data_15702 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 15702 _Entry.Title ; Solution NMR Structure of Bordatella pertussis protein BP2786, a Mth938-like domain: Northeast Structural Genomics Consortium target BeR31 ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2008-04-01 _Entry.Accession_date 2008-04-01 _Entry.Last_release_date . _Entry.Original_release_date . _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 3.0.8.116 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.Entry_ID 1 John Cort . R. . 15702 2 Chi Ho . K. . 15702 3 Chioma Nwosu . . . 15702 4 Melissa Maglaqui . . . 15702 5 Rong Xiao . . . 15702 6 Jinfeng Liu . . . 15702 7 Michael Baran . C. . 15702 8 G.V.T. Swapna . . . 15702 9 Thomas Acton . B. . 15702 10 Burkhard Rost . . . 15702 11 Gaetano Montelione . T. . 15702 12 Michael Kennedy . A. . 15702 stop_ loop_ _SG_project.SG_project_ID _SG_project.Project_name _SG_project.Full_name_of_center _SG_project.Initial_of_center _SG_project.Entry_ID . 'PSI, Protein Structure Initiative' 'Northeast Structural Genomics Consortium' . 15702 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID COG03737 . 15702 'DUF 498' . 15702 'MTH938-like fold' . 15702 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 15702 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 532 15702 '15N chemical shifts' 132 15702 '1H chemical shifts' 839 15702 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 2 . . 2010-05-26 2008-04-01 update BMRB 'update entity name' 15702 1 . . 2009-10-12 2008-04-01 original author 'original release' 15702 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 2FVT 'similar protein / homologue' 15702 PDB 2GM2 'similar protein / homologue' 15702 PDB 2K2E 'BMRB Entry Tracking System' 15702 PDB 3CPK 'X-ray structure of this protein' 15702 stop_ save_ ############### # Citations # ############### save_citation_1 _Citation.Sf_category citations _Citation.Sf_framecode citation_1 _Citation.Entry_ID 15702 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID . _Citation.Full_citation . _Citation.Title 'Solution structure of Bordatella pertussis protein BP2786' _Citation.Status 'in preparation' _Citation.Type journal _Citation.Journal_abbrev 'Not known' _Citation.Journal_name_full . _Citation.Journal_volume . _Citation.Journal_issue . _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first . _Citation.Page_last . _Citation.Year . _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.Entry_ID _Citation_author.Citation_ID 1 John Cort . R. . 15702 1 2 Michael Kennedy . A. . 15702 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 15702 _Assembly.ID 1 _Assembly.Name BP2786 _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 BP2786 1 $entity A . yes native no no . . . 15702 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity _Entity.Sf_category entity _Entity.Sf_framecode entity _Entity.Entry_ID 15702 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name BP2786 _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID A _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; MKLHTDPATALNTVTAYGDG YIEVNQVRFSHAIAFAPEGP VASWPVQRPADITASLLQQA AGLAEVVRDPLAFLDEPEAG AGARPANAPEVLLVGTGRRQ HLLGPEQVRPLLAMGVGVEA MDTQAAARTYNILMAEGRRV VVALLPDGDSLEHHHHHH ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details 'contains C-terminal 6X His tag and linker: LEHHHHHH' _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 158 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method man _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 15800 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-11-26 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 no PDB 2K2E . "Solution Nmr Structure Of Bordetella Pertussis Protein Bp2786, A Mth938-Like Domain. Northeast Structural Genomics Consortium T" . . . . . 100.00 158 100.00 100.00 1.32e-107 . . . . 15702 1 2 no PDB 3CPK . "Crystal Structure Of The Q7w7n7_borpa Protein From Bordetella Parapertussis. Northeast Structural Genomics Consortium Target Be" . . . . . 94.30 150 97.99 97.99 1.23e-96 . . . . 15702 1 3 no DBJ BAO68551 . "hypothetical protein BBS798_1825 [Bordetella bronchiseptica]" . . . . . 94.94 150 100.00 100.00 1.21e-100 . . . . 15702 1 4 no EMBL CAE32421 . "conserved hypothetical protein [Bordetella bronchiseptica RB50]" . . . . . 94.94 150 99.33 100.00 5.07e-100 . . . . 15702 1 5 no EMBL CAE37772 . "conserved hypothetical protein [Bordetella parapertussis]" . . . . . 94.94 150 100.00 100.00 1.21e-100 . . . . 15702 1 6 no EMBL CAE43059 . "conserved hypothetical protein [Bordetella pertussis Tohama I]" . . . . . 94.94 150 100.00 100.00 1.21e-100 . . . . 15702 1 7 no EMBL CCJ49135 . "conserved hypothetical protein [Bordetella parapertussis Bpp5]" . . . . . 94.94 150 100.00 100.00 1.21e-100 . . . . 15702 1 8 no EMBL CCJ53508 . "conserved hypothetical protein [Bordetella bronchiseptica 253]" . . . . . 94.94 150 100.00 100.00 1.21e-100 . . . . 15702 1 9 no GB AEE67991 . "hypothetical protein BPTD_2739 [Bordetella pertussis CS]" . . . . . 94.94 150 100.00 100.00 1.21e-100 . . . . 15702 1 10 no GB AIW91535 . "hypothetical protein B1917_1068 [Bordetella pertussis B1917]" . . . . . 94.94 150 100.00 100.00 1.21e-100 . . . . 15702 1 11 no GB AIW96550 . "hypothetical protein B1920_2798 [Bordetella pertussis B1920]" . . . . . 94.94 150 100.00 100.00 1.21e-100 . . . . 15702 1 12 no GB AJB27175 . "hypothetical protein Q425_25920 [Bordetella pertussis 137]" . . . . . 94.94 150 100.00 100.00 1.21e-100 . . . . 15702 1 13 no GB ALH48586 . "hypothetical protein B1838_1070 [Bordetella pertussis]" . . . . . 94.94 150 100.00 100.00 1.21e-100 . . . . 15702 1 14 no REF NP_881386 . "hypothetical protein BP2786 [Bordetella pertussis Tohama I]" . . . . . 94.94 150 100.00 100.00 1.21e-100 . . . . 15702 1 15 no REF WP_003813077 . "MULTISPECIES: hypothetical protein [Bordetella]" . . . . . 94.94 150 100.00 100.00 1.21e-100 . . . . 15702 1 16 no REF WP_010926333 . "hypothetical protein [Bordetella bronchiseptica]" . . . . . 94.94 150 99.33 100.00 5.07e-100 . . . . 15702 1 17 no REF WP_033453456 . "hypothetical protein [Bordetella bronchiseptica]" . . . . . 94.94 150 99.33 100.00 3.73e-100 . . . . 15702 1 18 no REF WP_033462228 . "hypothetical protein [Bordetella bronchiseptica]" . . . . . 94.94 150 98.00 99.33 3.74e-99 . . . . 15702 1 stop_ loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 . MET . 15702 1 2 . LYS . 15702 1 3 . LEU . 15702 1 4 . HIS . 15702 1 5 . THR . 15702 1 6 . ASP . 15702 1 7 . PRO . 15702 1 8 . ALA . 15702 1 9 . THR . 15702 1 10 . ALA . 15702 1 11 . LEU . 15702 1 12 . ASN . 15702 1 13 . THR . 15702 1 14 . VAL . 15702 1 15 . THR . 15702 1 16 . ALA . 15702 1 17 . TYR . 15702 1 18 . GLY . 15702 1 19 . ASP . 15702 1 20 . GLY . 15702 1 21 . TYR . 15702 1 22 . ILE . 15702 1 23 . GLU . 15702 1 24 . VAL . 15702 1 25 . ASN . 15702 1 26 . GLN . 15702 1 27 . VAL . 15702 1 28 . ARG . 15702 1 29 . PHE . 15702 1 30 . SER . 15702 1 31 . HIS . 15702 1 32 . ALA . 15702 1 33 . ILE . 15702 1 34 . ALA . 15702 1 35 . PHE . 15702 1 36 . ALA . 15702 1 37 . PRO . 15702 1 38 . GLU . 15702 1 39 . GLY . 15702 1 40 . PRO . 15702 1 41 . VAL . 15702 1 42 . ALA . 15702 1 43 . SER . 15702 1 44 . TRP . 15702 1 45 . PRO . 15702 1 46 . VAL . 15702 1 47 . GLN . 15702 1 48 . ARG . 15702 1 49 . PRO . 15702 1 50 . ALA . 15702 1 51 . ASP . 15702 1 52 . ILE . 15702 1 53 . THR . 15702 1 54 . ALA . 15702 1 55 . SER . 15702 1 56 . LEU . 15702 1 57 . LEU . 15702 1 58 . GLN . 15702 1 59 . GLN . 15702 1 60 . ALA . 15702 1 61 . ALA . 15702 1 62 . GLY . 15702 1 63 . LEU . 15702 1 64 . ALA . 15702 1 65 . GLU . 15702 1 66 . VAL . 15702 1 67 . VAL . 15702 1 68 . ARG . 15702 1 69 . ASP . 15702 1 70 . PRO . 15702 1 71 . LEU . 15702 1 72 . ALA . 15702 1 73 . PHE . 15702 1 74 . LEU . 15702 1 75 . ASP . 15702 1 76 . GLU . 15702 1 77 . PRO . 15702 1 78 . GLU . 15702 1 79 . ALA . 15702 1 80 . GLY . 15702 1 81 . ALA . 15702 1 82 . GLY . 15702 1 83 . ALA . 15702 1 84 . ARG . 15702 1 85 . PRO . 15702 1 86 . ALA . 15702 1 87 . ASN . 15702 1 88 . ALA . 15702 1 89 . PRO . 15702 1 90 . GLU . 15702 1 91 . VAL . 15702 1 92 . LEU . 15702 1 93 . LEU . 15702 1 94 . VAL . 15702 1 95 . GLY . 15702 1 96 . THR . 15702 1 97 . GLY . 15702 1 98 . ARG . 15702 1 99 . ARG . 15702 1 100 . GLN . 15702 1 101 . HIS . 15702 1 102 . LEU . 15702 1 103 . LEU . 15702 1 104 . GLY . 15702 1 105 . PRO . 15702 1 106 . GLU . 15702 1 107 . GLN . 15702 1 108 . VAL . 15702 1 109 . ARG . 15702 1 110 . PRO . 15702 1 111 . LEU . 15702 1 112 . LEU . 15702 1 113 . ALA . 15702 1 114 . MET . 15702 1 115 . GLY . 15702 1 116 . VAL . 15702 1 117 . GLY . 15702 1 118 . VAL . 15702 1 119 . GLU . 15702 1 120 . ALA . 15702 1 121 . MET . 15702 1 122 . ASP . 15702 1 123 . THR . 15702 1 124 . GLN . 15702 1 125 . ALA . 15702 1 126 . ALA . 15702 1 127 . ALA . 15702 1 128 . ARG . 15702 1 129 . THR . 15702 1 130 . TYR . 15702 1 131 . ASN . 15702 1 132 . ILE . 15702 1 133 . LEU . 15702 1 134 . MET . 15702 1 135 . ALA . 15702 1 136 . GLU . 15702 1 137 . GLY . 15702 1 138 . ARG . 15702 1 139 . ARG . 15702 1 140 . VAL . 15702 1 141 . VAL . 15702 1 142 . VAL . 15702 1 143 . ALA . 15702 1 144 . LEU . 15702 1 145 . LEU . 15702 1 146 . PRO . 15702 1 147 . ASP . 15702 1 148 . GLY . 15702 1 149 . ASP . 15702 1 150 . SER . 15702 1 151 . LEU . 15702 1 152 . GLU . 15702 1 153 . HIS . 15702 1 154 . HIS . 15702 1 155 . HIS . 15702 1 156 . HIS . 15702 1 157 . HIS . 15702 1 158 . HIS . 15702 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . MET 1 1 15702 1 . LYS 2 2 15702 1 . LEU 3 3 15702 1 . HIS 4 4 15702 1 . THR 5 5 15702 1 . ASP 6 6 15702 1 . PRO 7 7 15702 1 . ALA 8 8 15702 1 . THR 9 9 15702 1 . ALA 10 10 15702 1 . LEU 11 11 15702 1 . ASN 12 12 15702 1 . THR 13 13 15702 1 . VAL 14 14 15702 1 . THR 15 15 15702 1 . ALA 16 16 15702 1 . TYR 17 17 15702 1 . GLY 18 18 15702 1 . ASP 19 19 15702 1 . GLY 20 20 15702 1 . TYR 21 21 15702 1 . ILE 22 22 15702 1 . GLU 23 23 15702 1 . VAL 24 24 15702 1 . ASN 25 25 15702 1 . GLN 26 26 15702 1 . VAL 27 27 15702 1 . ARG 28 28 15702 1 . PHE 29 29 15702 1 . SER 30 30 15702 1 . HIS 31 31 15702 1 . ALA 32 32 15702 1 . ILE 33 33 15702 1 . ALA 34 34 15702 1 . PHE 35 35 15702 1 . ALA 36 36 15702 1 . PRO 37 37 15702 1 . GLU 38 38 15702 1 . GLY 39 39 15702 1 . PRO 40 40 15702 1 . VAL 41 41 15702 1 . ALA 42 42 15702 1 . SER 43 43 15702 1 . TRP 44 44 15702 1 . PRO 45 45 15702 1 . VAL 46 46 15702 1 . GLN 47 47 15702 1 . ARG 48 48 15702 1 . PRO 49 49 15702 1 . ALA 50 50 15702 1 . ASP 51 51 15702 1 . ILE 52 52 15702 1 . THR 53 53 15702 1 . ALA 54 54 15702 1 . SER 55 55 15702 1 . LEU 56 56 15702 1 . LEU 57 57 15702 1 . GLN 58 58 15702 1 . GLN 59 59 15702 1 . ALA 60 60 15702 1 . ALA 61 61 15702 1 . GLY 62 62 15702 1 . LEU 63 63 15702 1 . ALA 64 64 15702 1 . GLU 65 65 15702 1 . VAL 66 66 15702 1 . VAL 67 67 15702 1 . ARG 68 68 15702 1 . ASP 69 69 15702 1 . PRO 70 70 15702 1 . LEU 71 71 15702 1 . ALA 72 72 15702 1 . PHE 73 73 15702 1 . LEU 74 74 15702 1 . ASP 75 75 15702 1 . GLU 76 76 15702 1 . PRO 77 77 15702 1 . GLU 78 78 15702 1 . ALA 79 79 15702 1 . GLY 80 80 15702 1 . ALA 81 81 15702 1 . GLY 82 82 15702 1 . ALA 83 83 15702 1 . ARG 84 84 15702 1 . PRO 85 85 15702 1 . ALA 86 86 15702 1 . ASN 87 87 15702 1 . ALA 88 88 15702 1 . PRO 89 89 15702 1 . GLU 90 90 15702 1 . VAL 91 91 15702 1 . LEU 92 92 15702 1 . LEU 93 93 15702 1 . VAL 94 94 15702 1 . GLY 95 95 15702 1 . THR 96 96 15702 1 . GLY 97 97 15702 1 . ARG 98 98 15702 1 . ARG 99 99 15702 1 . GLN 100 100 15702 1 . HIS 101 101 15702 1 . LEU 102 102 15702 1 . LEU 103 103 15702 1 . GLY 104 104 15702 1 . PRO 105 105 15702 1 . GLU 106 106 15702 1 . GLN 107 107 15702 1 . VAL 108 108 15702 1 . ARG 109 109 15702 1 . PRO 110 110 15702 1 . LEU 111 111 15702 1 . LEU 112 112 15702 1 . ALA 113 113 15702 1 . MET 114 114 15702 1 . GLY 115 115 15702 1 . VAL 116 116 15702 1 . GLY 117 117 15702 1 . VAL 118 118 15702 1 . GLU 119 119 15702 1 . ALA 120 120 15702 1 . MET 121 121 15702 1 . ASP 122 122 15702 1 . THR 123 123 15702 1 . GLN 124 124 15702 1 . ALA 125 125 15702 1 . ALA 126 126 15702 1 . ALA 127 127 15702 1 . ARG 128 128 15702 1 . THR 129 129 15702 1 . TYR 130 130 15702 1 . ASN 131 131 15702 1 . ILE 132 132 15702 1 . LEU 133 133 15702 1 . MET 134 134 15702 1 . ALA 135 135 15702 1 . GLU 136 136 15702 1 . GLY 137 137 15702 1 . ARG 138 138 15702 1 . ARG 139 139 15702 1 . VAL 140 140 15702 1 . VAL 141 141 15702 1 . VAL 142 142 15702 1 . ALA 143 143 15702 1 . LEU 144 144 15702 1 . LEU 145 145 15702 1 . PRO 146 146 15702 1 . ASP 147 147 15702 1 . GLY 148 148 15702 1 . ASP 149 149 15702 1 . SER 150 150 15702 1 . LEU 151 151 15702 1 . GLU 152 152 15702 1 . HIS 153 153 15702 1 . HIS 154 154 15702 1 . HIS 155 155 15702 1 . HIS 156 156 15702 1 . HIS 157 157 15702 1 . HIS 158 158 15702 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 15702 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Subvariant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Cellular_location _Entity_natural_src.Fragment _Entity_natural_src.Fraction _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Plasmid_details _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Dev_stage _Entity_natural_src.Details _Entity_natural_src.Citation_ID _Entity_natural_src.Citation_label _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $entity . 