA . . . . 1 1 34 34 ALA H . . . 6.4 6.38 6.46 . . . . . . . . . . . . 4915 1 24 3JHNHA . 1 1 35 35 GLN HA . . . . 1 1 35 35 GLN H . . . 7.8 7.76 7.79 . . . . . . . . . . . . 4915 1 25 3JHNHA . 1 1 37 37 GLN HA . . . . 1 1 37 37 GLN H . . . 7.3 7.25 7.3 . . . . . . . . . . . . 4915 1 26 3JHNHA . 1 1 38 38 VAL HA . . . . 1 1 38 38 VAL H . . . 7.7 7.75 7.57 . . . . . . . . . . . . 4915 1 27 3JHNHA . 1 1 39 39 THR HA . . . . 1 1 39 39 THR H . . . 8.2 8.16 8.19 . . . . . . . . . . . . 4915 1 28 3JHNHA . 1 1 40 40 MET HA . . . . 1 1 40 40 MET H . . . 7.5 7.42 7.56 . . . . . . . . . . . . 4915 1 29 3JHNHA . 1 1 44 44 ALA HA . . . . 1 1 44 44 ALA H . . . 5.9 5.86 5.87 . . . . . . . . . . . . 4915 1 30 3JHNHA . 1 1 45 45 VAL HA . . . . 1 1 45 45 VAL H . . . 7.8 7.72 7.79 . . . . . . . . . . . . 4915 1 31 3JHNHA . 1 1 46 46 HIS HA . . . . 1 1 46 46 HIS H . . . 8.2 8.18 8.19 . . . . . . . . . . . . 4915 1 32 3JHNHA . 1 1 47 47 VAL HA . . . . 1 1 47 47 VAL H . . . 8.4 8.37 8.36 . . . . . . . . . . . . 4915 1 33 3JHNHA . 1 1 48 48 GLN HA . . . . 1 1 48 48 GLN H . . . 6.9 6.87 6.89 . . . . . . . . . . . . 4915 1 34 3JHNHA . 1 1 49 49 GLY HA . . . . 1 1 49 49 GLY H . . . 7.4 7.31 7.51 . . . . . . . . . . . . 4915 1 35 3JHNHA . 1 1 50 50 GLN HA . . . . 1 1 50 50 GLN H . . . 8.6 8.55 8.65 . . . . . . . . . . . . 4915 1 36 3JHNHA . 1 1 51 51 GLU HA . . . . 1 1 51 51 GLU H . . . 6.0 5.91 6.02 . . . . . . . . . . . . 4915 1 37 3JHNHA . 1 1 53 53 LEU HA . . . . 1 1 53 53 LEU H . . . 7.0 6.98 7.1 . . . . . . . . . . . . 4915 1 38 3JHNHA . 1 1 55 55 ALA HA . . . . 1 1 55 55 ALA H . . . 2.8 2.75 2.78 . . . . . . . . . . . . 4915 1 39 3JHNHA . 1 1 56 56 SER HA . . . . 1 1 56 56 SER H . . . 4.3 4.5 4.16 . . . . . . . . . . . . 4915 1 40 3JHNHA . 1 1 57 57 MET HA . . . . 1 1 57 57 MET H . . . 5.6 5.61 5.68 . . . . . . . . . . . . 4915 1 41 3JHNHA . 1 1 58 58 LEU HA . . . . 1 1 58 58 LEU H . . . 5.3 5.23 5.44 . . . . . . . . . . . . 4915 1 42 3JHNHA . 1 1 59 59 ALA HA . . . . 1 1 59 59 ALA H . . . 3.5 3.47 3.59 . . . . . . . . . . . . 4915 1 43 3JHNHA . 1 1 60 60 SER HA . . . . 1 1 60 60 SER H . . . 6.8 6.5 7.18 . . . . . . . . . . . . 4915 1 44 3JHNHA . 1 1 61 61 ALA HA . . . . 1 1 61 61 ALA H . . . 7.8 7.71 7.89 . . . . . . . . . . . . 4915 1 45 3JHNHA . 1 1 65 65 GLU HA . . . . 1 1 65 65 GLU H . . . 7.8 7.94 7.75 . . . . . . . . . . . . 4915 1 46 3JHNHA . 1 1 69 69 MET HA . . . . 1 1 69 69 MET H . . . 4.0 3.73 4.34 . . . . . . . . . . . . 4915 1 47 3JHNHA . 1 1 70 70 LEU HA . . . . 1 1 70 70 LEU H . . . 5.7 5.86 5.5 . . . . . . . . . . . . 4915 1 48 3JHNHA . 1 1 73 73 ARG HA . . . . 1 1 73 73 ARG H . . . 8.4 8.27 8.52 . . . . . . . . . . . . 4915 1 49 3JHNHA . 1 1 74 74 LEU HA . . . . 1 1 74 74 LEU H . . . 4.3 4.5 4.16 . . . . . . . . . . . . 4915 1 50 3JHNHA . 