520 organism . 'Bordatella pertussis' 'Bordetella pertussis' . . Bacteria . Bordatella pertussis 'Tohama I' . . . . . . . . . . . . . . . BP2786 . . . . 15702 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 15702 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_subvariant _Entity_experimental_src.Host_org_organ _Entity_experimental_src.Host_org_tissue _Entity_experimental_src.Host_org_tissue_fraction _Entity_experimental_src.Host_org_cell_line _Entity_experimental_src.Host_org_cell_type _Entity_experimental_src.Host_org_cellular_location _Entity_experimental_src.Host_org_organelle _Entity_experimental_src.Host_org_gene _Entity_experimental_src.Host_org_culture_collection _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Host_org_dev_stage _Entity_experimental_src.Details _Entity_experimental_src.Citation_ID _Entity_experimental_src.Citation_label _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $entity . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . . . . . . . . . . . . . . pET21 . . . . . . 15702 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 15702 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '95% H2O/5% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 BP2786 . . . 1 $entity . . . . . mM . . . . 15702 1 2 'sodium chloride' 'natural abundance' . . . . . . 100 . . mM . . . . 15702 1 3 MES 'natural abundance' . . . . . . 20 . . mM . . . . 15702 1 4 DTT 'natural abundance' . . . . . . 10 . . mM . . . . 15702 1 5 'sodium azide' 'natural abundance' . . . . . . 0.02 . . % . . . . 15702 1 6 'calcium chloride' 'natural abundance' . . . . . . 5 . . mM . . . . 15702 1 stop_ save_ save_sample_2 _Sample.Sf_category sample _Sample.Sf_framecode sample_2 _Sample.Entry_ID 15702 _Sample.ID 2 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '100% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 BP2786 . . . 1 $entity . . . . . mM . . . . 15702 2 2 'sodium chloride' 'natural abundance' . . . . . . 100 . . mM . . . . 15702 2 3 MES 'natural abundance' . . . . . . 20 . . mM . . . . 15702 2 4 DTT 'natural abundance' . . . . . . 10 . . mM . . . . 15702 2 5 'sodium azide' 'natural abundance' . . . . . . 0.02 . . % . . . . 15702 2 6 'calcium chloride' 'natural abundance' . . . . . . 5 . . mM . . . . 15702 2 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID 15702 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 135 . mM 15702 1 pH 6.5 . pH 15702 1 pressure 1 . atm 15702 1 temperature 293 . K 15702 1 stop_ save_ ############################ # Computer software used # ############################ save_Felix _Software.Sf_category software _Software.Sf_framecode Felix _Software.Entry_ID 15702 _Software.ID 1 _Software.Name FELIX _Software.Version 97 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Accelrys Software Inc.' . . 15702 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 15702 1 'data analysis' 15702 1 processing 15702 1 stop_ save_ save_SPARKY _Software.Sf_category software _Software.Sf_framecode SPARKY _Software.Entry_ID 15702 _Software.ID 2 _Software.Name SPARKY _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Goddard . . 15702 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 15702 2 'data analysis' 15702 2 stop_ save_ save_AutoStructure _Software.Sf_category software _Software.Sf_framecode AutoStructure _Software.Entry_ID 15702 _Software.ID 3 _Software.Name AutoStruct _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Huang, Tejero, Powers and Montelione' . . 15702 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID refinement 15702 3 'structure solution' 15702 3 stop_ save_ save_PSVS _Software.Sf_category software _Software.Sf_framecode PSVS _Software.Entry_ID 15702 _Software.ID 4 _Software.Name PSVS _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bhattacharya and Montelione' . . 15702 4 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID refinement 15702 4 'structure analysis' 15702 4 stop_ save_ save_CNS _Software.Sf_category software _Software.Sf_framecode CNS _Software.Entry_ID 15702 _Software.ID 5 _Software.Name CNS _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Brunger, Adams, Clore, Gros, Nilges and Read' . . 15702 5 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID refinement 15702 5 'structure solution' 15702 5 stop_ save_ save_X-PLOR_NIH _Software.Sf_category software _Software.Sf_framecode X-PLOR_NIH _Software.Entry_ID 15702 _Software.ID 6 _Software.Name 'X-PLOR NIH' _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Schwieters, Kuszewski, Tjandra and Clore' . . 15702 6 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID refinement 15702 6 'structure solution' 15702 6 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_1 _NMR_spectrometer.Entry_ID 15702 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model INOVA _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_2 _NMR_spectrometer.Entry_ID 15702 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model INOVA _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 750 save_ save_spectrometer_3 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_3 _NMR_spectrometer.Entry_ID 15702 _NMR_spectrometer.ID 3 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model INOVA _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ save_spectrometer_4 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_4 _NMR_spectrometer.Entry_ID 15702 _NMR_spectrometer.ID 4 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model INOVA _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 15702 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 Varian INOVA . 600 . . . 15702 1 2 spectrometer_2 Varian INOVA . 750 . . . 15702 1 3 spectrometer_3 Varian INOVA . 800 . . . 15702 1 4 spectrometer_4 Varian INOVA . 600 . . . 15702 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 15702 _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 1H-13C NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 15702 1 2 '3D 1H-15N NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 15702 1 3 '4D 1H-13C-13C-1H HMQC-NOESY' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 15702 1 4 '3D HCCH-TOCSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 15702 1 5 '3D HCCH-COSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 15702 1 6 '3D HNCACB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 15702 1 7 '3D CBCA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 15702 1 8 '3D HNCO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 15702 1 9 '2D 1H-15N HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 15702 1 10 '2D 1H-13C HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 15702 1 11 '3D 1H-13C NOESY' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 15702 1 12 '2D 1H-13C HSQC' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 15702 1 13 '2D 1H-15N HSQC' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 15702 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_reference_1 _Chem_shift_reference.Entry_ID 15702 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.00 . indirect 0.251449530 . . . . . . . . . 15702 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . . . . . 15702 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 . indirect 0.101329118 . . . . . . . . . 15702 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_CHEMSHIFTS _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode CHEMSHIFTS _Assigned_chem_shift_list.Entry_ID 15702 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err 0.02 _Assigned_chem_shift_list.Chem_shift_13C_err 0.2 _Assigned_chem_shift_list.Chem_shift_15N_err 0.2 _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 4 '3D HCCH-TOCSY' . . . 15702 1 5 '3D HCCH-COSY' . . . 15702 1 6 '3D HNCACB' . . . 15702 1 7 '3D CBCA(CO)NH' . . . 15702 1 8 '3D HNCO' . . . 15702 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 1 $Felix . . 15702 1 2 $SPARKY . . 15702 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 1 1 MET HE1 H 1 2.07 0.02 . 1 . . . . 1 MET HE . 15702 1 2 . 1 1 1 1 MET HE2 H 1 2.07 0.02 . 1 . . . . 1 MET HE . 15702 1 3 . 1 1 1 1 MET HE3 H 1 2.07 0.02 . 1 . . . . 1 MET HE . 15702 1 4 . 1 1 1 1 MET CE C 13 16.7 0.2 . 1 . . . . 1 MET CE . 15702 1 5 . 1 1 4 4 HIS C C 13 174.8 0.2 . 1 . . . . 4 HIS C . 15702 1 6 . 1 1 4 4 HIS CA C 13 55.9 0.2 . 1 . . . . 4 HIS CA . 15702 1 7 . 1 1 4 4 HIS CB C 13 30.0 0.2 . 1 . . . . 4 HIS CB . 15702 1 8 . 1 1 5 5 THR H H 1 7.99 0.02 . 1 . . . . 5 THR H . 15702 1 9 . 1 1 5 5 THR C C 13 173.8 0.2 . 1 . . . . 5 THR C . 15702 1 10 . 1 1 5 5 THR CA C 13 61.5 0.2 . 1 . . . . 5 THR CA . 15702 1 11 . 1 1 5 5 THR CB C 13 69.9 0.2 . 1 . . . . 5 THR CB . 15702 1 12 . 1 1 5 5 THR N N 15 115.3 0.2 . 1 . . . . 5 THR N . 15702 1 13 . 1 1 6 6 ASP H H 1 8.37 0.02 . 1 . . . . 6 ASP H . 15702 1 14 . 1 1 6 6 ASP HA H 1 4.86 0.02 . 1 . . . . 6 ASP HA . 15702 1 15 . 1 1 6 6 ASP HB2 H 1 2.50 0.02 . 2 . . . . 6 ASP HB2 . 15702 1 16 . 1 1 6 6 ASP HB3 H 1 2.75 0.02 . 2 . . . . 6 ASP HB3 . 15702 1 17 . 1 1 6 6 ASP CA C 13 52.5 0.2 . 1 . . . . 6 ASP CA . 15702 1 18 . 1 1 6 6 ASP CB C 13 41.1 0.2 . 1 . . . . 6 ASP CB . 15702 1 19 . 1 1 6 6 ASP N N 15 124.4 0.2 . 1 . . . . 6 ASP N . 15702 1 20 . 1 1 7 7 PRO HA H 1 4.35 0.02 . 1 . . . . 7 PRO HA . 15702 1 21 . 1 1 7 7 PRO HB2 H 1 1.86 0.02 . 2 . . . . 7 PRO HB2 . 15702 1 22 . 1 1 7 7 PRO HB3 H 1 2.23 0.02 . 2 . . . . 7 PRO HB3 . 15702 1 23 . 1 1 7 7 PRO HD2 H 1 3.76 0.02 . 2 . . . . 7 PRO HD2 . 15702 1 24 . 1 1 7 7 PRO HG2 H 1 1.94 0.02 . 2 . . . . 7 PRO HG2 . 15702 1 25 . 1 1 7 7 PRO HG3 H 1 1.99 0.02 . 2 . . . . 7 PRO HG3 . 15702 1 26 . 1 1 7 7 PRO C C 13 176.9 0.2 . 1 . . . . 7 PRO C . 15702 1 27 . 1 1 7 7 PRO CA C 13 63.5 0.2 . 1 . . . . 7 PRO CA . 15702 1 28 . 1 1 7 7 PRO CB C 13 32.1 0.2 . 1 . . . . 7 PRO CB . 15702 1 29 . 1 1 7 7 PRO CD C 13 50.5 0.2 . 1 . . . . 7 PRO CD . 15702 1 30 . 1 1 7 7 PRO CG C 13 27.5 0.2 . 1 . . . . 7 PRO CG . 15702 1 31 . 1 1 8 8 ALA H H 1 8.42 0.02 . 1 . . . . 8 ALA H . 15702 1 32 . 1 1 8 8 ALA HA H 1 4.26 0.02 . 1 . . . . 8 ALA HA . 15702 1 33 . 1 1 8 8 ALA HB1 H 1 1.36 0.02 . 1 . . . . 8 ALA HB . 15702 1 34 . 1 1 8 8 ALA HB2 H 1 1.36 0.02 . 1 . . . . 8 ALA HB . 15702 1 35 . 1 1 8 8 ALA HB3 H 1 1.36 0.02 . 1 . . . . 8 ALA HB . 15702 1 36 . 1 1 8 8 ALA C C 13 178.1 0.2 . 1 . . . . 8 ALA C . 15702 1 37 . 1 1 8 8 ALA CA C 13 52.9 0.2 . 1 . . . . 8 ALA CA . 15702 1 38 . 1 1 8 8 ALA CB C 13 19.2 0.2 . 1 . . . . 8 ALA CB . 15702 1 39 . 1 1 8 8 ALA N N 15 122.7 0.2 . 1 . . . . 8 ALA N . 15702 1 40 . 1 1 9 9 THR H H 1 7.88 0.02 . 1 . . . . 9 THR H . 15702 1 41 . 1 1 9 9 THR HA H 1 4.23 0.02 . 1 . . . . 9 THR HA . 15702 1 42 . 1 1 9 9 THR HB H 1 4.15 0.02 . 1 . . . . 9 THR HB . 15702 1 43 . 1 1 9 9 THR HG21 H 1 1.16 0.02 . 1 . . . . 9 THR HG2 . 15702 1 44 . 1 1 9 9 THR HG22 H 1 1.16 0.02 . 1 . . . . 9 THR HG2 . 15702 1 45 . 1 1 9 9 THR HG23 H 1 1.16 0.02 . 1 . . . . 9 THR HG2 . 15702 1 46 . 1 1 9 9 THR C C 13 173.8 0.2 . 1 . . . . 9 THR C . 15702 1 47 . 1 1 9 9 THR CA C 13 61.7 0.2 . 1 . . . . 9 THR CA . 15702 1 48 . 1 1 9 9 THR CB C 13 69.7 0.2 . 1 . . . . 9 THR CB . 15702 1 49 . 1 1 9 9 THR CG2 C 13 21.4 0.2 . 1 . . . . 9 THR CG2 . 15702 1 50 . 1 1 9 9 THR N N 15 112.9 0.2 . 1 . . . . 9 THR N . 15702 1 51 . 1 1 10 10 ALA H H 1 8.16 0.02 . 1 . . . . 10 ALA H . 15702 1 52 . 1 1 10 10 ALA HA H 1 4.34 0.02 . 1 . . . . 10 ALA HA . 15702 1 53 . 1 1 10 10 ALA HB1 H 1 1.33 0.02 . 1 . . . . 10 ALA HB . 15702 1 54 . 1 1 10 10 ALA HB2 H 1 1.33 0.02 . 1 . . . . 10 ALA HB . 15702 1 55 . 1 1 10 10 ALA HB3 H 1 1.33 0.02 . 1 . . . . 10 ALA HB . 15702 1 56 . 1 1 10 10 ALA C C 13 177.0 0.2 . 1 . . . . 10 ALA C . 15702 1 57 . 1 1 10 10 ALA CA C 13 52.3 0.2 . 1 . . . . 10 ALA CA . 15702 1 58 . 1 1 10 10 ALA CB C 13 19.4 0.2 . 1 . . . . 10 ALA CB . 15702 1 59 . 1 1 10 10 ALA N N 15 127.0 0.2 . 1 . . . . 10 ALA N . 15702 1 60 . 1 1 11 11 LEU H H 1 8.04 0.02 . 1 . . . . 11 LEU H . 15702 1 61 . 1 1 11 11 LEU HA H 1 4.64 0.02 . 1 . . . . 11 LEU HA . 15702 1 62 . 1 1 11 11 LEU HB2 H 1 1.50 0.02 . 2 . . . . 11 LEU HB2 . 15702 1 63 . 1 1 11 11 LEU HB3 H 1 1.64 0.02 . 2 . . . . 11 LEU HB3 . 15702 1 64 . 1 1 11 11 LEU HD11 H 1 0.88 0.02 . 1 . . . . 11 LEU HD1 . 15702 1 65 . 1 1 11 11 LEU HD12 H 1 0.88 0.02 . 1 . . . . 11 LEU HD1 . 15702 1 66 . 1 1 11 11 LEU HD13 H 1 0.88 0.02 . 1 . . . . 11 LEU HD1 . 15702 1 67 . 1 1 11 11 LEU HD21 H 1 0.78 0.02 . 1 . . . . 11 LEU HD2 . 15702 1 68 . 1 1 11 11 LEU HD22 H 1 0.78 0.02 . 1 . . . . 11 LEU HD2 . 15702 1 69 . 1 1 11 11 LEU HD23 H 1 0.78 0.02 . 1 . . . . 11 LEU HD2 . 15702 1 70 . 1 1 11 11 LEU C C 13 178.3 0.2 . 1 . . . . 11 LEU C . 15702 1 71 . 1 1 11 11 LEU CA C 13 54.0 0.2 . 1 . . . . 11 LEU CA . 15702 1 72 . 1 1 11 11 LEU CB C 13 42.9 0.2 . 1 . . . . 11 LEU CB . 15702 1 73 . 1 1 11 11 LEU CD1 C 13 25.8 0.2 . 1 . . . . 11 LEU CD1 . 15702 1 74 . 1 1 11 11 LEU CD2 C 13 22.9 0.2 . 1 . . . . 11 LEU CD2 . 15702 1 75 . 1 1 11 11 LEU N N 15 121.5 0.2 . 1 . . . . 11 LEU N . 15702 1 76 . 1 1 12 12 ASN H H 1 9.70 0.02 . 1 . . . . 12 ASN H . 15702 1 77 . 1 1 12 12 ASN HA H 1 4.76 0.02 . 1 . . . . 12 ASN HA . 15702 1 78 . 1 1 12 12 ASN HB2 H 1 1.87 0.02 . 2 . . . . 12 ASN HB2 . 15702 1 79 . 1 1 12 12 ASN HB3 H 1 3.07 0.02 . 2 . . . . 12 ASN HB3 . 15702 1 80 . 1 1 12 12 ASN C C 13 174.7 0.2 . 1 . . . . 12 ASN C . 15702 1 81 . 1 1 12 12 ASN CA C 13 54.1 0.2 . 1 . . . . 12 ASN CA . 15702 1 82 . 1 1 12 12 ASN CB C 13 38.1 0.2 . 1 . . . . 12 ASN CB . 15702 1 83 . 1 1 12 12 ASN N N 15 121.5 0.2 . 1 . . . . 12 ASN N . 15702 1 84 . 1 1 13 13 THR H H 1 8.71 0.02 . 1 . . . . 13 THR H . 15702 1 85 . 1 1 13 13 THR HA H 1 4.76 0.02 . 1 . . . . 13 THR HA . 15702 1 86 . 1 1 13 13 THR HB H 1 4.02 0.02 . 1 . . . . 13 THR HB . 15702 1 87 . 1 1 13 13 THR HG21 H 1 1.10 0.02 . 1 . . . . 13 THR HG2 . 15702 1 88 . 1 1 13 13 THR HG22 H 1 1.10 0.02 . 1 . . . . 13 THR HG2 . 15702 1 89 . 1 1 13 13 THR HG23 H 1 1.10 0.02 . 1 . . . . 13 THR HG2 . 15702 1 90 . 1 1 13 13 THR C C 13 173.6 0.2 . 1 . . . . 13 THR C . 15702 1 91 . 1 1 13 13 THR CA C 13 61.9 0.2 . 1 . . . . 13 THR CA . 15702 1 92 . 1 1 13 13 THR CB C 13 71.5 0.2 . 1 . . . . 13 THR CB . 15702 1 93 . 1 1 13 13 THR CG2 C 13 20.4 0.2 . 1 . . . . 13 THR CG2 . 15702 1 94 . 1 1 13 13 THR N N 15 121.8 0.2 . 1 . . . . 13 THR N . 15702 1 95 . 1 1 14 14 VAL H H 1 9.50 0.02 . 1 . . . . 14 VAL H . 15702 1 96 . 1 1 14 14 VAL HA H 1 4.66 0.02 . 1 . . . . 14 VAL HA . 15702 1 97 . 1 1 14 14 VAL HB H 1 2.34 0.02 . 1 . . . . 14 VAL HB . 15702 1 98 . 1 1 14 14 VAL HG11 H 1 1.12 0.02 . 1 . . . . 14 VAL HG1 . 15702 1 99 . 1 1 14 14 VAL HG12 H 1 1.12 0.02 . 1 . . . . 14 VAL HG1 . 15702 1 100 . 1 1 14 14 VAL HG13 H 1 1.12 0.02 . 1 . . . . 14 VAL HG1 . 15702 1 101 . 1 1 14 14 VAL HG21 H 1 1.11 0.02 . 1 . . . . 14 VAL HG2 . 15702 1 102 . 1 1 14 14 VAL HG22 H 1 1.11 0.02 . 1 . . . . 14 VAL HG2 . 15702 1 103 . 1 1 14 14 VAL HG23 H 1 1.11 0.02 . 1 . . . . 14 VAL HG2 . 15702 1 104 . 1 1 14 14 VAL C C 13 177.0 0.2 . 1 . . . . 14 VAL C . 15702 1 105 . 1 1 14 14 VAL CA C 13 63.8 0.2 . 1 . . . . 14 VAL CA . 15702 1 106 . 1 1 14 14 VAL CB C 13 30.6 0.2 . 1 . . . . 14 VAL CB . 15702 1 107 . 1 1 14 14 VAL CG1 C 13 22.1 0.2 . 1 . . . . 14 VAL CG1 . 15702 1 108 . 1 1 14 14 VAL CG2 C 13 22.3 0.2 . 1 . . . . 14 VAL CG2 . 15702 1 109 . 1 1 14 14 VAL N N 15 126.7 0.2 . 1 . . . . 14 VAL N . 15702 1 110 . 1 1 15 15 THR H H 1 8.90 0.02 . 1 . . . . 15 THR H . 15702 1 111 . 1 1 15 15 THR HA H 1 4.30 0.02 . 1 . . . . 15 THR HA . 15702 1 112 . 1 1 15 15 THR HB H 1 4.38 0.02 . 1 . . . . 15 THR HB . 15702 1 113 . 1 1 15 15 THR HG21 H 1 1.24 0.02 . 1 . . . . 15 THR HG2 . 15702 1 114 . 1 1 15 15 THR HG22 H 1 1.24 0.02 . 1 . . . . 15 THR HG2 . 15702 1 115 . 1 1 15 15 THR HG23 H 1 1.24 0.02 . 1 . . . . 15 THR HG2 . 15702 1 116 . 1 1 15 15 THR C C 13 174.9 0.2 . 1 . . . . 15 THR C . 15702 1 117 . 1 1 15 15 THR CA C 13 62.8 0.2 . 1 . . . . 15 THR CA . 15702 1 118 . 1 1 15 15 THR CB C 13 68.7 0.2 . 1 . . . . 15 THR CB . 15702 1 119 . 1 1 15 15 THR CG2 C 13 22.4 0.2 . 1 . . . . 15 THR CG2 . 15702 1 120 . 1 1 15 15 THR N N 15 122.0 0.2 . 1 . . . . 15 THR N . 15702 1 121 . 1 1 16 16 ALA H H 1 7.96 0.02 . 1 . . . . 16 ALA H . 15702 1 122 . 1 1 16 16 ALA HA H 1 4.36 0.02 . 1 . . . . 16 ALA HA . 15702 1 123 . 1 1 16 16 ALA HB1 H 1 1.44 0.02 . 1 . . . . 16 ALA HB . 15702 1 124 . 1 1 16 16 ALA HB2 H 1 1.44 0.02 . 1 . . . . 16 ALA HB . 15702 1 125 . 1 1 16 16 ALA HB3 H 1 1.44 0.02 . 1 . . . . 16 ALA HB . 15702 1 126 . 1 1 16 16 ALA C C 13 174.4 0.2 . 1 . . . . 16 ALA C . 15702 1 127 . 1 1 16 16 ALA CA C 13 52.6 0.2 . 1 . . . . 16 ALA CA . 15702 1 128 . 1 1 16 16 ALA CB C 13 21.9 0.2 . 1 . . . . 16 ALA CB . 15702 1 129 . 1 1 16 16 ALA N N 15 120.9 0.2 . 1 . . . . 16 ALA N . 15702 1 130 . 1 1 17 17 TYR H H 1 7.79 0.02 . 1 . . . . 17 TYR H . 15702 1 131 . 1 1 17 17 TYR HA H 1 4.39 0.02 . 1 . . . . 17 TYR HA . 15702 1 132 . 1 1 17 17 TYR HB2 H 1 2.93 0.02 . 2 . . . . 17 TYR HB2 . 15702 1 133 . 1 1 17 17 TYR HB3 H 1 3.00 0.02 . 2 . . . . 17 TYR HB3 . 15702 1 134 . 1 1 17 17 TYR HD1 H 1 6.75 0.02 . 3 . . . . 17 TYR HD1 . 15702 1 135 . 1 1 17 17 TYR HE1 H 1 6.68 0.02 . 3 . . . . 17 TYR HE1 . 15702 1 136 . 1 1 17 17 TYR C C 13 173.0 0.2 . 1 . . . . 17 TYR C . 15702 1 137 . 1 1 17 17 TYR CA C 13 56.4 0.2 . 1 . . . . 17 TYR CA . 15702 1 138 . 1 1 17 17 TYR CB C 13 39.7 0.2 . 1 . . . . 17 TYR CB . 15702 1 139 . 1 1 17 17 TYR CD1 C 13 133.0 0.2 . 3 . . . . 17 TYR CD1 . 15702 1 140 . 1 1 17 17 TYR CE1 C 13 117.9 0.2 . 3 . . . . 17 TYR CE1 . 15702 1 141 . 1 1 17 17 TYR N N 15 114.8 0.2 . 1 . . . . 17 TYR N . 15702 1 142 . 1 1 18 18 GLY H H 1 7.03 0.02 . 1 . . . . 18 GLY H . 15702 1 143 . 1 1 18 18 GLY HA2 H 1 3.21 0.02 . 2 . . . . 18 GLY HA2 . 15702 1 144 . 1 1 18 18 GLY HA3 H 1 3.90 0.02 . 2 . . . . 18 GLY HA3 . 15702 1 145 . 1 1 18 18 GLY C C 13 172.2 0.2 . 1 . . . . 18 GLY C . 15702 1 146 . 1 1 18 18 GLY CA C 13 44.9 0.2 . 1 . . . . 18 GLY CA . 15702 1 147 . 1 1 18 18 GLY N N 15 108.6 0.2 . 1 . . . . 18 GLY N . 15702 1 148 . 1 1 19 19 ASP H H 1 8.41 0.02 . 1 . . . . 19 ASP H . 15702 1 149 . 1 1 19 19 ASP HA H 1 4.32 0.02 . 1 . . . . 19 ASP HA . 15702 1 150 . 1 1 19 19 ASP HB2 H 1 2.54 0.02 . 2 . . . . 19 ASP HB2 . 15702 1 151 . 1 1 19 19 ASP HB3 H 1 2.71 0.02 . 2 . . . . 19 ASP HB3 . 15702 1 152 . 1 1 19 19 ASP C C 13 176.5 0.2 . 1 . . . . 19 ASP C . 15702 1 153 . 1 1 19 19 ASP CA C 13 55.6 0.2 . 1 . . . . 19 ASP CA . 15702 1 154 . 1 1 19 19 ASP CB C 13 39.5 0.2 . 1 . . . . 19 ASP CB . 15702 1 155 . 1 1 19 19 ASP N N 15 120.4 0.2 . 1 . . . . 19 ASP N . 15702 1 156 . 1 1 20 20 GLY H H 1 8.67 0.02 . 1 . . . . 20 GLY H . 15702 1 157 . 1 1 20 20 GLY HA2 H 1 3.67 0.02 . 2 . . . . 20 GLY HA2 . 15702 1 158 . 1 1 20 20 GLY HA3 H 1 4.21 0.02 . 2 . . . . 20 GLY HA3 . 15702 1 159 . 1 1 20 20 GLY C C 13 173.9 0.2 . 1 . . . . 20 GLY C . 15702 1 160 . 1 1 20 20 GLY CA C 13 45.8 0.2 . 1 . . . . 20 GLY CA . 15702 1 161 . 1 1 20 20 GLY N N 15 113.5 0.2 . 1 . . . . 20 GLY N . 15702 1 162 . 1 1 21 21 TYR H H 1 7.53 0.02 . 1 . . . . 21 TYR H . 15702 1 163 . 1 1 21 21 TYR HA H 1 5.48 0.02 . 1 . . . . 21 TYR HA . 15702 1 164 . 1 1 21 21 TYR HB2 H 1 2.58 0.02 . 2 . . . . 21 TYR HB2 . 15702 1 165 . 1 1 21 21 TYR HB3 H 1 2.85 0.02 . 2 . . . . 21 TYR HB3 . 15702 1 166 . 1 1 21 21 TYR HD1 H 1 6.54 0.02 . 3 . . . . 21 TYR HD1 . 15702 1 167 . 1 1 21 21 TYR HE1 H 1 6.42 0.02 . 3 . . . . 21 TYR HE1 . 15702 1 168 . 1 1 21 21 TYR C C 13 172.8 0.2 . 1 . . . . 21 TYR C . 15702 1 169 . 1 1 21 21 TYR CA C 13 56.7 0.2 . 1 . . . . 21 TYR CA . 15702 1 170 . 1 1 21 21 TYR CB C 13 41.4 0.2 . 1 . . . . 21 TYR CB . 15702 1 171 . 1 1 21 21 TYR CD1 C 13 133.1 0.2 . 3 . . . . 21 TYR CD1 . 15702 1 172 . 1 1 21 21 TYR CE1 C 13 117.3 0.2 . 3 . . . . 21 TYR CE1 . 15702 1 173 . 1 1 21 21 TYR N N 15 114.3 0.2 . 1 . . . . 21 TYR N . 15702 1 174 . 1 1 22 22 ILE H H 1 8.78 0.02 . 1 . . . . 22 ILE H . 15702 1 175 . 1 1 22 22 ILE HA H 1 4.35 0.02 . 1 . . . . 22 ILE HA . 15702 1 176 . 1 1 22 22 ILE HB H 1 1.76 0.02 . 1 . . . . 22 ILE HB . 15702 1 177 . 1 1 22 22 ILE HD11 H 1 0.77 0.02 . 1 . . . . 22 ILE HD1 . 15702 1 178 . 1 1 22 22 ILE HD12 H 1 0.77 0.02 . 1 . . . . 22 ILE HD1 . 15702 1 179 . 1 1 22 22 ILE HD13 H 1 0.77 0.02 . 1 . . . . 22 ILE HD1 . 15702 1 180 . 1 1 22 22 ILE HG12 H 1 1.21 0.02 . 2 . . . . 22 ILE HG12 . 15702 1 181 . 1 1 22 22 ILE HG13 H 1 1.44 0.02 . 2 . . . . 22 ILE HG13 . 15702 1 182 . 1 1 22 22 ILE HG21 H 1 0.98 0.02 . 1 . . . . 22 ILE HG2 . 15702 1 183 . 1 1 22 22 ILE HG22 H 1 0.98 0.02 . 1 . . . . 22 ILE HG2 . 15702 1 184 . 1 1 22 22 ILE HG23 H 1 0.98 0.02 . 1 . . . . 22 ILE HG2 . 15702 1 185 . 1 1 22 22 ILE C C 13 173.8 0.2 . 1 . . . . 22 ILE C . 15702 1 186 . 1 1 22 22 ILE CA C 13 60.2 0.2 . 1 . . . . 22 ILE CA . 15702 1 187 . 1 1 22 22 ILE CB C 13 41.7 0.2 . 1 . . . . 22 ILE CB . 15702 1 188 . 1 1 22 22 ILE CD1 C 13 14.1 0.2 . 1 . . . . 22 ILE CD1 . 15702 1 189 . 1 1 22 22 ILE CG1 C 13 27.7 0.2 . 1 . . . . 22 ILE CG1 . 15702 1 190 . 1 1 22 22 ILE CG2 C 13 19.2 0.2 . 1 . . . . 22 ILE CG2 . 15702 1 191 . 1 1 22 22 ILE N N 15 119.3 0.2 . 1 . . . . 22 ILE N . 15702 1 192 . 1 1 23 23 GLU H H 1 9.01 0.02 . 1 . . . . 23 GLU H . 15702 1 193 . 1 1 23 23 GLU HA H 1 5.68 0.02 . 1 . . . . 23 GLU HA . 15702 1 194 . 1 1 23 23 GLU HB2 H 1 1.67 0.02 . 2 . . . . 23 GLU HB2 . 15702 1 195 . 1 1 23 23 GLU HB3 H 1 1.87 0.02 . 2 . . . . 23 GLU HB3 . 15702 1 196 . 1 1 23 23 GLU HG2 H 1 1.57 0.02 . 2 . . . . 23 GLU HG2 . 15702 1 197 . 1 1 23 23 GLU HG3 H 1 1.80 0.02 . 2 . . . . 23 GLU HG3 . 15702 1 198 . 1 1 23 23 GLU C C 13 175.0 0.2 . 1 . . . . 23 GLU C . 15702 1 199 . 1 1 23 23 GLU CA C 13 54.3 0.2 . 1 . . . . 23 GLU CA . 15702 1 200 . 1 1 23 23 GLU CB C 13 33.5 0.2 . 1 . . . . 23 GLU CB . 15702 1 201 . 1 1 23 23 GLU CG C 13 37.7 0.2 . 1 . . . . 23 GLU CG . 15702 1 202 . 1 1 23 23 GLU N N 15 127.8 0.2 . 1 . . . . 23 GLU N . 15702 1 203 . 1 1 24 24 VAL H H 1 8.98 0.02 . 1 . . . . 24 VAL H . 15702 1 204 . 1 1 24 24 VAL HA H 1 4.84 0.02 . 1 . . . . 24 VAL HA . 15702 1 205 . 1 1 24 24 VAL HB H 1 1.81 0.02 . 1 . . . . 24 VAL HB . 15702 1 206 . 1 1 24 24 VAL HG11 H 1 0.07 0.02 . 1 . . . . 24 VAL HG1 . 15702 1 207 . 1 1 24 24 VAL HG12 H 1 0.07 0.02 . 1 . . . . 24 VAL HG1 . 15702 1 208 . 1 1 24 24 VAL HG13 H 1 0.07 0.02 . 1 . . . . 24 VAL HG1 . 15702 1 209 . 1 1 24 24 VAL HG21 H 1 0.34 0.02 . 1 . . . . 24 VAL HG2 . 15702 1 210 . 1 1 24 24 VAL HG22 H 1 0.34 0.02 . 1 . . . . 24 VAL HG2 . 15702 1 211 . 1 1 24 24 VAL HG23 H 1 0.34 0.02 . 1 . . . . 24 VAL HG2 . 15702 1 212 . 1 1 24 24 VAL C C 13 177.3 0.2 . 1 . . . . 24 VAL C . 15702 1 213 . 1 1 24 24 VAL CA C 13 60.6 0.2 . 1 . . . . 24 VAL CA . 15702 1 214 . 1 1 24 24 VAL CB C 13 33.6 0.2 . 1 . . . . 24 VAL CB . 15702 1 215 . 1 1 24 24 VAL CG1 C 13 20.1 0.2 . 1 . . . . 24 VAL CG1 . 15702 1 216 . 1 1 24 24 VAL CG2 C 13 21.9 0.2 . 1 . . . . 24 VAL CG2 . 15702 1 217 . 1 1 24 24 VAL N N 15 125.4 0.2 . 1 . . . . 24 VAL N . 15702 1 218 . 1 1 25 25 ASN H H 1 9.34 0.02 . 1 . . . . 25 ASN H . 15702 1 219 . 1 1 25 25 ASN HA H 1 4.34 0.02 . 1 . . . . 25 ASN HA . 15702 1 220 . 1 1 25 25 ASN HB2 H 1 2.98 0.02 . 2 . . . . 25 ASN HB2 . 15702 1 221 . 1 1 25 25 ASN HB3 H 1 3.05 0.02 . 2 . . . . 25 ASN HB3 . 15702 1 222 . 1 1 25 25 ASN C C 13 173.8 0.2 . 1 . . . . 25 ASN C . 15702 1 223 . 1 1 25 25 ASN CA C 13 54.6 0.2 . 1 . . . . 25 ASN CA . 15702 1 224 . 1 1 25 25 ASN CB C 13 36.6 0.2 . 1 . . . . 25 ASN CB . 15702 1 225 . 1 1 25 25 ASN N N 15 127.8 0.2 . 1 . . . . 25 ASN N . 15702 1 226 . 1 1 26 26 GLN H H 1 7.92 0.02 . 1 . . . . 26 GLN H . 15702 1 227 . 1 1 26 26 GLN HA H 1 3.67 0.02 . 1 . . . . 26 GLN HA . 15702 1 228 . 1 1 26 26 GLN HB2 H 1 2.25 0.02 . 2 . . . . 26 GLN HB2 . 15702 1 229 . 1 1 26 26 GLN HB3 H 1 2.42 0.02 . 2 . . . . 26 GLN HB3 . 15702 1 230 . 1 1 26 26 GLN HG2 H 1 2.21 0.02 . 2 . . . . 26 GLN HG2 . 15702 1 231 . 1 1 26 26 GLN HG3 H 1 2.23 0.02 . 2 . . . . 26 GLN HG3 . 15702 1 232 . 1 1 26 26 GLN C C 13 174.4 0.2 . 1 . . . . 26 GLN C . 15702 1 233 . 1 1 26 26 GLN CA C 13 58.1 0.2 . 1 . . . . 26 GLN CA . 15702 1 234 . 1 1 26 26 GLN CB C 13 26.5 0.2 . 1 . . . . 26 GLN CB . 15702 1 235 . 1 1 26 26 GLN CG C 13 35.1 0.2 . 1 . . . . 26 GLN CG . 15702 1 236 . 1 1 26 26 GLN N N 15 104.1 0.2 . 1 . . . . 26 GLN N . 15702 1 237 . 1 1 27 27 VAL H H 1 7.85 0.02 . 1 . . . . 27 VAL H . 15702 1 238 . 1 1 27 27 VAL HA H 1 3.90 0.02 . 1 . . . . 27 VAL HA . 15702 1 239 . 1 1 27 27 VAL HB H 1 2.07 0.02 . 1 . . . . 27 VAL HB . 15702 1 240 . 1 1 27 27 VAL HG11 H 1 0.37 0.02 . 1 . . . . 27 VAL HG1 . 15702 1 241 . 1 1 27 27 VAL HG12 H 1 0.37 0.02 . 1 . . . . 27 VAL HG1 . 15702 1 242 . 1 1 27 27 VAL HG13 H 1 0.37 0.02 . 1 . . . . 27 VAL HG1 . 15702 1 243 . 1 1 27 27 VAL HG21 H 1 0.87 0.02 . 1 . . . . 27 VAL HG2 . 15702 1 244 . 1 1 27 27 VAL HG22 H 1 0.87 0.02 . 1 . . . . 27 VAL HG2 . 15702 1 245 . 1 1 27 27 VAL HG23 H 1 0.87 0.02 . 1 . . . . 27 VAL HG2 . 15702 1 246 . 1 1 27 27 VAL C C 13 174.2 0.2 . 1 . . . . 27 VAL C . 15702 1 247 . 1 1 27 27 VAL CA C 13 62.1 0.2 . 1 . . . . 27 VAL CA . 15702 1 248 . 1 1 27 27 VAL CB C 13 32.5 0.2 . 1 . . . . 27 VAL CB . 15702 1 249 . 1 1 27 27 VAL CG1 C 13 21.3 0.2 . 1 . . . . 27 VAL CG1 . 15702 1 250 . 1 1 27 27 VAL CG2 C 13 21.2 0.2 . 1 . . . . 27 VAL CG2 . 15702 1 251 . 1 1 27 27 VAL N N 15 123.1 0.2 . 1 . . . . 27 VAL N . 15702 1 252 . 1 1 28 28 ARG H H 1 8.43 0.02 . 1 . . . . 28 ARG H . 15702 1 253 . 1 1 28 28 ARG HA H 1 4.32 0.02 . 1 . . . . 28 ARG HA . 15702 1 254 . 1 1 28 28 ARG HB2 H 1 1.41 0.02 . 2 . . . . 28 ARG HB2 . 15702 1 255 . 1 1 28 28 ARG HB3 H 1 1.56 0.02 . 2 . . . . 28 ARG HB3 . 15702 1 256 . 1 1 28 28 ARG C C 13 175.2 0.2 . 1 . . . . 28 ARG C . 15702 1 257 . 1 1 28 28 ARG CA C 13 57.1 0.2 . 1 . . . . 28 ARG CA . 15702 1 258 . 1 1 28 28 ARG CB C 13 31.3 0.2 . 1 . . . . 28 ARG CB . 15702 1 259 . 1 1 28 28 ARG N N 15 126.2 0.2 . 1 . . . . 28 ARG N . 15702 1 260 . 1 1 29 29 PHE H H 1 9.29 0.02 . 1 . . . . 29 PHE H . 15702 1 261 . 1 1 29 29 PHE HA H 1 4.58 0.02 . 1 . . . . 29 PHE HA . 