1 1 77 77 LEU HA . . . . 1 1 77 77 LEU H . . . 6.9 7 6.81 . . . . . . . . . . . . 4915 1 51 3JHNHA . 1 1 78 78 ILE HA . . . . 1 1 78 78 ILE H . . . 5.9 5.85 5.88 . . . . . . . . . . . . 4915 1 52 3JHNHA . 1 1 79 79 GLN HA . . . . 1 1 79 79 GLN H . . . 3.0 2.77 3.31 . . . . . . . . . . . . 4915 1 53 3JHNHA . 1 1 80 80 ALA HA . . . . 1 1 80 80 ALA H . . . 5.1 5 5.19 . . . . . . . . . . . . 4915 1 54 3JHNHA . 1 1 88 88 LYS HA . . . . 1 1 88 88 LYS H . . . 5.0 4.9 5.07 . . . . . . . . . . . . 4915 1 55 3JHNHA . 1 1 89 89 ILE HA . . . . 1 1 89 89 ILE H . . . 4.5 4.52 4.48 . . . . . . . . . . . . 4915 1 56 3JHNHA . 1 1 90 90 THR HA . . . . 1 1 90 90 THR H . . . 3.3 3.06 3.56 . . . . . . . . . . . . 4915 1 57 3JHNHA . 1 1 91 91 GLY HA . . . . 1 1 91 91 GLY H . . . 3.7 3.24 4.12 . . . . . . . . . . . . 4915 1 58 3JHNHA . 1 1 92 92 MET HA . . . . 1 1 92 92 MET H . . . 5.5 5.38 5.69 . . . . . . . . . . . . 4915 1 59 3JHNHA . 1 1 94 94 LEU HA . . . . 1 1 94 94 LEU H . . . 3.8 3.63 3.89 . . . . . . . . . . . . 4915 1 60 3JHNHA . 1 1 95 95 GLU HA . . . . 1 1 95 95 GLU H . . . 6.2 6.1 6.28 . . . . . . . . . . . . 4915 1 61 3JHNHA . 1 1 96 96 ILE HA . . . . 1 1 96 96 ILE H . . . 6.4 6.39 6.45 . . . . . . . . . . . . 4915 1 62 3JHNHA . 1 1 97 97 ASP HA . . . . 1 1 97 97 ASP H . . . 2.4 2.34 2.53 . . . . . . . . . . . . 4915 1 63 3JHNHA . 1 1 99 99 SER HA . . . . 1 1 99 99 SER H . . . 4.6 4.51 4.62 . . . . . . . . . . . . 4915 1 64 3JHNHA . 1 1 100 100 GLU HA . . . . 1 1 100 100 GLU H . . . 6.9 6.86 6.98 . . . . . . . . . . . . 4915 1 65 3JHNHA . 1 1 101 101 LEU HA . . . . 1 1 101 101 LEU H . . . 3.9 3.87 3.99 . . . . . . . . . . . . 4915 1 66 3JHNHA . 1 1 103 103 HIS HA . . . . 1 1 103 103 HIS H . . . 4.9 4.79 5.04 . . . . . . . . . . . . 4915 1 67 3JHNHA . 1 1 104 104 MET HA . . . . 1 1 104 104 MET H . . . 4.5 4.59 4.52 . . . . . . . . . . . . 4915 1 68 3JHNHA . 1 1 105 105 LEU HA . . . . 1 1 105 105 LEU H . . . 5.4 5.32 5.52 . . . . . . . . . . . . 4915 1 69 3JHNHA . 1 1 106 106 GLU HA . . . . 1 1 106 106 GLU H . . . 8.4 8.35 8.36 . . . . . . . . . . . . 4915 1 70 3JHNHA . 1 1 107 107 SER HA . . . . 1 1 107 107 SER H . . . 8.8 8.63 8.89 . . . . . . . . . . . . 4915 1 71 3JHNHA . 1 1 110 110 SER HA . . . . 1 1 110 110 SER H . . . 6.4 6.36 6.43 . . . . . . . . . . . . 4915 1 72 3JHNHA . 1 1 111 111 LEU HA . . . . 1 1 111 111 LEU H . . . 4.3 4.08 4.65 . . . . . . . . . . . . 4915 1 73 3JHNHA . 1 1 113 113 SER HA . . . . 1 1 113 113 SER H . . . 3.7 3.59 3.81 . . . . . . . . . . . . 4915 1 74 3JHNHA . 1 1 114 114 LYS HA . . . . 1 1 114 114 LYS H . . . 4.4 4.36 4.38 . . . . . . . . . . . . 4915 1 75 3JHNHA . 1 1 115 115 VAL HA . . . . 1 1 115 115 VAL H . . . 4.7 4.68 4.79 . . . . . . . . . . . . 4915 1 76 3JHNHA . 1 1 116 116 ASP HA . . . . 