15702 1 262 . 1 1 29 29 PHE HB2 H 1 2.45 0.02 . 2 . . . . 29 PHE HB2 . 15702 1 263 . 1 1 29 29 PHE HB3 H 1 2.97 0.02 . 2 . . . . 29 PHE HB3 . 15702 1 264 . 1 1 29 29 PHE HD1 H 1 7.13 0.02 . 3 . . . . 29 PHE HD1 . 15702 1 265 . 1 1 29 29 PHE HE1 H 1 7.20 0.02 . 3 . . . . 29 PHE HE1 . 15702 1 266 . 1 1 29 29 PHE C C 13 175.8 0.2 . 1 . . . . 29 PHE C . 15702 1 267 . 1 1 29 29 PHE CA C 13 57.7 0.2 . 1 . . . . 29 PHE CA . 15702 1 268 . 1 1 29 29 PHE CB C 13 42.0 0.2 . 1 . . . . 29 PHE CB . 15702 1 269 . 1 1 29 29 PHE CD1 C 13 132.7 0.2 . 3 . . . . 29 PHE CD1 . 15702 1 270 . 1 1 29 29 PHE CE1 C 13 131.1 0.2 . 3 . . . . 29 PHE CE1 . 15702 1 271 . 1 1 29 29 PHE N N 15 123.9 0.2 . 1 . . . . 29 PHE N . 15702 1 272 . 1 1 30 30 SER H H 1 8.95 0.02 . 1 . . . . 30 SER H . 15702 1 273 . 1 1 30 30 SER HA H 1 5.13 0.02 . 1 . . . . 30 SER HA . 15702 1 274 . 1 1 30 30 SER HB2 H 1 4.00 0.02 . 2 . . . . 30 SER HB2 . 15702 1 275 . 1 1 30 30 SER HB3 H 1 4.05 0.02 . 2 . . . . 30 SER HB3 . 15702 1 276 . 1 1 30 30 SER C C 13 172.9 0.2 . 1 . . . . 30 SER C . 15702 1 277 . 1 1 30 30 SER CA C 13 57.0 0.2 . 1 . . . . 30 SER CA . 15702 1 278 . 1 1 30 30 SER CB C 13 63.2 0.2 . 1 . . . . 30 SER CB . 15702 1 279 . 1 1 30 30 SER N N 15 119.4 0.2 . 1 . . . . 30 SER N . 15702 1 280 . 1 1 31 31 HIS H H 1 7.17 0.02 . 1 . . . . 31 HIS H . 15702 1 281 . 1 1 31 31 HIS HA H 1 4.84 0.02 . 1 . . . . 31 HIS HA . 15702 1 282 . 1 1 31 31 HIS HB2 H 1 3.39 0.02 . 2 . . . . 31 HIS HB2 . 15702 1 283 . 1 1 31 31 HIS HB3 H 1 3.47 0.02 . 2 . . . . 31 HIS HB3 . 15702 1 284 . 1 1 31 31 HIS C C 13 171.9 0.2 . 1 . . . . 31 HIS C . 15702 1 285 . 1 1 31 31 HIS CA C 13 53.2 0.2 . 1 . . . . 31 HIS CA . 15702 1 286 . 1 1 31 31 HIS CB C 13 31.1 0.2 . 1 . . . . 31 HIS CB . 15702 1 287 . 1 1 31 31 HIS N N 15 114.6 0.2 . 1 . . . . 31 HIS N . 15702 1 288 . 1 1 32 32 ALA H H 1 8.93 0.02 . 1 . . . . 32 ALA H . 15702 1 289 . 1 1 32 32 ALA HA H 1 5.05 0.02 . 1 . . . . 32 ALA HA . 15702 1 290 . 1 1 32 32 ALA HB1 H 1 2.08 0.02 . 1 . . . . 32 ALA HB . 15702 1 291 . 1 1 32 32 ALA HB2 H 1 2.08 0.02 . 1 . . . . 32 ALA HB . 15702 1 292 . 1 1 32 32 ALA HB3 H 1 2.08 0.02 . 1 . . . . 32 ALA HB . 15702 1 293 . 1 1 32 32 ALA C C 13 179.0 0.2 . 1 . . . . 32 ALA C . 15702 1 294 . 1 1 32 32 ALA CA C 13 53.7 0.2 . 1 . . . . 32 ALA CA . 15702 1 295 . 1 1 32 32 ALA CB C 13 20.7 0.2 . 1 . . . . 32 ALA CB . 15702 1 296 . 1 1 32 32 ALA N N 15 120.2 0.2 . 1 . . . . 32 ALA N . 15702 1 297 . 1 1 33 33 ILE H H 1 8.28 0.02 . 1 . . . . 33 ILE H . 15702 1 298 . 1 1 33 33 ILE HA H 1 5.52 0.02 . 1 . . . . 33 ILE HA . 15702 1 299 . 1 1 33 33 ILE HB H 1 1.56 0.02 . 1 . . . . 33 ILE HB . 15702 1 300 . 1 1 33 33 ILE HD11 H 1 0.41 0.02 . 1 . . . . 33 ILE HD1 . 15702 1 301 . 1 1 33 33 ILE HD12 H 1 0.41 0.02 . 1 . . . . 33 ILE HD1 . 15702 1 302 . 1 1 33 33 ILE HD13 H 1 0.41 0.02 . 1 . . . . 33 ILE HD1 . 15702 1 303 . 1 1 33 33 ILE HG12 H 1 1.18 0.02 . 2 . . . . 33 ILE HG12 . 15702 1 304 . 1 1 33 33 ILE HG13 H 1 1.28 0.02 . 2 . . . . 33 ILE HG13 . 15702 1 305 . 1 1 33 33 ILE HG21 H 1 0.51 0.02 . 1 . . . . 33 ILE HG2 . 15702 1 306 . 1 1 33 33 ILE HG22 H 1 0.51 0.02 . 1 . . . . 33 ILE HG2 . 15702 1 307 . 1 1 33 33 ILE HG23 H 1 0.51 0.02 . 1 . . . . 33 ILE HG2 . 15702 1 308 . 1 1 33 33 ILE C C 13 173.4 0.2 . 1 . . . . 33 ILE C . 15702 1 309 . 1 1 33 33 ILE CA C 13 59.5 0.2 . 1 . . . . 33 ILE CA . 15702 1 310 . 1 1 33 33 ILE CB C 13 44.5 0.2 . 1 . . . . 33 ILE CB . 15702 1 311 . 1 1 33 33 ILE CD1 C 13 14.9 0.2 . 1 . . . . 33 ILE CD1 . 15702 1 312 . 1 1 33 33 ILE CG2 C 13 18.7 0.2 . 1 . . . . 33 ILE CG2 . 15702 1 313 . 1 1 33 33 ILE N N 15 115.8 0.2 . 1 . . . . 33 ILE N . 15702 1 314 . 1 1 34 34 ALA H H 1 8.90 0.02 . 1 . . . . 34 ALA H . 15702 1 315 . 1 1 34 34 ALA HA H 1 5.29 0.02 . 1 . . . . 34 ALA HA . 15702 1 316 . 1 1 34 34 ALA HB1 H 1 0.76 0.02 . 1 . . . . 34 ALA HB . 15702 1 317 . 1 1 34 34 ALA HB2 H 1 0.76 0.02 . 1 . . . . 34 ALA HB . 15702 1 318 . 1 1 34 34 ALA HB3 H 1 0.76 0.02 . 1 . . . . 34 ALA HB . 15702 1 319 . 1 1 34 34 ALA C C 13 176.1 0.2 . 1 . . . . 34 ALA C . 15702 1 320 . 1 1 34 34 ALA CA C 13 51.1 0.2 . 1 . . . . 34 ALA CA . 15702 1 321 . 1 1 34 34 ALA CB C 13 21.9 0.2 . 1 . . . . 34 ALA CB . 15702 1 322 . 1 1 34 34 ALA N N 15 121.6 0.2 . 1 . . . . 34 ALA N . 15702 1 323 . 1 1 35 35 PHE H H 1 8.58 0.02 . 1 . . . . 35 PHE H . 15702 1 324 . 1 1 35 35 PHE HA H 1 4.74 0.02 . 1 . . . . 35 PHE HA . 15702 1 325 . 1 1 35 35 PHE HB2 H 1 3.02 0.02 . 2 . . . . 35 PHE HB2 . 15702 1 326 . 1 1 35 35 PHE HB3 H 1 3.36 0.02 . 2 . . . . 35 PHE HB3 . 15702 1 327 . 1 1 35 35 PHE HD1 H 1 6.62 0.02 . 3 . . . . 35 PHE HD1 . 15702 1 328 . 1 1 35 35 PHE HE1 H 1 6.39 0.02 . 3 . . . . 35 PHE HE1 . 15702 1 329 . 1 1 35 35 PHE HZ H 1 6.34 0.02 . 1 . . . . 35 PHE HZ . 15702 1 330 . 1 1 35 35 PHE C C 13 170.0 0.2 . 1 . . . . 35 PHE C . 15702 1 331 . 1 1 35 35 PHE CA C 13 57.1 0.2 . 1 . . . . 35 PHE CA . 15702 1 332 . 1 1 35 35 PHE CB C 13 39.7 0.2 . 1 . . . . 35 PHE CB . 15702 1 333 . 1 1 35 35 PHE CD1 C 13 132.2 0.2 . 3 . . . . 35 PHE CD1 . 15702 1 334 . 1 1 35 35 PHE CE1 C 13 130.2 0.2 . 3 . . . . 35 PHE CE1 . 15702 1 335 . 1 1 35 35 PHE CZ C 13 129.2 0.2 . 1 . . . . 35 PHE CZ . 15702 1 336 . 1 1 35 35 PHE N N 15 116.6 0.2 . 1 . . . . 35 PHE N . 15702 1 337 . 1 1 36 36 ALA H H 1 8.73 0.02 . 1 . . . . 36 ALA H . 15702 1 338 . 1 1 36 36 ALA HA H 1 5.17 0.02 . 1 . . . . 36 ALA HA . 15702 1 339 . 1 1 36 36 ALA HB1 H 1 1.65 0.02 . 1 . . . . 36 ALA HB . 15702 1 340 . 1 1 36 36 ALA HB2 H 1 1.65 0.02 . 1 . . . . 36 ALA HB . 15702 1 341 . 1 1 36 36 ALA HB3 H 1 1.65 0.02 . 1 . . . . 36 ALA HB . 15702 1 342 . 1 1 36 36 ALA CA C 13 49.1 0.2 . 1 . . . . 36 ALA CA . 15702 1 343 . 1 1 36 36 ALA CB C 13 20.5 0.2 . 1 . . . . 36 ALA CB . 15702 1 344 . 1 1 36 36 ALA N N 15 123.4 0.2 . 1 . . . . 36 ALA N . 15702 1 345 . 1 1 37 37 PRO HA H 1 4.74 0.02 . 1 . . . . 37 PRO HA . 15702 1 346 . 1 1 37 37 PRO HB2 H 1 2.05 0.02 . 2 . . . . 37 PRO HB2 . 15702 1 347 . 1 1 37 37 PRO HB3 H 1 2.48 0.02 . 2 . . . . 37 PRO HB3 . 15702 1 348 . 1 1 37 37 PRO HD2 H 1 3.96 0.02 . 2 . . . . 37 PRO HD2 . 15702 1 349 . 1 1 37 37 PRO HD3 H 1 4.63 0.02 . 2 . . . . 37 PRO HD3 . 15702 1 350 . 1 1 37 37 PRO C C 13 176.5 0.2 . 1 . . . . 37 PRO C . 15702 1 351 . 1 1 37 37 PRO CA C 13 66.2 0.2 . 1 . . . . 37 PRO CA . 15702 1 352 . 1 1 37 37 PRO CB C 13 33.6 0.2 . 1 . . . . 37 PRO CB . 15702 1 353 . 1 1 37 37 PRO CD C 13 51.0 0.2 . 1 . . . . 37 PRO CD . 15702 1 354 . 1 1 38 38 GLU H H 1 7.45 0.02 . 1 . . . . 38 GLU H . 15702 1 355 . 1 1 38 38 GLU HA H 1 4.79 0.02 . 1 . . . . 38 GLU HA . 15702 1 356 . 1 1 38 38 GLU HB2 H 1 1.89 0.02 . 2 . . . . 38 GLU HB2 . 15702 1 357 . 1 1 38 38 GLU HB3 H 1 2.04 0.02 . 2 . . . . 38 GLU HB3 . 15702 1 358 . 1 1 38 38 GLU HG2 H 1 2.17 0.02 . 2 . . . . 38 GLU HG2 . 15702 1 359 . 1 1 38 38 GLU HG3 H 1 2.19 0.02 . 2 . . . . 38 GLU HG3 . 15702 1 360 . 1 1 38 38 GLU C C 13 177.3 0.2 . 1 . . . . 38 GLU C . 15702 1 361 . 1 1 38 38 GLU CA C 13 54.2 0.2 . 1 . . . . 38 GLU CA . 15702 1 362 . 1 1 38 38 GLU CB C 13 32.6 0.2 . 1 . . . . 38 GLU CB . 15702 1 363 . 1 1 38 38 GLU CG C 13 37.0 0.2 . 1 . . . . 38 GLU CG . 15702 1 364 . 1 1 38 38 GLU N N 15 110.1 0.2 . 1 . . . . 38 GLU N . 15702 1 365 . 1 1 39 39 GLY H H 1 8.60 0.02 . 1 . . . . 39 GLY H . 15702 1 366 . 1 1 39 39 GLY HA2 H 1 3.92 0.02 . 2 . . . . 39 GLY HA2 . 15702 1 367 . 1 1 39 39 GLY HA3 H 1 4.44 0.02 . 2 . . . . 39 GLY HA3 . 15702 1 368 . 1 1 39 39 GLY CA C 13 44.4 0.2 . 1 . . . . 39 GLY CA . 15702 1 369 . 1 1 39 39 GLY N N 15 109.5 0.2 . 1 . . . . 39 GLY N . 15702 1 370 . 1 1 40 40 PRO HA H 1 4.55 0.02 . 1 . . . . 40 PRO HA . 15702 1 371 . 1 1 40 40 PRO HB2 H 1 1.82 0.02 . 2 . . . . 40 PRO HB2 . 15702 1 372 . 1 1 40 40 PRO HB3 H 1 2.28 0.02 . 2 . . . . 40 PRO HB3 . 15702 1 373 . 1 1 40 40 PRO HD2 H 1 3.62 0.02 . 2 . . . . 40 PRO HD2 . 15702 1 374 . 1 1 40 40 PRO HD3 H 1 3.76 0.02 . 2 . . . . 40 PRO HD3 . 15702 1 375 . 1 1 40 40 PRO C C 13 177.1 0.2 . 1 . . . . 40 PRO C . 15702 1 376 . 1 1 40 40 PRO CA C 13 62.5 0.2 . 1 . . . . 40 PRO CA . 15702 1 377 . 1 1 40 40 PRO CB C 13 32.7 0.2 . 1 . . . . 40 PRO CB . 15702 1 378 . 1 1 41 41 VAL H H 1 8.53 0.02 . 1 . . . . 41 VAL H . 15702 1 379 . 1 1 41 41 VAL HA H 1 3.90 0.02 . 1 . . . . 41 VAL HA . 15702 1 380 . 1 1 41 41 VAL HB H 1 1.70 0.02 . 1 . . . . 41 VAL HB . 15702 1 381 . 1 1 41 41 VAL HG11 H 1 -0.02 0.02 . 1 . . . . 41 VAL HG1 . 15702 1 382 . 1 1 41 41 VAL HG12 H 1 -0.02 0.02 . 1 . . . . 41 VAL HG1 . 15702 1 383 . 1 1 41 41 VAL HG13 H 1 -0.02 0.02 . 1 . . . . 41 VAL HG1 . 15702 1 384 . 1 1 41 41 VAL HG21 H 1 0.30 0.02 . 1 . . . . 41 VAL HG2 . 15702 1 385 . 1 1 41 41 VAL HG22 H 1 0.30 0.02 . 1 . . . . 41 VAL HG2 . 15702 1 386 . 1 1 41 41 VAL HG23 H 1 0.30 0.02 . 1 . . . . 41 VAL HG2 . 15702 1 387 . 1 1 41 41 VAL C C 13 175.2 0.2 . 1 . . . . 41 VAL C . 15702 1 388 . 1 1 41 41 VAL CA C 13 63.0 0.2 . 1 . . . . 41 VAL CA . 15702 1 389 . 1 1 41 41 VAL CB C 13 31.1 0.2 . 1 . . . . 41 VAL CB . 15702 1 390 . 1 1 41 41 VAL CG1 C 13 21.9 0.2 . 1 . . . . 41 VAL CG1 . 15702 1 391 . 1 1 41 41 VAL CG2 C 13 20.1 0.2 . 1 . . . . 41 VAL CG2 . 15702 1 392 . 1 1 41 41 VAL N N 15 123.0 0.2 . 1 . . . . 41 VAL N . 15702 1 393 . 1 1 42 42 ALA H H 1 8.32 0.02 . 1 . . . . 42 ALA H . 15702 1 394 . 1 1 42 42 ALA HA H 1 4.75 0.02 . 1 . . . . 42 ALA HA . 15702 1 395 . 1 1 42 42 ALA HB1 H 1 1.49 0.02 . 1 . . . . 42 ALA HB . 15702 1 396 . 1 1 42 42 ALA HB2 H 1 1.49 0.02 . 1 . . . . 42 ALA HB . 15702 1 397 . 1 1 42 42 ALA HB3 H 1 1.49 0.02 . 1 . . . . 42 ALA HB . 15702 1 398 . 1 1 42 42 ALA C C 13 177.4 0.2 . 1 . . . . 42 ALA C . 15702 1 399 . 1 1 42 42 ALA CA C 13 50.8 0.2 . 1 . . . . 42 ALA CA . 15702 1 400 . 1 1 42 42 ALA CB C 13 21.4 0.2 . 1 . . . . 42 ALA CB . 15702 1 401 . 1 1 42 42 ALA N N 15 131.3 0.2 . 1 . . . . 42 ALA N . 15702 1 402 . 1 1 43 43 SER H H 1 8.66 0.02 . 1 . . . . 43 SER H . 15702 1 403 . 1 1 43 43 SER HA H 1 4.69 0.02 . 1 . . . . 43 SER HA . 15702 1 404 . 1 1 43 43 SER HB2 H 1 3.81 0.02 . 2 . . . . 43 SER HB2 . 15702 1 405 . 1 1 43 43 SER HB3 H 1 3.84 0.02 . 2 . . . . 43 SER HB3 . 15702 1 406 . 1 1 43 43 SER CA C 13 59.0 0.2 . 1 . . . . 43 SER CA . 15702 1 407 . 1 1 43 43 SER CB C 13 62.8 0.2 . 1 . . . . 43 SER CB . 15702 1 408 . 1 1 43 43 SER N N 15 115.4 0.2 . 1 . . . . 43 SER N . 15702 1 409 . 1 1 44 44 TRP HA H 1 5.47 0.02 . 1 . . . . 44 TRP HA . 15702 1 410 . 1 1 44 44 TRP HB2 H 1 2.53 0.02 . 2 . . . . 44 TRP HB2 . 15702 1 411 . 1 1 44 44 TRP HB3 H 1 3.29 0.02 . 2 . . . . 44 TRP HB3 . 15702 1 412 . 1 1 44 44 TRP HD1 H 1 7.47 0.02 . 1 . . . . 44 TRP HD1 . 15702 1 413 . 1 1 44 44 TRP HE1 H 1 9.71 0.02 . 1 . . . . 44 TRP HE1 . 15702 1 414 . 1 1 44 44 TRP HE3 H 1 7.19 0.02 . 1 . . . . 44 TRP HE3 . 15702 1 415 . 1 1 44 44 TRP HH2 H 1 6.66 0.02 . 1 . . . . 44 TRP HH2 . 15702 1 416 . 1 1 44 44 TRP HZ2 H 1 6.70 0.02 . 1 . . . . 44 TRP HZ2 . 15702 1 417 . 1 1 44 44 TRP HZ3 H 1 6.56 0.02 . 1 . . . . 44 TRP HZ3 . 15702 1 418 . 1 1 44 44 TRP CA C 13 52.2 0.2 . 1 . . . . 44 TRP CA . 15702 1 419 . 1 1 44 44 TRP CB C 13 31.0 0.2 . 1 . . . . 44 TRP CB . 15702 1 420 . 1 1 44 44 TRP CD1 C 13 124.8 0.2 . 1 . . . . 44 TRP CD1 . 15702 1 421 . 1 1 44 44 TRP CE3 C 13 121.3 0.2 . 1 . . . . 44 TRP CE3 . 15702 1 422 . 1 1 44 44 TRP CH2 C 13 123.9 0.2 . 1 . . . . 44 TRP CH2 . 15702 1 423 . 1 1 44 44 TRP CZ2 C 13 112.2 0.2 . 1 . . . . 44 TRP CZ2 . 15702 1 424 . 1 1 44 44 TRP CZ3 C 13 121.4 0.2 . 1 . . . . 44 TRP CZ3 . 15702 1 425 . 1 1 44 44 TRP NE1 N 15 127.9 0.2 . 1 . . . . 44 TRP NE1 . 15702 1 426 . 1 1 45 45 PRO HA H 1 4.55 0.02 . 1 . . . . 45 PRO HA . 15702 1 427 . 1 1 45 45 PRO HB2 H 1 1.71 0.02 . 2 . . . . 45 PRO HB2 . 15702 1 428 . 1 1 45 45 PRO HB3 H 1 2.16 0.02 . 2 . . . . 45 PRO HB3 . 15702 1 429 . 1 1 45 45 PRO HD2 H 1 3.43 0.02 . 2 . . . . 45 PRO HD2 . 15702 1 430 . 1 1 45 45 PRO HD3 H 1 3.72 0.02 . 2 . . . . 45 PRO HD3 . 15702 1 431 . 1 1 45 45 PRO C C 13 173.0 0.2 . 1 . . . . 45 PRO C . 15702 1 432 . 1 1 45 45 PRO CA C 13 63.3 0.2 . 1 . . . . 45 PRO CA . 15702 1 433 . 1 1 45 45 PRO CB C 13 27.8 0.2 . 1 . . . . 45 PRO CB . 15702 1 434 . 1 1 45 45 PRO CD C 13 51.1 0.2 . 1 . . . . 45 PRO CD . 15702 1 435 . 1 1 46 46 VAL H H 1 8.39 0.02 . 1 . . . . 46 VAL H . 15702 1 436 . 1 1 46 46 VAL HA H 1 3.77 0.02 . 1 . . . . 46 VAL HA . 15702 1 437 . 1 1 46 46 VAL HB H 1 0.95 0.02 . 1 . . . . 46 VAL HB . 15702 1 438 . 1 1 46 46 VAL HG11 H 1 -0.01 0.02 . 1 . . . . 46 VAL HG1 . 15702 1 439 . 1 1 46 46 VAL HG12 H 1 -0.01 0.02 . 1 . . . . 46 VAL HG1 . 15702 1 440 . 1 1 46 46 VAL HG13 H 1 -0.01 0.02 . 1 . . . . 46 VAL HG1 . 15702 1 441 . 1 1 46 46 VAL HG21 H 1 -0.59 0.02 . 1 . . . . 46 VAL HG2 . 15702 1 442 . 1 1 46 46 VAL HG22 H 1 -0.59 0.02 . 1 . . . . 46 VAL HG2 . 15702 1 443 . 1 1 46 46 VAL HG23 H 1 -0.59 0.02 . 1 . . . . 46 VAL HG2 . 15702 1 444 . 1 1 46 46 VAL C C 13 174.1 0.2 . 1 . . . . 46 VAL C . 15702 1 445 . 1 1 46 46 VAL CA C 13 61.1 0.2 . 1 . . . . 46 VAL CA . 15702 1 446 . 1 1 46 46 VAL CB C 13 35.2 0.2 . 1 . . . . 46 VAL CB . 15702 1 447 . 1 1 46 46 VAL CG1 C 13 21.6 0.2 . 1 . . . . 46 VAL CG1 . 15702 1 448 . 1 1 46 46 VAL CG2 C 13 20.5 0.2 . 1 . . . . 46 VAL CG2 . 15702 1 449 . 1 1 46 46 VAL N N 15 124.3 0.2 . 1 . . . . 46 VAL N . 15702 1 450 . 1 1 47 47 GLN H H 1 8.97 0.02 . 1 . . . . 47 GLN H . 15702 1 451 . 1 1 47 47 GLN HA H 1 4.43 0.02 . 1 . . . . 47 GLN HA . 15702 1 452 . 1 1 47 47 GLN HB2 H 1 1.95 0.02 . 2 . . . . 47 GLN HB2 . 15702 1 453 . 1 1 47 47 GLN HB3 H 1 2.10 0.02 . 2 . . . . 47 GLN HB3 . 15702 1 454 . 1 1 47 47 GLN HG2 H 1 2.28 0.02 . 2 . . . . 47 GLN HG2 . 15702 1 455 . 1 1 47 47 GLN HG3 H 1 2.30 0.02 . 2 . . . . 47 GLN HG3 . 15702 1 456 . 1 1 47 47 GLN C C 13 175.1 0.2 . 1 . . . . 47 GLN C . 15702 1 457 . 1 1 47 47 GLN CA C 13 56.4 0.2 . 1 . . . . 47 GLN CA . 15702 1 458 . 1 1 47 47 GLN CB C 13 30.9 0.2 . 1 . . . . 47 GLN CB . 15702 1 459 . 1 1 47 47 GLN N N 15 122.0 0.2 . 1 . . . . 47 GLN N . 15702 1 460 . 1 1 48 48 ARG H H 1 7.72 0.02 . 1 . . . . 48 ARG H . 15702 1 461 . 1 1 48 48 ARG HA H 1 4.75 0.02 . 1 . . . . 48 ARG HA . 15702 1 462 . 1 1 48 48 ARG HB2 H 1 1.63 0.02 . 2 . . . . 48 ARG HB2 . 15702 1 463 . 1 1 48 48 ARG HB3 H 1 1.90 0.02 . 2 . . . . 48 ARG HB3 . 15702 1 464 . 1 1 48 48 ARG HD2 H 1 3.11 0.02 . 2 . . . . 48 ARG HD2 . 15702 1 465 . 1 1 48 48 ARG HD3 H 1 3.15 0.02 . 2 . . . . 48 ARG HD3 . 15702 1 466 . 1 1 48 48 ARG HG2 H 1 1.27 0.02 . 2 . . . . 48 ARG HG2 . 15702 1 467 . 1 1 48 48 ARG HG3 H 1 1.58 0.02 . 2 . . . . 48 ARG HG3 . 15702 1 468 . 1 1 48 48 ARG CA C 13 52.8 0.2 . 1 . . . . 48 ARG CA . 15702 1 469 . 1 1 48 48 ARG CB C 13 30.5 0.2 . 1 . . . . 48 ARG CB . 15702 1 470 . 1 1 48 48 ARG CG C 13 26.1 0.2 . 1 . . . . 48 ARG CG . 15702 1 471 . 1 1 48 48 ARG N N 15 116.6 0.2 . 1 . . . . 48 ARG N . 15702 1 472 . 1 1 49 49 PRO HA H 1 3.75 0.02 . 1 . . . . 49 PRO HA . 15702 1 473 . 1 1 49 49 PRO HB2 H 1 1.44 0.02 . 2 . . . . 49 PRO HB2 . 15702 1 474 . 1 1 49 49 PRO HB3 H 1 1.71 0.02 . 2 . . . . 49 PRO HB3 . 15702 1 475 . 1 1 49 49 PRO HD2 H 1 3.49 0.02 . 2 . . . . 49 PRO HD2 . 15702 1 476 . 1 1 49 49 PRO HD3 H 1 3.69 0.02 . 2 . . . . 49 PRO HD3 . 15702 1 477 . 1 1 49 49 PRO C C 13 177.5 0.2 . 1 . . . . 49 PRO C . 15702 1 478 . 1 1 49 49 PRO CA C 13 65.4 0.2 . 1 . . . . 49 PRO CA . 15702 1 479 . 1 1 49 49 PRO CB C 13 30.7 0.2 . 1 . . . . 49 PRO CB . 15702 1 480 . 1 1 49 49 PRO CD C 13 50.1 0.2 . 1 . . . . 49 PRO CD . 15702 1 481 . 1 1 50 50 ALA H H 1 7.96 0.02 . 1 . . . . 50 ALA H . 15702 1 482 . 1 1 50 50 ALA HA H 1 4.01 0.02 . 1 . . . . 50 ALA HA . 15702 1 483 . 1 1 50 50 ALA HB1 H 1 1.26 0.02 . 1 . . . . 50 ALA HB . 15702 1 484 . 1 1 50 50 ALA HB2 H 1 1.26 0.02 . 1 . . . . 50 ALA HB . 15702 1 485 . 1 1 50 50 ALA HB3 H 1 1.26 0.02 . 1 . . . . 50 ALA HB . 15702 1 486 . 1 1 50 50 ALA C C 13 177.3 0.2 . 1 . . . . 50 ALA C . 15702 1 487 . 1 1 50 50 ALA CA C 13 53.8 0.2 . 1 . . . . 50 ALA CA . 15702 1 488 . 1 1 50 50 ALA CB C 13 18.5 0.2 . 1 . . . . 50 ALA CB . 15702 1 489 . 1 1 50 50 ALA N N 15 117.2 0.2 . 1 . . . . 50 ALA N . 15702 1 490 . 1 1 51 51 ASP H H 1 7.57 0.02 . 1 . . . . 51 ASP H . 15702 1 491 . 1 1 51 51 ASP HA H 1 4.41 0.02 . 1 . . . . 51 ASP HA . 15702 1 492 . 1 1 51 51 ASP HB2 H 1 2.69 0.02 . 2 . . . . 51 ASP HB2 . 15702 1 493 . 1 1 51 51 ASP HB3 H 1 2.80 0.02 . 2 . . . . 51 ASP HB3 . 15702 1 494 . 1 1 51 51 ASP C C 13 176.0 0.2 . 1 . . . . 51 ASP C . 15702 1 495 . 1 1 51 51 ASP CA C 13 54.2 0.2 . 1 . . . . 51 ASP CA . 15702 1 496 . 1 1 51 51 ASP CB C 13 41.9 0.2 . 1 . . . . 51 ASP CB . 15702 1 497 . 1 1 51 51 ASP N N 15 114.8 0.2 . 1 . . . . 51 ASP N . 15702 1 498 . 1 1 52 52 ILE H H 1 7.29 0.02 . 1 . . . . 52 ILE H . 15702 1 499 . 1 1 52 52 ILE HA H 1 3.10 0.02 . 1 . . . . 52 ILE HA . 15702 1 500 . 1 1 52 52 ILE HB H 1 1.76 0.02 . 1 . . . . 52 ILE HB . 15702 1 501 . 1 1 52 52 ILE HD11 H 1 0.86 0.02 . 1 . . . . 52 ILE HD1 . 15702 1 502 . 1 1 52 52 ILE HD12 H 1 0.86 0.02 . 1 . . . . 52 ILE HD1 . 15702 1 503 . 1 1 52 52 ILE HD13 H 1 0.86 0.02 . 1 . . . . 52 ILE HD1 . 15702 1 504 . 1 1 52 52 ILE HG12 H 1 1.63 0.02 . 2 . . . . 52 ILE HG12 . 15702 1 505 . 1 1 52 52 ILE HG13 H 1 1.65 0.02 . 2 . . . . 52 ILE HG13 . 15702 1 506 . 1 1 52 52 ILE HG21 H 1 0.85 0.02 . 1 . . . . 52 ILE HG2 . 15702 1 507 . 1 1 52 52 ILE HG22 H 1 0.85 0.02 . 1 . . . . 52 ILE HG2 . 15702 1 508 . 1 1 52 52 ILE HG23 H 1 0.85 0.02 . 1 . . . . 52 ILE HG2 . 15702 1 509 . 1 1 52 52 ILE C C 13 174.8 0.2 . 1 . . . . 52 ILE C . 15702 1 510 . 1 1 52 52 ILE CA C 13 65.1 0.2 . 1 . . . . 52 ILE CA . 15702 1 511 . 1 1 52 52 ILE CB C 13 37.1 0.2 . 1 . . . . 52 ILE CB . 15702 1 512 . 1 1 52 52 ILE CD1 C 13 13.6 0.2 . 1 . . . . 52 ILE CD1 . 15702 1 513 . 1 1 52 52 ILE CG1 C 13 29.5 0.2 . 1 . . . . 52 ILE CG1 . 15702 1 514 . 1 1 52 52 ILE CG2 C 13 18.3 0.2 . 1 . . . . 52 ILE CG2 . 15702 1 515 . 1 1 52 52 ILE N N 15 117.7 0.2 . 1 . . . . 52 ILE N . 15702 1 516 . 1 1 53 53 THR H H 1 6.56 0.02 . 1 . . . . 53 THR H . 15702 1 517 . 1 1 53 53 THR HA H 1 4.72 0.02 . 1 . . . . 53 THR HA . 15702 1 518 . 1 1 53 53 THR HB H 1 4.68 0.02 . 1 . . . . 53 THR HB . 15702 1 519 . 1 1 53 53 THR HG21 H 1 1.21 0.02 . 1 . . . . 53 THR HG2 . 15702 1 520 . 1 1 53 53 THR HG22 H 1 1.21 0.02 . 1 . . . . 53 THR HG2 . 15702 1 521 . 1 1 53 53 THR HG23 H 1 1.21 0.02 . 1 . . . . 53 THR HG2 . 15702 1 522 . 1 1 53 53 THR C C 13 174.6 0.2 . 1 . . . . 53 THR C . 15702 1 523 . 1 1 53 53 THR CA C 13 58.5 0.2 . 1 . . . . 53 THR CA . 15702 1 524 . 1 1 53 53 THR CB C 13 72.9 0.2 . 1 . . . . 53 THR CB . 15702 1 525 . 1 1 53 53 THR CG2 C 13 21.3 0.2 . 1 . . . . 53 THR CG2 . 15702 1 526 . 1 1 53 53 THR N N 15 117.3 0.2 . 1 . . . . 53 THR N . 15702 1 527 . 1 1 54 54 ALA H H 1 9.34 0.02 . 1 . . . . 54 ALA H . 15702 1 528 . 1 1 54 54 ALA HA H 1 4.46 0.02 . 1 . . . . 54 ALA HA . 15702 1 529 . 1 1 54 54 ALA HB1 H 1 1.53 0.02 . 1 . . . . 54 ALA HB . 15702 1 530 . 1 1 54 54 ALA HB2 H 1 1.53 0.02 . 1 . . . . 54 ALA HB . 15702 1 531 . 1 1 54 54 ALA HB3 H 1 1.53 0.02 . 1 . . . . 54 ALA HB . 15702 1 532 . 1 1 54 54 ALA C C 13 167.4 0.2 . 1 . . . . 54 ALA C . 15702 1 533 . 1 1 54 54 ALA CA C 13 55.8 0.2 . 1 . . . . 54 ALA CA . 15702 1 534 . 1 1 54 54 ALA CB C 13 18.2 0.2 . 1 . . . . 54 ALA CB . 15702 1 535 . 1 1 54 54 ALA N N 15 123.8 0.2 . 1 . . . . 54 ALA N . 15702 1 536 . 1 1 55 55 SER H H 1 8.53 0.02 . 1 . . . . 55 SER H . 15702 1 537 . 1 1 55 55 SER HA H 1 4.28 0.02 . 1 . . . . 55 SER HA . 15702 1 538 . 1 1 55 55 SER HB2 H 1 3.82 0.02 . 2 . . . . 55 SER HB2 . 15702 1 539 . 1 1 55 55 SER HB3 H 1 3.88 0.02 . 2 . . . . 55 SER HB3 . 15702 1 540 . 1 1 55 55 SER HG H 1 5.66 0.02 . 1 . . . . 55 SER HG . 15702 1 541 . 1 1 55 55 SER C C 13 177.7 0.2 . 1 . . . . 55 SER C . 15702 1 542 . 1 1 55 55 SER CA C 13 61.6 0.2 . 1 . . . . 55 SER CA . 15702 1 543 . 1 1 55 55 SER CB C 13 62.6 0.2 . 1 . . . . 55 SER CB . 15702 1 544 . 1 1 55 55 SER N N 15 112.6 0.2 . 1 . . . . 55 SER N . 15702 1 545 . 1 1 56 56 LEU H H 1 7.81 0.02 . 1 . . . . 56 LEU H . 15702 1 546 . 1 1 56 56 LEU HA H 1 4.28 0.02 . 1 . . . . 56 LEU HA . 15702 1 547 . 1 1 56 56 LEU HB2 H 1 1.21 0.02 . 2 . . . . 56 LEU HB2 . 15702 1 548 . 1 1 56 56 LEU HB3 H 1 1.76 0.02 . 2 . . . . 56 LEU HB3 . 15702 1 549 . 1 1 56 56 LEU HD11 H 1 0.68 0.02 . 1 . . . . 56 LEU HD1 . 15702 1 550 . 1 1 56 56 LEU HD12 H 1 0.68 0.02 . 1 . . . . 56 LEU HD1 . 15702 1 551 . 1 1 56 56 LEU HD13 H 1 0.68 0.02 . 1 . . . . 56 LEU HD1 . 15702 1 552 . 1 1 56 56 LEU HD21 H 1 0.58 0.02 . 1 . . . . 56 LEU HD2 . 15702 1 553 . 1 1 56 56 LEU HD22 H 1 0.58 0.02 . 1 . . . . 56 LEU HD2 . 15702 1 554 . 1 1 56 56 LEU HD23 H 1 0.58 0.02 . 1 . . . . 56 LEU HD2 . 15702 1 555 . 1 1 56 56 LEU HG H 1 1.52 0.02 . 1 . . . . 56 LEU HG . 15702 1 556 . 1 1 56 56 LEU C C 13 168.1 0.2 . 1 . . . . 56 LEU C . 15702 1 557 . 1 1 56 56 LEU CA C 13 57.9 0.2 . 1 . . . . 56 LEU CA . 15702 1 558 . 1 1 56 56 LEU CB C 13 42.1 0.2 . 1 . . . . 56 LEU CB . 15702 1 559 . 1 1 56 56 LEU CD1 C 13 25.9 0.2 . 1 . . . . 56 LEU CD1 . 15702 1 560 . 1 1 56 56 LEU CD2 C 13 22.9 0.2 . 1 . . . . 56 LEU CD2 . 15702 1 561 . 1 1 56 56 LEU CG C 13 27.6 0.2 . 1 . . . . 56 LEU CG . 15702 1 562 . 1 1 56 56 LEU N N 15 122.5 0.2 . 1 . . . . 56 LEU N . 15702 1 563 . 1 1 57 57 LEU H H 1 8.49 0.02 . 1 . . . . 57 LEU H . 15702 1 564 . 1 1 57 57 LEU HA H 1 4.18 0.02 . 1 . . . . 57 LEU HA . 15702 1 565 . 1 1 57 57 LEU HB2 H 1 1.21 0.02 . 2 . . . . 57 LEU HB2 . 15702 1 566 . 1 1 57 57 LEU HB3 H 1 2.21 0.02 . 2 . . . . 57 LEU HB3 . 15702 1 567 . 1 1 57 57 LEU HD11 H 1 0.78 0.02 . 1 . . . . 57 LEU HD1 . 15702 1 568 . 1 1 57 57 LEU HD12 H 1 0.78 0.02 . 1 . . . . 57 LEU HD1 . 15702 1 569 . 1 1 57 57 LEU HD13 H 1 0.78 0.02 . 1 . . . . 57 LEU HD1 . 15702 1 570 . 1 1 57 57 LEU HD21 H 1 0.83 0.02 . 1 . . . . 57 LEU HD2 . 15702 1 571 . 1 1 57 57 LEU HD22 H 1 0.83 0.02 . 1 . . . . 57 LEU HD2 . 15702 1 572 . 1 1 57 57 LEU HD23 H 1 0.83 0.02 . 1 . . . . 57 LEU HD2 . 15702 1 573 . 1 1 57 57 LEU HG H 1 1.86 0.02 . 1 . . . . 57 LEU HG . 15702 1 574 . 1 1 57 57 LEU C C 13 178.0 0.2 . 1 . . . . 57 LEU C . 15702 1 575 . 1 1 57 57 LEU CA C 13 58.3 0.2 . 1 . . . . 57 LEU CA . 15702 1 576 . 1 1 57 57 LEU CB C 13 41.2 0.2 . 1 . . . . 57 LEU CB . 15702 1 577 . 1 1 57 57 LEU CD1 C 13 26.6 0.2 . 1 . . . . 57 LEU CD1 . 15702 1 578 . 1 1 57 57 LEU CD2 C 13 23.8 0.2 . 1 . . . . 57 LEU CD2 . 15702 1 579 . 1 1 57 57 LEU CG C 13 26.4 0.2 . 1 . . . . 57 LEU CG . 15702 1 580 . 1 1 57 57 LEU N N 15 123.9 0.2 . 1 . . . . 57 LEU N . 15702 1 581 . 1 1 58 58 GLN H H 1 8.50 0.02 . 1 . . . . 58 GLN H . 15702 1 582 . 1 1 58 58 GLN HA H 1 3.68 0.02 . 1 . . . . 58 GLN HA . 15702 1 583 . 1 1 58 58 GLN HB2 H 1 1.98 0.02 . 2 . . . . 58 GLN HB2 . 15702 1 584 . 1 1 58 58 GLN HB3 H 1 2.31 0.02 . 2 . . . . 58 GLN HB3 . 15702 1 585 . 1 1 58 58 GLN HE21 H 1 6.86 0.02 . 2 . . . . 58 GLN HE21 . 15702 1 586 . 1 1 58 58 GLN HE22 H 1 6.90 0.02 . 2 . . . . 58 GLN HE22 . 15702 1 587 . 1 1 58 58 GLN HG2 H 1 2.02 0.02 . 2 . . . . 58 GLN HG2 . 15702 1 588 . 1 1 58 58 GLN HG3 H 1 2.38 0.02 . 2 . . . . 58 GLN HG3 . 15702 1 589 . 1 1 58 58 GLN C C 13 178.2 0.2 . 1 . . . . 58 GLN C . 15702 1 590 . 1 1 58 58 GLN CA C 13 60.2 0.2 . 1 . . . . 58 GLN CA . 15702 1 591 . 1 1 58 58 GLN CB C 13 28.5 0.2 . 1 . . . . 58 GLN CB . 15702 1 592 . 1 1 58 58 GLN CG C 13 35.6 0.2 . 1 . . . . 58 GLN CG . 15702 1 593 . 1 1 58 58 GLN N N 15 118.8 0.2 . 1 . . . . 58 GLN N . 15702 1 594 . 1 1 58 58 GLN NE2 N 15 109.5 0.2 . 1 . . . . 58 GLN NE2 . 15702 1 595 . 1 1 59 59 GLN H H 1 8.30 0.02 . 1 . . . . 59 GLN H . 15702 1 596 . 1 1 59 59 GLN HA H 1 4.09 0.02 . 1 . . . . 59 GLN HA . 15702 1 597 . 1 1 59 59 GLN HB2 H 1 2.26 0.02 . 2 . . . . 59 GLN HB2 . 15702 1 598 . 1 1 59 59 GLN HB3 H 1 2.32 0.02 . 2 . . . . 59 GLN HB3 . 15702 1 599 . 1 1 59 59 GLN HG2 H 1 2.32 0.02 . 2 . . . . 59 GLN HG2 . 15702 1 600 . 1 1 59 59 GLN HG3 H 1 2.53 0.02 . 2 . . . . 59 GLN HG3 . 15702 1 601 . 1 1 59 59 GLN C C 13 179.9 0.2 . 1 . . . . 59 GLN C . 15702 1 602 . 1 1 59 59 GLN CA C 13 58.9 0.2 . 1 . . . . 59 GLN CA . 15702 1 603 . 1 1 59 59 GLN CB C 13 28.8 0.2 . 1 . . . . 59 GLN CB . 15702 1 604 . 1 1 59 59 GLN CG C 13 33.6 0.2 . 1 . . . . 59 GLN CG . 15702 1 605 . 1 1 59 59 GLN N N 15 118.6 0.2 . 1 . . . . 59 GLN N . 15702 1 606 . 1 1 60 60 ALA H H 1 7.85 0.02 . 1 . . . . 60 ALA H . 15702 1 607 . 1 1 60 60 ALA HA H 1 3.58 0.02 . 1 . . . . 60 ALA HA . 15702 1 608 . 1 1 60 60 ALA HB1 H 1 0.72 0.02 . 1 . . . . 60 ALA HB . 15702 1 609 . 1 1 60 60 ALA HB2 H 1 0.72 0.02 . 1 . . . . 60 ALA HB . 15702 1 610 . 1 1 60 60 ALA HB3 H 1 0.72 0.02 . 1 . . . . 60 ALA HB . 15702 1 611 . 1 1 60 60 ALA C C 13 176.7 0.2 . 1 . . . . 60 ALA C . 15702 1 612 . 1 1 60 60 ALA CA C 13 54.7 0.2 . 1 . . . . 60 ALA CA . 15702 1 613 . 1 1 60 60 ALA CB C 13 17.4 0.2 . 1 . . . . 60 ALA CB . 15702 1 614 . 1 1 60 60 ALA N N 15 122.5 0.2 . 1 . . . . 60 ALA N . 15702 1 615 . 1 1 61 61 ALA H H 1 7.54 0.02 . 1 . . . . 61 ALA H . 15702 1 616 . 1 1 61 61 ALA HA H 1 3.97 0.02 . 1 . . . . 61 ALA HA . 15702 1 617 . 1 1 61 61 ALA HB1 H 1 1.26 0.02 . 1 . . . . 61 ALA HB . 15702 1 618 . 1 1 61 61 ALA HB2 H 1 1.26 0.02 . 1 . . . . 61 ALA HB . 15702 1 619 . 1 1 61 61 ALA HB3 H 1 1.26 0.02 . 1 . . . . 61 ALA HB . 15702 1 620 . 1 1 61 61 ALA C C 13 176.3 0.2 . 1 . . . . 61 ALA C . 15702 1 621 . 1 1 61 61 ALA CA C 13 52.4 0.2 . 1 . . . . 61 ALA CA . 15702 1 622 . 1 1 61 61 ALA CB C 13 19.1 0.2 . 1 . . . . 61 ALA CB . 15702 1 623 . 1 1 61 61 ALA N N 15 113.7 0.2 . 1 . . . . 61 ALA N . 15702 1 624 . 1 1 62 62 GLY H H 1 7.60 0.02 . 1 . . . . 62 GLY H . 15702 1 625 . 1 1 62 62 GLY HA2 H 1 3.89 0.02 . 2 . . . . 62 GLY HA2 . 15702 1 626 . 1 1 62 62 GLY HA3 H 1 3.98 0.02 . 2 . . . . 62 GLY HA3 . 15702 1 627 . 1 1 62 62 GLY C C 13 175.4 0.2 . 1 . . . . 62 GLY C . 15702 1 628 . 1 1 62 62 GLY CA C 13 45.8 0.2 . 1 . . . . 62 GLY CA . 15702 1 629 . 1 1 62 62 GLY N N 15 104.8 0.2 . 1 . . . . 62 GLY N . 15702 1 630 . 1 1 63 63 LEU H H 1 7.77 0.02 . 1 . . . . 63 LEU H . 15702 1 631 . 1 1 63 63 LEU HA H 1 4.43 0.02 . 1 . . . . 63 LEU HA . 15702 1 632 . 1 1 63 63 LEU HB2 H 1 1.43 0.02 . 2 . . . . 63 LEU HB2 . 15702 1 633 . 1 1 63 63 LEU HB3 H 1 1.65 0.02 . 2 . . . . 63 LEU HB3 . 15702 1 634 . 1 1 63 63 LEU HD11 H 1 0.82 0.02 . 1 . . . . 63 LEU HD1 . 15702 1 635 . 1 1 63 63 LEU HD12 H 1 0.82 0.02 . 1 . . . . 63 LEU HD1 . 15702 1 636 . 