1 1 116 116 ASP H . . . 3.4 3.35 3.45 . . . . . . . . . . . . 4915 1 77 3JHNHA . 1 1 117 117 GLU HA . . . . 1 1 117 117 GLU H . . . 4.6 4.38 4.75 . . . . . . . . . . . . 4915 1 78 3JHNHA . 1 1 118 118 ALA HA . . . . 1 1 118 118 ALA H . . . 4.8 4.74 4.84 . . . . . . . . . . . . 4915 1 79 3JHNHA . 1 1 119 119 VAL HA . . . . 1 1 119 119 VAL H . . . 3.5 3.3 3.64 . . . . . . . . . . . . 4915 1 80 3JHNHA . 1 1 120 120 ALA HA . . . . 1 1 120 120 ALA H . . . 4.9 4.54 5.26 . . . . . . . . . . . . 4915 1 81 3JHNHA . 1 1 121 121 VAL HA . . . . 1 1 121 121 VAL H . . . 5.4 5.38 5.46 . . . . . . . . . . . . 4915 1 82 3JHNHA . 1 1 122 122 LEU HA . . . . 1 1 122 122 LEU H . . . 4.1 4.15 4.14 . . . . . . . . . . . . 4915 1 83 3JHNHA . 1 1 123 123 GLN HA . . . . 1 1 123 123 GLN H . . . 5.4 5.37 5.33 . . . . . . . . . . . . 4915 1 84 3JHNHA . 1 1 124 124 ALA HA . . . . 1 1 124 124 ALA H . . . 5.6 5.61 5.68 . . . . . . . . . . . . 4915 1 85 3JHNHA . 1 1 126 126 GLN HA . . . . 1 1 126 126 GLN H . . . 5.5 4.95 6.05 . . . . . . . . . . . . 4915 1 86 3JHNHA . 1 1 127 127 ALA HA . . . . 1 1 127 127 ALA H . . . 6.5 6.48 6.51 . . . . . . . . . . . . 4915 1 87 3JHNHA . 1 1 128 128 LYS HA . . . . 1 1 128 128 LYS H . . . 6.6 6.57 6.62 . . . . . . . . . . . . 4915 1 88 3JHNHA . 1 1 129 129 GLU HA . . . . 1 1 129 129 GLU H . . . 5.5 5.32 5.61 . . . . . . . . . . . . 4915 1 89 3JHNHA . 1 1 130 130 ALA HA . . . . 1 1 130 130 ALA H . . . 5.6 5.03 6.31 . . . . . . . . . . . . 4915 1 90 3JHNHA . 1 1 131 131 ALA HA . . . . 1 1 131 131 ALA H . . . 6.0 6 6.08 . . . . . . . . . . . . 4915 1 91 3JHNHA . 1 1 132 132 GLN HA . . . . 1 1 132 132 GLN H . . . 6.9 6.97 6.87 . . . . . . . . . . . . 4915 1 92 3JHNHA . 1 1 133 133 LYS HA . . . . 1 1 133 133 LYS H . . . 5.8 5.85 5.75 . . . . . . . . . . . . 4915 1 93 3JHNHA . 1 1 134 134 ALA HA . . . . 1 1 134 134 ALA H . . . 6.4 6.39 6.41 . . . . . . . . . . . . 4915 1 94 3JHNHA . 1 1 135 135 VAL HA . . . . 1 1 135 135 VAL H . . . 7.6 7.56 7.59 . . . . . . . . . . . . 4915 1 95 3JHNHA . 1 1 136 136 ASN HA . . . . 1 1 136 136 ASN H . . . 6.2 6.21 6.26 . . . . . . . . . . . . 4915 1 96 3JHNHA . 1 1 137 137 SER HA . . . . 1 1 137 137 SER H . . . 7.5 7.34 7.67 . . . . . . . . . . . . 4915 1 97 3JHNHA . 1 1 138 138 ALA HA . . . . 1 1 138 138 ALA H . . . 5.9 5.62 6.15 . . . . . . . . . . . . 4915 1 98 3JHNHA . 1 1 139 139 THR HA . . . . 1 1 139 139 THR H . . . 8.8 8.79 8.77 . . . . . . . . . . . . 4915 1 99 3JHNHA . 1 1 140 140 GLY HA . . . . 1 1 140 140 GLY H . . . 7.9 7.88 7.87 . . . . . . . . . . . . 4915 1 100 3JHNHA . 1 1 141 141 VAL HA . . . . 1 1 141 141 VAL H . . . 7.3 7.54 7.07 . . . . . . . . . . . . 4915 1 101 3JHNHA . 1 1 143 143 THR HA . . . . 1 1 143 143 THR H . . . 7.9 7.85 7.86 . . . . . . . . . . . . 4915 1 stop_ save_