1 1 63 63 LEU HD13 H 1 0.82 0.02 . 1 . . . . 63 LEU HD1 . 15702 1 637 . 1 1 63 63 LEU HD21 H 1 0.79 0.02 . 1 . . . . 63 LEU HD2 . 15702 1 638 . 1 1 63 63 LEU HD22 H 1 0.79 0.02 . 1 . . . . 63 LEU HD2 . 15702 1 639 . 1 1 63 63 LEU HD23 H 1 0.79 0.02 . 1 . . . . 63 LEU HD2 . 15702 1 640 . 1 1 63 63 LEU C C 13 176.4 0.2 . 1 . . . . 63 LEU C . 15702 1 641 . 1 1 63 63 LEU CA C 13 54.0 0.2 . 1 . . . . 63 LEU CA . 15702 1 642 . 1 1 63 63 LEU CB C 13 42.5 0.2 . 1 . . . . 63 LEU CB . 15702 1 643 . 1 1 63 63 LEU CD1 C 13 26.4 0.2 . 1 . . . . 63 LEU CD1 . 15702 1 644 . 1 1 63 63 LEU CD2 C 13 22.9 0.2 . 1 . . . . 63 LEU CD2 . 15702 1 645 . 1 1 63 63 LEU N N 15 119.1 0.2 . 1 . . . . 63 LEU N . 15702 1 646 . 1 1 64 64 ALA H H 1 8.06 0.02 . 1 . . . . 64 ALA H . 15702 1 647 . 1 1 64 64 ALA HA H 1 4.16 0.02 . 1 . . . . 64 ALA HA . 15702 1 648 . 1 1 64 64 ALA HB1 H 1 1.31 0.02 . 1 . . . . 64 ALA HB . 15702 1 649 . 1 1 64 64 ALA HB2 H 1 1.31 0.02 . 1 . . . . 64 ALA HB . 15702 1 650 . 1 1 64 64 ALA HB3 H 1 1.31 0.02 . 1 . . . . 64 ALA HB . 15702 1 651 . 1 1 64 64 ALA C C 13 177.3 0.2 . 1 . . . . 64 ALA C . 15702 1 652 . 1 1 64 64 ALA CA C 13 52.7 0.2 . 1 . . . . 64 ALA CA . 15702 1 653 . 1 1 64 64 ALA CB C 13 19.7 0.2 . 1 . . . . 64 ALA CB . 15702 1 654 . 1 1 64 64 ALA N N 15 122.9 0.2 . 1 . . . . 64 ALA N . 15702 1 655 . 1 1 65 65 GLU H H 1 8.26 0.02 . 1 . . . . 65 GLU H . 15702 1 656 . 1 1 65 65 GLU C C 13 176.3 0.2 . 1 . . . . 65 GLU C . 15702 1 657 . 1 1 65 65 GLU CA C 13 56.4 0.2 . 1 . . . . 65 GLU CA . 15702 1 658 . 1 1 65 65 GLU CB C 13 30.1 0.2 . 1 . . . . 65 GLU CB . 15702 1 659 . 1 1 65 65 GLU N N 15 118.9 0.2 . 1 . . . . 65 GLU N . 15702 1 660 . 1 1 66 66 VAL H H 1 7.96 0.02 . 1 . . . . 66 VAL H . 15702 1 661 . 1 1 66 66 VAL HA H 1 4.02 0.02 . 1 . . . . 66 VAL HA . 15702 1 662 . 1 1 66 66 VAL HB H 1 1.98 0.02 . 1 . . . . 66 VAL HB . 15702 1 663 . 1 1 66 66 VAL C C 13 175.9 0.2 . 1 . . . . 66 VAL C . 15702 1 664 . 1 1 66 66 VAL CA C 13 62.3 0.2 . 1 . . . . 66 VAL CA . 15702 1 665 . 1 1 66 66 VAL CB C 13 32.8 0.2 . 1 . . . . 66 VAL CB . 15702 1 666 . 1 1 66 66 VAL N N 15 121.5 0.2 . 1 . . . . 66 VAL N . 15702 1 667 . 1 1 67 67 VAL H H 1 8.21 0.02 . 1 . . . . 67 VAL H . 15702 1 668 . 1 1 67 67 VAL C C 13 175.8 0.2 . 1 . . . . 67 VAL C . 15702 1 669 . 1 1 67 67 VAL CA C 13 62.2 0.2 . 1 . . . . 67 VAL CA . 15702 1 670 . 1 1 67 67 VAL CB C 13 32.6 0.2 . 1 . . . . 67 VAL CB . 15702 1 671 . 1 1 67 67 VAL N N 15 124.9 0.2 . 1 . . . . 67 VAL N . 15702 1 672 . 1 1 68 68 ARG H H 1 8.38 0.02 . 1 . . . . 68 ARG H . 15702 1 673 . 1 1 68 68 ARG HA H 1 4.27 0.02 . 1 . . . . 68 ARG HA . 15702 1 674 . 1 1 68 68 ARG C C 13 175.4 0.2 . 1 . . . . 68 ARG C . 15702 1 675 . 1 1 68 68 ARG CA C 13 55.7 0.2 . 1 . . . . 68 ARG CA . 15702 1 676 . 1 1 68 68 ARG CB C 13 31.1 0.2 . 1 . . . . 68 ARG CB . 15702 1 677 . 1 1 68 68 ARG N N 15 125.9 0.2 . 1 . . . . 68 ARG N . 15702 1 678 . 1 1 69 69 ASP H H 1 8.39 0.02 . 1 . . . . 69 ASP H . 15702 1 679 . 1 1 69 69 ASP HA H 1 4.80 0.02 . 1 . . . . 69 ASP HA . 15702 1 680 . 1 1 69 69 ASP HB2 H 1 2.54 0.02 . 2 . . . . 69 ASP HB2 . 15702 1 681 . 1 1 69 69 ASP HB3 H 1 2.76 0.02 . 2 . . . . 69 ASP HB3 . 15702 1 682 . 1 1 69 69 ASP CA C 13 51.7 0.2 . 1 . . . . 69 ASP CA . 15702 1 683 . 1 1 69 69 ASP CB C 13 41.7 0.2 . 1 . . . . 69 ASP CB . 15702 1 684 . 1 1 69 69 ASP N N 15 123.6 0.2 . 1 . . . . 69 ASP N . 15702 1 685 . 1 1 70 70 PRO HA H 1 4.29 0.02 . 1 . . . . 70 PRO HA . 15702 1 686 . 1 1 70 70 PRO HB2 H 1 1.93 0.02 . 2 . . . . 70 PRO HB2 . 15702 1 687 . 1 1 70 70 PRO HB3 H 1 2.31 0.02 . 2 . . . . 70 PRO HB3 . 15702 1 688 . 1 1 70 70 PRO C C 13 177.5 0.2 . 1 . . . . 70 PRO C . 15702 1 689 . 1 1 70 70 PRO CA C 13 64.1 0.2 . 1 . . . . 70 PRO CA . 15702 1 690 . 1 1 70 70 PRO CB C 13 32.3 0.2 . 1 . . . . 70 PRO CB . 15702 1 691 . 1 1 71 71 LEU H H 1 8.28 0.02 . 1 . . . . 71 LEU H . 15702 1 692 . 1 1 71 71 LEU HA H 1 4.26 0.02 . 1 . . . . 71 LEU HA . 15702 1 693 . 1 1 71 71 LEU HB2 H 1 1.52 0.02 . 2 . . . . 71 LEU HB2 . 15702 1 694 . 1 1 71 71 LEU HB3 H 1 1.71 0.02 . 2 . . . . 71 LEU HB3 . 15702 1 695 . 1 1 71 71 LEU HD11 H 1 0.82 0.02 . 2 . . . . 71 LEU HD1 . 15702 1 696 . 1 1 71 71 LEU HD12 H 1 0.82 0.02 . 2 . . . . 71 LEU HD1 . 15702 1 697 . 1 1 71 71 LEU HD13 H 1 0.82 0.02 . 2 . . . . 71 LEU HD1 . 15702 1 698 . 1 1 71 71 LEU C C 13 177.6 0.2 . 1 . . . . 71 LEU C . 15702 1 699 . 1 1 71 71 LEU CA C 13 55.1 0.2 . 1 . . . . 71 LEU CA . 15702 1 700 . 1 1 71 71 LEU CB C 13 41.2 0.2 . 1 . . . . 71 LEU CB . 15702 1 701 . 1 1 71 71 LEU CD1 C 13 22.8 0.2 . 2 . . . . 71 LEU CD1 . 15702 1 702 . 1 1 71 71 LEU N N 15 118.4 0.2 . 1 . . . . 71 LEU N . 15702 1 703 . 1 1 72 72 ALA H H 1 7.66 0.02 . 1 . . . . 72 ALA H . 15702 1 704 . 1 1 72 72 ALA HA H 1 4.17 0.02 . 1 . . . . 72 ALA HA . 15702 1 705 . 1 1 72 72 ALA HB1 H 1 1.27 0.02 . 1 . . . . 72 ALA HB . 15702 1 706 . 1 1 72 72 ALA HB2 H 1 1.27 0.02 . 1 . . . . 72 ALA HB . 15702 1 707 . 1 1 72 72 ALA HB3 H 1 1.27 0.02 . 1 . . . . 72 ALA HB . 15702 1 708 . 1 1 72 72 ALA C C 13 177.4 0.2 . 1 . . . . 72 ALA C . 15702 1 709 . 1 1 72 72 ALA CA C 13 52.6 0.2 . 1 . . . . 72 ALA CA . 15702 1 710 . 1 1 72 72 ALA CB C 13 19.2 0.2 . 1 . . . . 72 ALA CB . 15702 1 711 . 1 1 72 72 ALA N N 15 122.9 0.2 . 1 . . . . 72 ALA N . 15702 1 712 . 1 1 73 73 PHE H H 1 7.94 0.02 . 1 . . . . 73 PHE H . 15702 1 713 . 1 1 73 73 PHE HA H 1 4.51 0.02 . 1 . . . . 73 PHE HA . 15702 1 714 . 1 1 73 73 PHE HB2 H 1 2.97 0.02 . 2 . . . . 73 PHE HB2 . 15702 1 715 . 1 1 73 73 PHE HB3 H 1 3.11 0.02 . 2 . . . . 73 PHE HB3 . 15702 1 716 . 1 1 73 73 PHE HD1 H 1 7.21 0.02 . 3 . . . . 73 PHE HD1 . 15702 1 717 . 1 1 73 73 PHE C C 13 175.6 0.2 . 1 . . . . 73 PHE C . 15702 1 718 . 1 1 73 73 PHE CA C 13 57.8 0.2 . 1 . . . . 73 PHE CA . 15702 1 719 . 1 1 73 73 PHE CB C 13 39.1 0.2 . 1 . . . . 73 PHE CB . 15702 1 720 . 1 1 73 73 PHE N N 15 118.2 0.2 . 1 . . . . 73 PHE N . 15702 1 721 . 1 1 74 74 LEU H H 1 7.89 0.02 . 1 . . . . 74 LEU H . 15702 1 722 . 1 1 74 74 LEU CA C 13 55.2 0.2 . 1 . . . . 74 LEU CA . 15702 1 723 . 1 1 74 74 LEU CB C 13 42.4 0.2 . 1 . . . . 74 LEU CB . 15702 1 724 . 1 1 74 74 LEU N N 15 122.6 0.2 . 1 . . . . 74 LEU N . 15702 1 725 . 1 1 78 78 GLU C C 13 176.6 0.2 . 1 . . . . 78 GLU C . 15702 1 726 . 1 1 78 78 GLU CA C 13 57.5 0.2 . 1 . . . . 78 GLU CA . 15702 1 727 . 1 1 78 78 GLU CB C 13 30.1 0.2 . 1 . . . . 78 GLU CB . 15702 1 728 . 1 1 79 79 ALA H H 1 8.46 0.02 . 1 . . . . 79 ALA H . 15702 1 729 . 1 1 79 79 ALA C C 13 178.3 0.2 . 1 . . . . 79 ALA C . 15702 1 730 . 1 1 79 79 ALA CA C 13 52.9 0.2 . 1 . . . . 79 ALA CA . 15702 1 731 . 1 1 79 79 ALA CB C 13 19.2 0.2 . 1 . . . . 79 ALA CB . 15702 1 732 . 1 1 79 79 ALA N N 15 124.7 0.2 . 1 . . . . 79 ALA N . 15702 1 733 . 1 1 80 80 GLY H H 1 8.33 0.02 . 1 . . . . 80 GLY H . 15702 1 734 . 1 1 80 80 GLY C C 13 174.1 0.2 . 1 . . . . 80 GLY C . 15702 1 735 . 1 1 80 80 GLY CA C 13 45.1 0.2 . 1 . . . . 80 GLY CA . 15702 1 736 . 1 1 80 80 GLY N N 15 108.2 0.2 . 1 . . . . 80 GLY N . 15702 1 737 . 1 1 81 81 ALA H H 1 8.14 0.02 . 1 . . . . 81 ALA H . 15702 1 738 . 1 1 81 81 ALA HA H 1 4.17 0.02 . 1 . . . . 81 ALA HA . 15702 1 739 . 1 1 81 81 ALA C C 13 178.4 0.2 . 1 . . . . 81 ALA C . 15702 1 740 . 1 1 81 81 ALA CA C 13 52.8 0.2 . 1 . . . . 81 ALA CA . 15702 1 741 . 1 1 81 81 ALA CB C 13 19.2 0.2 . 1 . . . . 81 ALA CB . 15702 1 742 . 1 1 81 81 ALA N N 15 123.6 0.2 . 1 . . . . 81 ALA N . 15702 1 743 . 1 1 82 82 GLY H H 1 8.40 0.02 . 1 . . . . 82 GLY H . 15702 1 744 . 1 1 82 82 GLY HA2 H 1 3.86 0.02 . 2 . . . . 82 GLY HA2 . 15702 1 745 . 1 1 82 82 GLY HA3 H 1 2.88 0.02 . 2 . . . . 82 GLY HA3 . 15702 1 746 . 1 1 82 82 GLY C C 13 173.6 0.2 . 1 . . . . 82 GLY C . 15702 1 747 . 1 1 82 82 GLY CA C 13 45.2 0.2 . 1 . . . . 82 GLY CA . 15702 1 748 . 1 1 82 82 GLY N N 15 108.0 0.2 . 1 . . . . 82 GLY N . 15702 1 749 . 1 1 83 83 ALA H H 1 7.98 0.02 . 1 . . . . 83 ALA H . 15702 1 750 . 1 1 83 83 ALA HA H 1 4.28 0.02 . 1 . . . . 83 ALA HA . 15702 1 751 . 1 1 83 83 ALA HB1 H 1 1.30 0.02 . 1 . . . . 83 ALA HB . 15702 1 752 . 1 1 83 83 ALA HB2 H 1 1.30 0.02 . 1 . . . . 83 ALA HB . 15702 1 753 . 1 1 83 83 ALA HB3 H 1 1.30 0.02 . 1 . . . . 83 ALA HB . 15702 1 754 . 1 1 83 83 ALA C C 13 177.2 0.2 . 1 . . . . 83 ALA C . 15702 1 755 . 1 1 83 83 ALA CA C 13 52.1 0.2 . 1 . . . . 83 ALA CA . 15702 1 756 . 1 1 83 83 ALA CB C 13 19.5 0.2 . 1 . . . . 83 ALA CB . 15702 1 757 . 1 1 83 83 ALA N N 15 123.3 0.2 . 1 . . . . 83 ALA N . 15702 1 758 . 1 1 84 84 ARG H H 1 8.24 0.02 . 1 . . . . 84 ARG H . 15702 1 759 . 1 1 84 84 ARG HA H 1 4.61 0.02 . 1 . . . . 84 ARG HA . 15702 1 760 . 1 1 84 84 ARG HB2 H 1 1.72 0.02 . 2 . . . . 84 ARG HB2 . 15702 1 761 . 1 1 84 84 ARG HB3 H 1 1.77 0.02 . 2 . . . . 84 ARG HB3 . 15702 1 762 . 1 1 84 84 ARG CA C 13 54.0 0.2 . 1 . . . . 84 ARG CA . 15702 1 763 . 1 1 84 84 ARG CB C 13 30.5 0.2 . 1 . . . . 84 ARG CB . 15702 1 764 . 1 1 84 84 ARG N N 15 121.7 0.2 . 1 . . . . 84 ARG N . 15702 1 765 . 1 1 85 85 PRO HA H 1 4.39 0.02 . 1 . . . . 85 PRO HA . 15702 1 766 . 1 1 85 85 PRO HB2 H 1 2.30 0.02 . 2 . . . . 85 PRO HB2 . 15702 1 767 . 1 1 85 85 PRO HB3 H 1 2.33 0.02 . 2 . . . . 85 PRO HB3 . 15702 1 768 . 1 1 85 85 PRO HD2 H 1 3.54 0.02 . 2 . . . . 85 PRO HD2 . 15702 1 769 . 1 1 85 85 PRO HD3 H 1 3.92 0.02 . 2 . . . . 85 PRO HD3 . 15702 1 770 . 1 1 85 85 PRO C C 13 177.0 0.2 . 1 . . . . 85 PRO C . 15702 1 771 . 1 1 85 85 PRO CA C 13 62.9 0.2 . 1 . . . . 85 PRO CA . 15702 1 772 . 1 1 85 85 PRO CB C 13 32.2 0.2 . 1 . . . . 85 PRO CB . 15702 1 773 . 1 1 86 86 ALA H H 1 8.60 0.02 . 1 . . . . 86 ALA H . 15702 1 774 . 1 1 86 86 ALA HA H 1 4.15 0.02 . 1 . . . . 86 ALA HA . 15702 1 775 . 1 1 86 86 ALA HB1 H 1 1.36 0.02 . 1 . . . . 86 ALA HB . 15702 1 776 . 1 1 86 86 ALA HB2 H 1 1.36 0.02 . 1 . . . . 86 ALA HB . 15702 1 777 . 1 1 86 86 ALA HB3 H 1 1.36 0.02 . 1 . . . . 86 ALA HB . 15702 1 778 . 1 1 86 86 ALA C C 13 177.8 0.2 . 1 . . . . 86 ALA C . 15702 1 779 . 1 1 86 86 ALA CA C 13 53.4 0.2 . 1 . . . . 86 ALA CA . 15702 1 780 . 1 1 86 86 ALA CB C 13 18.9 0.2 . 1 . . . . 86 ALA CB . 15702 1 781 . 1 1 86 86 ALA N N 15 124.9 0.2 . 1 . . . . 86 ALA N . 15702 1 782 . 1 1 87 87 ASN H H 1 8.38 0.02 . 1 . . . . 87 ASN H . 15702 1 783 . 1 1 87 87 ASN HA H 1 4.59 0.02 . 1 . . . . 87 ASN HA . 15702 1 784 . 1 1 87 87 ASN HB2 H 1 2.72 0.02 . 2 . . . . 87 ASN HB2 . 15702 1 785 . 1 1 87 87 ASN HB3 H 1 2.79 0.02 . 2 . . . . 87 ASN HB3 . 15702 1 786 . 1 1 87 87 ASN C C 13 174.4 0.2 . 1 . . . . 87 ASN C . 15702 1 787 . 1 1 87 87 ASN CA C 13 52.6 0.2 . 1 . . . . 87 ASN CA . 15702 1 788 . 1 1 87 87 ASN CB C 13 38.3 0.2 . 1 . . . . 87 ASN CB . 15702 1 789 . 1 1 87 87 ASN N N 15 114.9 0.2 . 1 . . . . 87 ASN N . 15702 1 790 . 1 1 88 88 ALA H H 1 7.80 0.02 . 1 . . . . 88 ALA H . 15702 1 791 . 1 1 88 88 ALA HA H 1 4.40 0.02 . 1 . . . . 88 ALA HA . 15702 1 792 . 1 1 88 88 ALA HB1 H 1 1.26 0.02 . 1 . . . . 88 ALA HB . 15702 1 793 . 1 1 88 88 ALA HB2 H 1 1.26 0.02 . 1 . . . . 88 ALA HB . 15702 1 794 . 1 1 88 88 ALA HB3 H 1 1.26 0.02 . 1 . . . . 88 ALA HB . 15702 1 795 . 1 1 88 88 ALA CA C 13 50.4 0.2 . 1 . . . . 88 ALA CA . 15702 1 796 . 1 1 88 88 ALA CB C 13 17.9 0.2 . 1 . . . . 88 ALA CB . 15702 1 797 . 1 1 88 88 ALA N N 15 123.6 0.2 . 1 . . . . 88 ALA N . 15702 1 798 . 1 1 89 89 PRO HA H 1 4.39 0.02 . 1 . . . . 89 PRO HA . 15702 1 799 . 1 1 89 89 PRO HB2 H 1 1.82 0.02 . 2 . . . . 89 PRO HB2 . 15702 1 800 . 1 1 89 89 PRO HB3 H 1 2.09 0.02 . 2 . . . . 89 PRO HB3 . 15702 1 801 . 1 1 89 89 PRO HD2 H 1 3.41 0.02 . 2 . . . . 89 PRO HD2 . 15702 1 802 . 1 1 89 89 PRO HD3 H 1 3.82 0.02 . 2 . . . . 89 PRO HD3 . 15702 1 803 . 1 1 89 89 PRO HG2 H 1 1.81 0.02 . 2 . . . . 89 PRO HG2 . 15702 1 804 . 1 1 89 89 PRO HG3 H 1 1.98 0.02 . 2 . . . . 89 PRO HG3 . 15702 1 805 . 1 1 89 89 PRO C C 13 175.0 0.2 . 1 . . . . 89 PRO C . 15702 1 806 . 1 1 89 89 PRO CA C 13 62.4 0.2 . 1 . . . . 89 PRO CA . 15702 1 807 . 1 1 89 89 PRO CB C 13 31.7 0.2 . 1 . . . . 89 PRO CB . 15702 1 808 . 1 1 89 89 PRO CD C 13 49.5 0.2 . 1 . . . . 89 PRO CD . 15702 1 809 . 1 1 89 89 PRO CG C 13 26.8 0.2 . 1 . . . . 89 PRO CG . 15702 1 810 . 1 1 90 90 GLU H H 1 9.00 0.02 . 1 . . . . 90 GLU H . 15702 1 811 . 1 1 90 90 GLU HA H 1 4.31 0.02 . 1 . . . . 90 GLU HA . 15702 1 812 . 1 1 90 90 GLU HB2 H 1 2.01 0.02 . 2 . . . . 90 GLU HB2 . 15702 1 813 . 1 1 90 90 GLU HB3 H 1 2.04 0.02 . 2 . . . . 90 GLU HB3 . 15702 1 814 . 1 1 90 90 GLU C C 13 177.3 0.2 . 1 . . . . 90 GLU C . 15702 1 815 . 1 1 90 90 GLU CA C 13 58.0 0.2 . 1 . . . . 90 GLU CA . 15702 1 816 . 1 1 90 90 GLU CB C 13 31.4 0.2 . 1 . . . . 90 GLU CB . 15702 1 817 . 1 1 90 90 GLU N N 15 117.7 0.2 . 1 . . . . 90 GLU N . 15702 1 818 . 1 1 91 91 VAL H H 1 7.31 0.02 . 1 . . . . 91 VAL H . 15702 1 819 . 1 1 91 91 VAL HA H 1 4.57 0.02 . 1 . . . . 91 VAL HA . 15702 1 820 . 1 1 91 91 VAL HB H 1 1.84 0.02 . 1 . . . . 91 VAL HB . 15702 1 821 . 1 1 91 91 VAL HG11 H 1 0.69 0.02 . 1 . . . . 91 VAL HG1 . 15702 1 822 . 1 1 91 91 VAL HG12 H 1 0.69 0.02 . 1 . . . . 91 VAL HG1 . 15702 1 823 . 1 1 91 91 VAL HG13 H 1 0.69 0.02 . 1 . . . . 91 VAL HG1 . 15702 1 824 . 1 1 91 91 VAL HG21 H 1 0.69 0.02 . 1 . . . . 91 VAL HG2 . 15702 1 825 . 1 1 91 91 VAL HG22 H 1 0.69 0.02 . 1 . . . . 91 VAL HG2 . 15702 1 826 . 1 1 91 91 VAL HG23 H 1 0.69 0.02 . 1 . . . . 91 VAL HG2 . 15702 1 827 . 1 1 91 91 VAL C C 13 171.0 0.2 . 1 . . . . 91 VAL C . 15702 1 828 . 1 1 91 91 VAL CA C 13 59.7 0.2 . 1 . . . . 91 VAL CA . 15702 1 829 . 1 1 91 91 VAL CB C 13 35.6 0.2 . 1 . . . . 91 VAL CB . 15702 1 830 . 1 1 91 91 VAL CG1 C 13 19.5 0.2 . 1 . . . . 91 VAL CG1 . 15702 1 831 . 1 1 91 91 VAL CG2 C 13 21.1 0.2 . 1 . . . . 91 VAL CG2 . 15702 1 832 . 1 1 91 91 VAL N N 15 115.9 0.2 . 1 . . . . 91 VAL N . 15702 1 833 . 1 1 92 92 LEU H H 1 8.70 0.02 . 1 . . . . 92 LEU H . 15702 1 834 . 1 1 92 92 LEU HA H 1 4.95 0.02 . 1 . . . . 92 LEU HA . 15702 1 835 . 1 1 92 92 LEU HB2 H 1 0.76 0.02 . 2 . . . . 92 LEU HB2 . 15702 1 836 . 1 1 92 92 LEU HB3 H 1 1.76 0.02 . 2 . . . . 92 LEU HB3 . 15702 1 837 . 1 1 92 92 LEU HD11 H 1 0.39 0.02 . 1 . . . . 92 LEU HD1 . 15702 1 838 . 1 1 92 92 LEU HD12 H 1 0.39 0.02 . 1 . . . . 92 LEU HD1 . 15702 1 839 . 1 1 92 92 LEU HD13 H 1 0.39 0.02 . 1 . . . . 92 LEU HD1 . 15702 1 840 . 1 1 92 92 LEU HD21 H 1 0.60 0.02 . 1 . . . . 92 LEU HD2 . 15702 1 841 . 1 1 92 92 LEU HD22 H 1 0.60 0.02 . 1 . . . . 92 LEU HD2 . 15702 1 842 . 1 1 92 92 LEU HD23 H 1 0.60 0.02 . 1 . . . . 92 LEU HD2 . 15702 1 843 . 1 1 92 92 LEU HG H 1 1.14 0.02 . 1 . . . . 92 LEU HG . 15702 1 844 . 1 1 92 92 LEU C C 13 174.3 0.2 . 1 . . . . 92 LEU C . 15702 1 845 . 1 1 92 92 LEU CA C 13 52.7 0.2 . 1 . . . . 92 LEU CA . 15702 1 846 . 1 1 92 92 LEU CB C 13 44.1 0.2 . 1 . . . . 92 LEU CB . 15702 1 847 . 1 1 92 92 LEU CD1 C 13 23.9 0.2 . 1 . . . . 92 LEU CD1 . 15702 1 848 . 1 1 92 92 LEU CD2 C 13 28.2 0.2 . 1 . . . . 92 LEU CD2 . 15702 1 849 . 1 1 92 92 LEU CG C 13 27.2 0.2 . 1 . . . . 92 LEU CG . 15702 1 850 . 1 1 92 92 LEU N N 15 128.5 0.2 . 1 . . . . 92 LEU N . 15702 1 851 . 1 1 93 93 LEU H H 1 8.77 0.02 . 1 . . . . 93 LEU H . 15702 1 852 . 1 1 93 93 LEU HA H 1 4.91 0.02 . 1 . . . . 93 LEU HA . 15702 1 853 . 1 1 93 93 LEU HB2 H 1 1.10 0.02 . 2 . . . . 93 LEU HB2 . 15702 1 854 . 1 1 93 93 LEU HB3 H 1 1.76 0.02 . 2 . . . . 93 LEU HB3 . 15702 1 855 . 1 1 93 93 LEU HD11 H 1 0.83 0.02 . 1 . . . . 93 LEU HD1 . 15702 1 856 . 1 1 93 93 LEU HD12 H 1 0.83 0.02 . 1 . . . . 93 LEU HD1 . 15702 1 857 . 1 1 93 93 LEU HD13 H 1 0.83 0.02 . 1 . . . . 93 LEU HD1 . 15702 1 858 . 1 1 93 93 LEU HD21 H 1 0.77 0.02 . 1 . . . . 93 LEU HD2 . 15702 1 859 . 1 1 93 93 LEU HD22 H 1 0.77 0.02 . 1 . . . . 93 LEU HD2 . 15702 1 860 . 1 1 93 93 LEU HD23 H 1 0.77 0.02 . 1 . . . . 93 LEU HD2 . 15702 1 861 . 1 1 93 93 LEU HG H 1 1.52 0.02 . 1 . . . . 93 LEU HG . 15702 1 862 . 1 1 93 93 LEU C C 13 174.9 0.2 . 1 . . . . 93 LEU C . 15702 1 863 . 1 1 93 93 LEU CA C 13 52.6 0.2 . 1 . . . . 93 LEU CA . 15702 1 864 . 1 1 93 93 LEU CB C 13 44.3 0.2 . 1 . . . . 93 LEU CB . 15702 1 865 . 1 1 93 93 LEU CD1 C 13 26.7 0.2 . 1 . . . . 93 LEU CD1 . 15702 1 866 . 1 1 93 93 LEU CD2 C 13 23.7 0.2 . 1 . . . . 93 LEU CD2 . 15702 1 867 . 1 1 93 93 LEU CG C 13 26.8 0.2 . 1 . . . . 93 LEU CG . 15702 1 868 . 1 1 93 93 LEU N N 15 127.3 0.2 . 1 . . . . 93 LEU N . 15702 1 869 . 1 1 94 94 VAL H H 1 8.80 0.02 . 1 . . . . 94 VAL H . 15702 1 870 . 1 1 94 94 VAL HA H 1 4.88 0.02 . 1 . . . . 94 VAL HA . 15702 1 871 . 1 1 94 94 VAL HB H 1 1.84 0.02 . 1 . . . . 94 VAL HB . 15702 1 872 . 1 1 94 94 VAL HG11 H 1 0.84 0.02 . 1 . . . . 94 VAL HG1 . 15702 1 873 . 1 1 94 94 VAL HG12 H 1 0.84 0.02 . 1 . . . . 94 VAL HG1 . 15702 1 874 . 1 1 94 94 VAL HG13 H 1 0.84 0.02 . 1 . . . . 94 VAL HG1 . 15702 1 875 . 1 1 94 94 VAL HG21 H 1 0.60 0.02 . 1 . . . . 94 VAL HG2 . 15702 1 876 . 1 1 94 94 VAL HG22 H 1 0.60 0.02 . 1 . . . . 94 VAL HG2 . 15702 1 877 . 1 1 94 94 VAL HG23 H 1 0.60 0.02 . 1 . . . . 94 VAL HG2 . 15702 1 878 . 1 1 94 94 VAL C C 13 175.0 0.2 . 1 . . . . 94 VAL C . 15702 1 879 . 1 1 94 94 VAL CA C 13 60.0 0.2 . 1 . . . . 94 VAL CA . 15702 1 880 . 1 1 94 94 VAL CB C 13 33.9 0.2 . 1 . . . . 94 VAL CB . 15702 1 881 . 1 1 94 94 VAL CG1 C 13 21.4 0.2 . 1 . . . . 94 VAL CG1 . 15702 1 882 . 1 1 94 94 VAL CG2 C 13 21.6 0.2 . 1 . . . . 94 VAL CG2 . 15702 1 883 . 1 1 94 94 VAL N N 15 122.0 0.2 . 1 . . . . 94 VAL N . 15702 1 884 . 1 1 95 95 GLY H H 1 9.73 0.02 . 1 . . . . 95 GLY H . 15702 1 885 . 1 1 95 95 GLY HA2 H 1 3.24 0.02 . 2 . . . . 95 GLY HA2 . 15702 1 886 . 1 1 95 95 GLY HA3 H 1 4.94 0.02 . 2 . . . . 95 GLY HA3 . 15702 1 887 . 1 1 95 95 GLY C C 13 175.0 0.2 . 1 . . . . 95 GLY C . 15702 1 888 . 1 1 95 95 GLY CA C 13 45.5 0.2 . 1 . . . . 95 GLY CA . 15702 1 889 . 1 1 95 95 GLY N N 15 114.0 0.2 . 1 . . . . 95 GLY N . 15702 1 890 . 1 1 96 96 THR H H 1 9.32 0.02 . 1 . . . . 96 THR H . 15702 1 891 . 1 1 96 96 THR HA H 1 4.21 0.02 . 1 . . . . 96 THR HA . 15702 1 892 . 1 1 96 96 THR HB H 1 4.79 0.02 . 1 . . . . 96 THR HB . 15702 1 893 . 1 1 96 96 THR HG21 H 1 1.25 0.02 . 1 . . . . 96 THR HG2 . 15702 1 894 . 1 1 96 96 THR HG22 H 1 1.25 0.02 . 1 . . . . 96 THR HG2 . 15702 1 895 . 1 1 96 96 THR HG23 H 1 1.25 0.02 . 1 . . . . 96 THR HG2 . 15702 1 896 . 1 1 96 96 THR C C 13 173.0 0.2 . 1 . . . . 96 THR C . 15702 1 897 . 1 1 96 96 THR CA C 13 61.8 0.2 . 1 . . . . 96 THR CA . 15702 1 898 . 1 1 96 96 THR CB C 13 67.6 0.2 . 1 . . . . 96 THR CB . 15702 1 899 . 1 1 96 96 THR CG2 C 13 20.2 0.2 . 1 . . . . 96 THR CG2 . 15702 1 900 . 1 1 96 96 THR N N 15 113.8 0.2 . 1 . . . . 96 THR N . 15702 1 901 . 1 1 97 97 GLY H H 1 8.60 0.02 . 1 . . . . 97 GLY H . 15702 1 902 . 1 1 97 97 GLY HA2 H 1 3.58 0.02 . 2 . . . . 97 GLY HA2 . 15702 1 903 . 1 1 97 97 GLY HA3 H 1 4.50 0.02 . 2 . . . . 97 GLY HA3 . 15702 1 904 . 1 1 97 97 GLY C C 13 174.8 0.2 . 1 . . . . 97 GLY C . 15702 1 905 . 1 1 97 97 GLY CA C 13 44.0 0.2 . 1 . . . . 97 GLY CA . 15702 1 906 . 1 1 97 97 GLY N N 15 110.9 0.2 . 1 . . . . 97 GLY N . 15702 1 907 . 1 1 98 98 ARG H H 1 9.40 0.02 . 1 . . . . 98 ARG H . 15702 1 908 . 1 1 98 98 ARG HA H 1 4.11 0.02 . 1 . . . . 98 ARG HA . 15702 1 909 . 1 1 98 98 ARG HB2 H 1 1.83 0.02 . 2 . . . . 98 ARG HB2 . 15702 1 910 . 1 1 98 98 ARG HB3 H 1 1.96 0.02 . 2 . . . . 98 ARG HB3 . 15702 1 911 . 1 1 98 98 ARG C C 13 175.7 0.2 . 1 . . . . 98 ARG C . 15702 1 912 . 1 1 98 98 ARG CA C 13 58.8 0.2 . 1 . . . . 98 ARG CA . 15702 1 913 . 1 1 98 98 ARG CB C 13 30.7 0.2 . 1 . . . . 98 ARG CB . 15702 1 914 . 1 1 98 98 ARG N N 15 125.5 0.2 . 1 . . . . 98 ARG N . 15702 1 915 . 1 1 99 99 ARG H H 1 8.18 0.02 . 1 . . . . 99 ARG H . 15702 1 916 . 1 1 99 99 ARG HA H 1 4.64 0.02 . 1 . . . . 99 ARG HA . 15702 1 917 . 1 1 99 99 ARG HB2 H 1 1.55 0.02 . 2 . . . . 99 ARG HB2 . 15702 1 918 . 1 1 99 99 ARG HB3 H 1 1.66 0.02 . 2 . . . . 99 ARG HB3 . 15702 1 919 . 1 1 99 99 ARG C C 13 175.0 0.2 . 1 . . . . 99 ARG C . 15702 1 920 . 1 1 99 99 ARG CA C 13 53.1 0.2 . 1 . . . . 99 ARG CA . 15702 1 921 . 1 1 99 99 ARG CB C 13 33.2 0.2 . 1 . . . . 99 ARG CB . 15702 1 922 . 1 1 99 99 ARG N N 15 114.3 0.2 . 1 . . . . 99 ARG N . 15702 1 923 . 1 1 100 100 GLN H H 1 8.71 0.02 . 1 . . . . 100 GLN H . 15702 1 924 . 1 1 100 100 GLN HA H 1 3.62 0.02 . 1 . . . . 100 GLN HA . 15702 1 925 . 1 1 100 100 GLN HB2 H 1 2.00 0.02 . 2 . . . . 100 GLN HB2 . 15702 1 926 . 1 1 100 100 GLN HB3 H 1 2.03 0.02 . 2 . . . . 100 GLN HB3 . 15702 1 927 . 1 1 100 100 GLN HG2 H 1 1.78 0.02 . 2 . . . . 100 GLN HG2 . 15702 1 928 . 1 1 100 100 GLN HG3 H 1 1.81 0.02 . 2 . . . . 100 GLN HG3 . 15702 1 929 . 1 1 100 100 GLN C C 13 173.9 0.2 . 1 . . . . 100 GLN C . 15702 1 930 . 1 1 100 100 GLN CA C 13 56.4 0.2 . 1 . . . . 100 GLN CA . 15702 1 931 . 1 1 100 100 GLN CB C 13 29.6 0.2 . 1 . . . . 100 GLN CB . 15702 1 932 . 1 1 100 100 GLN CG C 13 34.1 0.2 . 1 . . . . 100 GLN CG . 15702 1 933 . 1 1 100 100 GLN N N 15 121.7 0.2 . 1 . . . . 100 GLN N . 15702 1 934 . 1 1 101 101 HIS H H 1 7.90 0.02 . 1 . . . . 101 HIS H . 15702 1 935 . 1 1 101 101 HIS HA H 1 4.53 0.02 . 1 . . . . 101 HIS HA . 15702 1 936 . 1 1 101 101 HIS HB2 H 1 2.63 0.02 . 2 . . . . 101 HIS HB2 . 15702 1 937 . 1 1 101 101 HIS HB3 H 1 2.99 0.02 . 2 . . . . 101 HIS HB3 . 15702 1 938 . 1 1 101 101 HIS HD1 H 1 6.86 0.02 . 1 . . . . 101 HIS HD1 . 15702 1 939 . 1 1 101 101 HIS C C 13 173.1 0.2 . 1 . . . . 101 HIS C . 15702 1 940 . 1 1 101 101 HIS CA C 13 55.1 0.2 . 1 . . . . 101 HIS CA . 15702 1 941 . 1 1 101 101 HIS CB C 13 32.1 0.2 . 1 . . . . 101 HIS CB . 15702 1 942 . 1 1 101 101 HIS N N 15 130.6 0.2 . 1 . . . . 101 HIS N . 15702 1 943 . 1 1 102 102 LEU H H 1 8.08 0.02 . 1 . . . . 102 LEU H . 15702 1 944 . 1 1 102 102 LEU HA H 1 4.06 0.02 . 1 . . . . 102 LEU HA . 15702 1 945 . 1 1 102 102 LEU HD11 H 1 0.79 0.02 . 2 . . . . 102 LEU HD1 . 15702 1 946 . 1 1 102 102 LEU HD12 H 1 0.79 0.02 . 2 . . . . 102 LEU HD1 . 15702 1 947 . 1 1 102 102 LEU HD13 H 1 0.79 0.02 . 2 . . . . 102 LEU HD1 . 15702 1 948 . 1 1 102 102 LEU C C 13 177.2 0.2 . 1 . . . . 102 LEU C . 15702 1 949 . 1 1 102 102 LEU CA C 13 54.9 0.2 . 1 . . . . 102 LEU CA . 15702 1 950 . 1 1 102 102 LEU CB C 13 41.6 0.2 . 1 . . . . 102 LEU CB . 15702 1 951 . 1 1 102 102 LEU N N 15 121.4 0.2 . 1 . . . . 102 LEU N . 15702 1 952 . 1 1 103 103 LEU H H 1 8.26 0.02 . 1 . . . . 103 LEU H . 15702 1 953 . 1 1 103 103 LEU HA H 1 4.49 0.02 . 1 . . . . 103 LEU HA . 15702 1 954 . 1 1 103 103 LEU HB2 H 1 1.16 0.02 . 2 . . . . 103 LEU HB2 . 15702 1 955 . 1 1 103 103 LEU HB3 H 1 1.67 0.02 . 2 . . . . 103 LEU HB3 . 15702 1 956 . 1 1 103 103 LEU HD11 H 1 0.74 0.02 . 1 . . . . 103 LEU HD1 . 15702 1 957 . 1 1 103 103 LEU HD12 H 1 0.74 0.02 . 1 . . . . 103 LEU HD1 . 15702 1 958 . 1 1 103 103 LEU HD13 H 1 0.74 0.02 . 1 . . . . 103 LEU HD1 . 15702 1 959 . 1 1 103 103 LEU HD21 H 1 0.74 0.02 . 1 . . . . 103 LEU HD2 . 15702 1 960 . 1 1 103 103 LEU HD22 H 1 0.74 0.02 . 1 . . . . 103 LEU HD2 . 15702 1 961 . 1 1 103 103 LEU HD23 H 1 0.74 0.02 . 1 . . . . 103 LEU HD2 . 15702 1 962 . 1 1 103 103 LEU HG H 1 1.65 0.02 . 1 . . . . 103 LEU HG . 15702 1 963 . 1 1 103 103 LEU C C 13 177.1 0.2 . 1 . . . . 103 LEU C . 15702 1 964 . 1 1 103 103 LEU CA C 13 53.4 0.2 . 1 . . . . 103 LEU CA . 15702 1 965 . 1 1 103 103 LEU CB C 13 42.6 0.2 . 1 . . . . 103 LEU CB . 15702 1 966 . 1 1 103 103 LEU CD1 C 13 26.8 0.2 . 1 . . . . 103 LEU CD1 . 15702 1 967 . 1 1 103 103 LEU CD2 C 13 23.0 0.2 . 1 . . . . 103 LEU CD2 . 15702 1 968 . 1 1 103 103 LEU CG C 13 26.6 0.2 . 1 . . . . 103 LEU CG . 15702 1 969 . 1 1 103 103 LEU N N 15 123.0 0.2 . 1 . . . . 103 LEU N . 15702 1 970 . 1 1 104 104 GLY H H 1 8.82 0.02 . 1 . . . . 104 GLY H . 15702 1 971 . 1 1 104 104 GLY HA2 H 1 3.93 0.02 . 2 . . . . 104 GLY HA2 . 15702 1 972 . 1 1 104 104 GLY HA3 H 1 4.44 0.02 . 2 . . . . 104 GLY HA3 . 15702 1 973 . 1 1 104 104 GLY CA C 13 44.5 0.2 . 1 . . . . 104 GLY CA . 15702 1 974 . 1 1 104 104 GLY N N 15 110.2 0.2 . 1 . . . . 104 GLY N . 15702 1 975 . 1 1 105 105 PRO HA H 1 4.23 0.02 . 1 . . . . 105 PRO HA . 15702 1 976 . 1 1 105 105 PRO HB2 H 1 1.92 0.02 . 2 . . . . 105 PRO HB2 . 15702 1 977 . 1 1 105 105 PRO HB3 H 1 2.33 0.02 . 2 . . . . 105 PRO HB3 . 15702 1 978 . 1 1 105 105 PRO C C 13 178.9 0.2 . 1 . . . . 105 PRO C . 15702 1 979 . 1 1 105 105 PRO CA C 13 65.2 0.2 . 1 . . . . 105 PRO CA . 15702 1 980 . 1 1 105 105 PRO CB C 13 31.9 0.2 . 1 . . . . 105 PRO CB . 15702 1 981 . 1 1 106 106 GLU H H 1 9.15 0.02 . 1 . . . . 106 GLU H . 15702 1 982 . 1 1 106 106 GLU HA H 1 4.08 0.02 . 1 . . . . 106 GLU HA . 15702 1 983 . 1 1 106 106 GLU HB2 H 1 1.99 0.02 . 2 . . . . 106 GLU HB2 . 15702 1 984 . 1 1 106 106 GLU HB3 H 1 2.05 0.02 . 2 . . . . 106 GLU HB3 . 15702 1 985 . 1 1 106 106 GLU HG2 H 1 2.29 0.02 . 2 . . . . 106 GLU HG2 . 15702 1 986 . 1 1 106 106 GLU HG3 H 1 2.37 0.02 . 2 . . . . 106 GLU HG3 . 15702 1 987 . 1 1 106 106 GLU C C 13 178.5 0.2 . 1 . . . . 106 GLU C . 15702 1 988 . 1 1 106 106 GLU CA C 13 58.6 0.2 . 1 . . . . 106 GLU CA . 15702 1 989 . 1 1 106 106 GLU CB C 13 28.5 0.2 . 1 . . . . 106 GLU CB . 15702 1 990 . 1 1 106 106 GLU CG C 13 36.4 0.2 . 1 . . . . 106 GLU CG . 15702 1 991 . 1 1 106 106 GLU N N 15 115.4 0.2 . 1 . . . . 106 GLU N . 15702 1 992 . 1 1 107 107 GLN H H 1 7.68 0.02 . 1 . . . . 107 GLN H . 15702 1 993 . 1 1 107 107 GLN HA H 1 4.16 0.02 . 1 . . . . 107 GLN HA . 15702 1 994 . 1 1 107 107 GLN HB2 H 1 1.67 0.02 . 2 . . . . 107 GLN HB2 . 15702 1 995 . 1 1 107 107 GLN HB3 H 1 2.43 0.02 . 2 . . . . 107 GLN HB3 . 15702 1 996 . 1 1 107 107 GLN HG2 H 1 2.31 0.02 . 2 . . . . 107 GLN HG2 . 15702 1 997 . 1 1 107 107 GLN HG3 H 1 2.37 0.02 . 2 . . . . 107 GLN HG3 . 15702 1 998 . 1 1 107 107 GLN C C 13 175.2 0.2 . 1 . . . . 107 GLN C . 15702 1 999 . 1 1 107 107 GLN CA C 13 58.5 0.2 . 1 . . . . 107 GLN CA . 15702 1 1000 . 1 1 107 107 GLN CB C 13 29.4 0.2 . 1 . . . . 107 GLN CB . 15702 1 1001 . 1 1 107 107 GLN CG C 13 35.4 0.2 . 1 . . . . 107 GLN CG . 15702 1 1002 . 1 1 107 107 GLN N N 15 116.1 0.2 . 1 . . . . 107 GLN N . 15702 1 1003 . 1 1 108 108 VAL H H 1 7.08 0.02 . 1 . . . . 108 VAL H . 15702 1 1004 . 1 1 108 108 VAL HA H 1 4.27 0.02 . 1 . . . . 108 VAL HA . 15702 1 1005 . 1 1 108 108 VAL HB H 1 2.18 0.02 . 1 . . . . 108 VAL HB . 15702 1 1006 . 1 1 108 108 VAL HG11 H 1 0.84 0.02 . 1 . . . . 108 VAL HG1 . 15702 1 1007 . 1 1 108 108 VAL HG12 H 1 0.84 0.02 . 1 . . . . 108 VAL HG1 . 15702 1 1008 . 1 1 108 108 VAL HG13 H 1 0.84 0.02 . 1 . . . . 108 VAL HG1 . 15702 1 1009 . 1 1 108 108 VAL HG21 H 1 0.89 0.02 . 1 . . . . 108 VAL HG2 . 15702 1 1010 . 1 1 108 108 VAL HG22 H 1 0.89 0.02 . 1 . . . . 108 VAL HG2 . 15702 1 1011 . 1 1 108 108 VAL HG23 H 1 0.89 0.02 . 1 . . . . 108 VAL HG2 . 15702 1 1012 . 1 1 108 108 VAL C C 13 177.5 0.2 . 1 . . . . 108 VAL C . 15702 1 1013 . 1 1 108 108 VAL CA C 13 62.0 0.2 . 1 . . . . 108 VAL CA . 15702 1 1014 . 1 1 108 108 VAL CB C 13 33.0 0.2 . 1 . . . . 108 VAL CB . 15702 1 1015 . 1 1 108 108 VAL CG1 C 13 22.6 0.2 . 1 . . . . 108 VAL CG1 . 15702 1 1016 . 1 1 108 108 VAL CG2 C 13 19.5 0.2 . 1 . . . . 108 VAL CG2 . 15702 1 1017 . 1 1 108 108 VAL N N 15 104.8 0.2 . 1 . . . . 108 VAL N . 15702 1 1018 . 1 1 109 109 ARG H H 1 8.22 0.02 . 1 . . . . 109 ARG H . 15702 1 1019 . 1 1 109 109 ARG HA H 1 4.06 0.02 . 1 . . . . 109 ARG HA . 15702 1 1020 . 1 1 109 109 ARG HB2 H 1 1.74 0.02 . 2 . . . . 109 ARG HB2 . 15702 1 1021 . 1 1 109 109 ARG HB3 H 1 2.10 0.02 . 2 . . . . 109 ARG HB3 . 15702 1 1022 . 1 1 109 109 ARG HD2 H 1 3.15 0.02 . 2 . . . . 109 ARG HD2 . 15702 1 1023 . 1 1 109 109 ARG HD3 H 1 3.17 0.02 . 2 . . . . 109 ARG HD3 . 15702 1 1024 . 1 1 109 109 ARG CA C 13 61.7 0.2 . 1 . . . . 109 ARG CA . 15702 1 1025 . 1 1 109 109 ARG CB C 13 27.6 0.2 . 1 . . . . 109 ARG CB . 15702 1 1026 . 1 1 109 109 ARG CD C 13 43.3 0.2 . 1 . . . . 109 ARG CD . 15702 1 1027 . 1 1 109 109 ARG N N 15 123.1 0.2 . 1 . . . . 109 ARG N . 15702 1 1028 . 1 1 110 110 PRO HA H 1 4.29 0.02 . 1 . . . . 110 PRO HA . 15702 1 1029 . 1 1 110 110 PRO HB2 H 1 1.53 0.02 . 2 . . . . 110 PRO HB2 . 15702 1 1030 . 1 1 110 110 PRO HB3 H 1 2.29 0.02 . 2 . . . . 110 PRO HB3 . 15702 1 1031 . 1 1 110 110 PRO HD2 H 1 3.31 0.02 . 2 . . . . 110 PRO HD2 . 15702 1 1032 . 1 1 110 110 PRO HD3 H 1 3.66 0.02 . 2 . . . . 110 PRO HD3 . 15702 1 1033 . 1 1 110 110 PRO HG2 H 1 1.42 0.02 . 2 . . . . 110 PRO HG2 . 15702 1 1034 . 1 1 110 110 PRO HG3 H 1 1.88 0.02 . 2 . . . . 110 PRO HG3 . 15702 1 1035 . 1 1 110 110 PRO C C 13 173.0 0.2 . 1 . . . . 110 PRO C . 15702 1 1036 . 1 1 110 110 PRO CA C 13 65.8 0.2 . 1 . . . . 110 PRO CA . 15702 1 1037 . 1 1 110 110 PRO CB C 13 31.4 0.2 . 1 . . . . 110 PRO CB . 15702 1 1038 . 1 1 110 110 PRO CD C 13 50.2 0.2 . 1 . . . . 110 PRO CD . 15702 1 1039 . 1 1 110 110 PRO CG C 13 28.6 0.2 . 1 . . . . 110 PRO CG . 15702 1 1040 . 1 1 111 111 LEU H H 1 7.08 0.02 . 1 . . . . 111 LEU H . 15702 1 1041 . 1 1 111 111 LEU HA H 1 4.05 0.02 . 1 . . . . 111 LEU HA . 15702 1 1042 . 1 1 111 111 LEU HB2 H 1 1.53 0.02 . 2 . . . . 111 LEU HB2 . 15702 1 1043 . 1 1 111 111 LEU HB3 H 1 1.80 0.02 . 2 . . . . 111 LEU HB3 . 15702 1 1044 . 1 1 111 111 LEU HD11 H 1 0.73 0.02 . 1 . . . . 111 LEU HD1 . 15702 1 1045 . 1 1 111 111 LEU HD12 H 1 0.73 0.02 . 1 . . . . 111 LEU HD1 . 15702 1 1046 . 1 1 111 111 LEU HD13 H 1 0.73 0.02 . 1 . . . . 111 LEU HD1 . 15702 1 1047 . 1 1 111 111 LEU HD21 H 1 0.84 0.02 . 1 . . . . 111 LEU HD2 . 15702 1 1048 . 1 1 111 111 LEU HD22 H 1 0.84 0.02 . 1 . . . . 111 LEU HD2 . 15702 1 1049 . 1 1 111 111 LEU HD23 H 1 0.84 0.02 . 1 . . . . 111 LEU HD2 . 15702 1 1050 . 1 1 111 111 LEU HG H 1 1.53 0.02 . 1 . . . . 111 LEU HG . 15702 1 1051 . 1 1 111 111 LEU C C 13 178.8 0.2 . 1 . . . . 111 LEU C . 15702 1 1052 . 1 1 111 111 LEU CA C 13 57.4 0.2 . 1 . . . . 111 LEU CA . 15702 1 1053 . 1 1 111 111 LEU CB C 13 40.1 0.2 . 1 . . . . 111 LEU CB . 15702 1 1054 . 1 1 111 111 LEU CD1 C 13 25.9 0.2 . 1 . . . . 111 LEU CD1 . 15702 1 1055 . 1 1 111 111 LEU CG C 13 29.1 0.2 . 1 . . . . 111 LEU CG . 15702 1 1056 . 1 1 111 111 LEU N N 15 117.7 0.2 . 1 . . . . 111 LEU N . 15702 1 1057 . 1 1 112 112 LEU H H 1 7.95 0.02 . 1 . . . . 112 LEU H . 15702 1 1058 . 1 1 112 112 LEU HA H 1 4.05 0.02 . 1 . . . . 112 LEU HA . 15702 1 1059 . 1 1 112 112 LEU HB2 H 1 1.52 0.02 . 2 . . . . 112 LEU HB2 . 15702 1 1060 . 1 1 112 112 LEU HB3 H 1 1.72 0.02 . 2 . . . . 112 LEU HB3 . 15702 1 1061 . 1 1 112 112 LEU HD11 H 1 0.89 0.02 . 1 . . . . 112 LEU HD1 . 15702 1 1062 . 1 1 112 112 LEU HD12 H 1 0.89 0.02 . 1 . . . . 112 LEU HD1 . 15702 1 1063 . 1 1 112 112 LEU HD13 H 1 0.89 0.02 . 1 . . . . 112 LEU HD1 . 15702 1 1064 . 1 1 112 112 LEU HD21 H 1 0.98 0.02 . 1 . . . . 112 LEU HD2 . 15702 1 1065 . 1 1 112 112 LEU HD22 H 1 0.98 0.02 . 1 . . . . 112 LEU HD2 . 15702 1 1066 . 1 1 112 112 LEU HD23 H 1 0.98 0.02 . 1 . . . . 112 LEU HD2 . 15702 1 1067 . 1 1 112 112 LEU HG H 1 1.69 0.02 . 1 . . . . 112 LEU HG . 15702 1 1068 . 1 1 112 112 LEU C C 13 169.0 0.2 . 1 . . . . 112 LEU C . 15702 1 1069 . 1 1 112 112 LEU CA C 13 58.0 0.2 . 1 . . . . 112 LEU CA . 15702 1 1070 . 1 1 112 112 LEU CB C 13 41.1 0.2 . 1 . . . . 112 LEU CB . 15702 1 1071 . 1 1 112 112 LEU CD1 C 13 25.3 0.2 . 1 . . . . 112 LEU CD1 . 15702 1 1072 . 1 1 112 112 LEU CD2 C 13 22.8 0.2 . 1 . . . . 112 LEU CD2 . 15702 1 1073 . 1 1 112 112 LEU CG C 13 27.3 0.2 . 1 . . . . 112 LEU CG . 15702 1 1074 . 1 1 112 112 LEU N N 15 121.7 0.2 . 1 . . . . 112 LEU N . 15702 1 1075 . 1 1 113 113 ALA H H 1 8.23 0.02 . 1 . . . . 113 ALA H . 15702 1 1076 . 1 1 113 113 ALA HA H 1 4.11 0.02 . 1 . . . . 113 ALA HA . 15702 1 1077 . 1 1 113 113 ALA HB1 H 1 1.42 0.02 . 1 . . . . 113 ALA HB . 15702 1 1078 . 1 1 113 113 ALA HB2 H 1 1.42 0.02 . 1 . . . . 113 ALA HB . 15702 1 1079 . 1 1 113 113 ALA HB3 H 1 1.42 0.02 . 1 . . . . 113 ALA HB . 15702 1 1080 . 1 1 113 113 ALA C C 13 178.7 0.2 . 1 . . . . 113 ALA C . 15702 1 1081 . 1 1 113 113 ALA CA C 13 54.4 0.2 . 1 . . . . 113 ALA CA . 15702 1 1082 . 1 1 113 113 ALA CB C 13 18.1 0.2 . 1 . . . . 113 ALA CB . 15702 1 1083 . 1 1 113 113 ALA N N 15 120.9 0.2 . 1 . . . . 113 ALA N . 15702 1 1084 . 1 1 114 114 MET H H 1 7.27 0.02 . 1 . . . . 114 MET H . 15702 1 1085 . 1 1 114 114 MET HA H 1 4.49 0.02 . 1 . . . . 114 MET HA . 15702 1 1086 . 1 1 114 114 MET HB2 H 1 2.12 0.02 . 2 . . . . 114 MET HB2 . 15702 1 1087 . 1 1 114 114 MET HB3 H 1 2.20 0.02 . 2 . . . . 114 MET HB3 . 15702 1 1088 . 1 1 114 114 MET HE1 H 1 2.02 0.02 . 1 . . . . 114 MET HE . 15702 1 1089 . 1 1 114 114 MET HE2 H 1 2.02 0.02 . 1 . . . . 114 MET HE . 15702 1 1090 . 1 1 114 114 MET HE3 H 1 2.02 0.02 . 1 . . . . 114 MET HE . 15702 1 1091 . 1 1 114 114 MET HG2 H 1 2.61 0.02 . 2 . . . . 114 MET HG2 . 15702 1 1092 . 1 1 114 114 MET HG3 H 1 2.74 0.02 . 2 . . . . 114 MET HG3 . 15702 1 1093 . 1 1 114 114 MET C C 13 175.1 0.2 . 1 . . . . 114 MET C . 15702 1 1094 . 1 1 114 114 MET CA C 13 55.1 0.2 . 1 . . . . 114 MET CA . 15702 1 1095 . 1 1 114 114 MET CB C 13 33.7 0.2 . 1 . . . . 114 MET CB . 15702 1 1096 . 1 1 114 114 MET CE C 13 17.2 0.2 . 1 . . . . 114 MET CE . 15702 1 1097 . 1 1 114 114 MET CG C 13 32.4 0.2 . 1 . . . . 114 MET CG . 15702 1 1098 . 1 1 114 114 MET N N 15 115.1 0.2 . 1 . . . . 114 MET N . 15702 1 1099 . 1 1 115 115 GLY H H 1 7.83 0.02 . 1 . . . . 115 GLY H . 15702 1 1100 . 1 1 115 115 GLY HA2 H 1 3.66 0.02 . 2 . . . . 115 GLY HA2 . 15702 1 1101 . 1 1 115 115 GLY HA3 H 1 4.06 0.02 . 2 . . . . 115 GLY HA3 . 15702 1 1102 . 1 1 115 115 GLY C C 13 173.7 0.2 . 1 . . . . 115 GLY C . 15702 1 1103 . 1 1 115 115 GLY CA C 13 45.6 0.2 . 1 . . . . 115 GLY CA . 15702 1 1104 . 1 1 115 115 GLY N N 15 106.3 0.2 . 1 . . . . 115 GLY N . 15702 1 1105 . 1 1 116 116 VAL H H 1 7.71 0.02 . 1 . . . . 116 VAL H . 15702 1 1106 . 1 1 116 116 VAL HA H 1 3.82 0.02 . 1 . . . . 116 VAL HA . 15702 1 1107 . 1 1 116 116 VAL HB H 1 1.71 0.02 . 1 . . . . 116 VAL HB . 15702 1 1108 . 1 1 116 116 VAL HG11 H 1 0.60 0.02 . 1 . . . . 116 VAL HG1 . 15702 1 1109 . 1 1 116 116 VAL HG12 H 1 0.60 0.02 . 1 . . . . 116 VAL HG1 . 15702 1 1110 . 1 1 116 116 VAL HG13 H 1 0.60 0.02 . 1 . . . . 116 VAL HG1 . 15702 1 1111 . 1 1 116 116 VAL HG21 H 1 0.79 0.02 . 1 . . . . 116 VAL HG2 . 15702 1 1112 . 1 1 116 116 VAL HG22 H 1 0.79 0.02 . 1 . . . . 116 VAL HG2 . 15702 1 1113 . 1 1 116 116 VAL HG23 H 1 0.79 0.02 . 1 . . . . 116 VAL HG2 . 15702 1 1114 . 1 1 116 116 VAL C C 13 174.8 0.2 . 1 . . . . 116 VAL C . 15702 1 1115 . 1 1 116 116 VAL CA C 13 61.2 0.2 . 1 . . . . 116 VAL CA . 15702 1 1116 . 1 1 116 116 VAL CB C 13 32.8 0.2 . 1 . . . . 116 VAL CB . 15702 1 1117 . 1 1 116 116 VAL CG1 C 13 21.0 0.2 . 1 . . . . 116 VAL CG1 . 15702 1 1118 . 1 1 116 116 VAL CG2 C 13 20.6 0.2 . 1 . . . . 116 VAL CG2 . 15702 1 1119 . 1 1 116 116 VAL N N 15 123.6 0.2 . 1 . . . . 116 VAL N . 15702 1 1120 . 1 1 117 117 GLY H H 1 7.73 0.02 . 1 . . . . 117 GLY H . 15702 1 1121 . 1 1 117 117 GLY HA2 H 1 3.57 0.02 . 2 . . . . 117 GLY HA2 . 15702 1 1122 . 1 1 117 117 GLY HA3 H 1 4.04 0.02 . 2 . . . . 117 GLY HA3 . 15702 1 1123 . 1 1 117 117 GLY C C 13 172.6 0.2 . 1 . . . . 117 GLY C . 15702 1 1124 . 1 1 117 117 GLY CA C 13 45.5 0.2 . 1 . . . . 117 GLY CA . 15702 1 1125 . 1 1 117 117 GLY N N 15 111.4 0.2 . 1 . . . . 117 GLY N . 15702 1 1126 . 1 1 118 118 VAL H H 1 7.74 0.02 . 1 . . . . 118 VAL H . 15702 1 1127 . 1 1 118 118 VAL HA H 1 5.10 0.02 . 1 . . . . 118 VAL HA . 15702 1 1128 . 1 1 118 118 VAL HB H 1 1.79 0.02 . 1 . . . . 118 VAL HB . 15702 1 1129 . 1 1 118 118 VAL HG11 H 1 0.74 0.02 . 1 . . . . 118 VAL HG1 . 15702 1 1130 . 1 1 118 118 VAL HG12 H 1 0.74 0.02 . 1 . . . . 118 VAL HG1 . 15702 1 1131 . 1 1 118 118 VAL HG13 H 1 0.74 0.02 . 1 . . . . 118 VAL HG1 . 15702 1 1132 . 1 1 118 118 VAL HG21 H 1 0.85 0.02 . 1 . . . . 118 VAL HG2 . 15702 1 1133 . 1 1 118 118 VAL HG22 H 1 0.85 0.02 . 1 . . . . 118 VAL HG2 . 15702 1 1134 . 1 1 118 118 VAL HG23 H 1 0.85 0.02 . 1 . . . . 118 VAL HG2 . 15702 1 1135 . 1 1 118 118 VAL C C 13 175.5 0.2 . 1 . . . . 118 VAL C . 15702 1 1136 . 1 1 118 118 VAL CA C 13 61.0 0.2 . 1 . . . . 118 VAL CA . 15702 1 1137 . 1 1 118 118 VAL CB C 13 34.3 0.2 . 1 . . . . 118 VAL CB . 15702 1 1138 . 1 1 118 118 VAL CG1 C 13 21.9 0.2 . 1 . . . . 118 VAL CG1 . 15702 1 1139 . 1 1 118 118 VAL CG2 C 13 22.4 0.2 . 1 . . . . 118 VAL CG2 . 15702 1 1140 . 1 1 118 118 VAL N N 15 120.9 0.2 . 1 . . . . 118 VAL N . 15702 1 1141 . 1 1 119 119 GLU H H 1 8.49 0.02 . 1 . . . . 119 GLU H . 15702 1 1142 . 1 1 119 119 GLU HA H 1 4.63 0.02 . 1 . . . . 119 GLU HA . 15702 1 1143 . 1 1 119 119 GLU HB2 H 1 1.64 0.02 . 2 . . . . 119 GLU HB2 . 15702 1 1144 . 1 1 119 119 GLU HB3 H 1 1.81 0.02 . 2 . . . . 119 GLU HB3 . 15702 1 1145 . 1 1 119 119 GLU HG2 H 1 1.97 0.02 . 2 . . . . 119 GLU HG2 . 15702 1 1146 . 1 1 119 119 GLU HG3 H 1 1.99 0.02 . 2 . . . . 119 GLU HG3 . 15702 1 1147 . 1 1 119 119 GLU C C 13 173.5 0.2 . 1 . . . . 119 GLU C . 15702 1 1148 . 1 1 119 119 GLU CA C 13 54.6 0.2 . 1 . . . . 119 GLU CA . 15702 1 1149 . 1 1 119 119 GLU CB C 13 32.3 0.2 . 1 . . . . 119 GLU CB . 15702 1 1150 . 1 1 119 119 GLU CG C 13 35.0 0.2 . 1 . . . . 119 GLU CG . 15702 1 1151 . 1 1 119 119 GLU N N 15 127.0 0.2 . 1 . . . . 119 GLU N . 15702 1 1152 . 1 1 120 120 ALA H H 1 8.60 0.02 . 1 . . . . 120 ALA H . 15702 1 1153 . 1 1 120 120 ALA HA H 1 5.53 0.02 . 1 . . . . 120 ALA HA . 15702 1 1154 . 1 1 120 120 ALA HB1 H 1 1.36 0.02 . 1 . . . . 120 ALA HB . 15702 1 1155 . 1 1 120 120 ALA HB2 H 1 1.36 0.02 . 1 . . . . 120 ALA HB . 15702 1 1156 . 1 1 120 120 ALA HB3 H 1 1.36 0.02 . 1 . . . . 120 ALA HB . 15702 1 1157 . 1 1 120 120 ALA C C 13 177.1 0.2 . 1 . . . . 120 ALA C . 15702 1 1158 . 1 1 120 120 ALA CA C 13 50.3 0.2 . 1 . . . . 120 ALA CA . 15702 1 1159 . 1 1 120 120 ALA CB C 13 20.8 0.2 . 1 . . . . 120 ALA CB . 15702 1 1160 . 1 1 120 120 ALA N N 15 126.5 0.2 . 1 . . . . 120 ALA N . 15702 1 1161 . 1 1 121 121 MET H H 1 9.43 0.02 . 1 . . . . 121 MET H . 15702 1 1162 . 1 1 121 121 MET HA H 1 4.63 0.02 . 1 . . . . 121 MET HA . 15702 1 1163 . 1 1 121 121 MET HB2 H 1 1.80 0.02 . 2 . . . . 121 MET HB2 . 15702 1 1164 . 1 1 121 121 MET HB3 H 1 2.37 0.02 . 2 . . . . 121 MET HB3 . 15702 1 1165 . 1 1 121 121 MET HE1 H 1 1.91 0.02 . 1 . . . . 121 MET HE . 15702 1 1166 . 1 1 121 121 MET HE2 H 1 1.91 0.02 . 1 . . . . 121 MET HE . 15702 1 1167 . 1 1 121 121 MET HE3 H 1 1.91 0.02 . 1 . . . . 121 MET HE . 15702 1 1168 . 1 1 121 121 MET HG2 H 1 2.36 0.02 . 2 . . . . 121 MET HG2 . 15702 1 1169 . 1 1 121 121 MET HG3 H 1 2.39 0.02 . 2 . . . . 121 MET HG3 . 15702 1 1170 . 1 1 121 121 MET C C 13 173.3 0.2 . 1 . . . . 121 MET C . 15702 1 1171 . 1 1 121 121 MET CA C 13 54.6 0.2 . 1 . . . . 121 MET CA . 15702 1 1172 . 1 1 121 121 MET CB C 13 36.8 0.2 . 1 . . . . 121 MET CB . 15702 1 1173 . 1 1 121 121 MET CE C 13 18.1 0.2 . 1 . . . . 121 MET CE . 15702 1 1174 . 1 1 121 121 MET CG C 13 31.8 0.2 . 1 . . . . 121 MET CG . 15702 1 1175 . 1 1 121 121 MET N N 15 120.4 0.2 . 1 . . . . 121 MET N . 15702 1 1176 . 1 1 122 122 ASP H H 1 8.46 0.02 . 1 . . . . 122 ASP H . 15702 1 1177 . 1 1 122 122 ASP HA H 1 4.17 0.02 . 1 . . . . 122 ASP HA . 15702 1 1178 . 1 1 122 122 ASP HB2 H 1 2.17 0.02 . 2 . . . . 122 ASP HB2 . 15702 1 1179 . 1 1 122 122 ASP HB3 H 1 2.96 0.02 . 2 . . . . 122 ASP HB3 . 15702 1 1180 . 1 1 122 122 ASP C C 13 175.2 0.2 . 1 . . . . 122 ASP C . 15702 1 1181 . 1 1 122 122 ASP CA C 13 55.0 0.2 . 1 . . . . 122 ASP CA . 15702 1 1182 . 1 1 122 122 ASP CB C 13 41.0 0.2 . 1 . . . . 122 ASP CB . 15702 1 1183 . 1 1 122 122 ASP N N 15 116.7 0.2 . 1 . . . . 122 ASP N . 15702 1 1184 . 1 1 123 123 THR H H 1 9.58 0.02 . 1 . . . . 123 THR H . 15702 1 1185 . 1 1 123 123 THR HA H 1 3.67 0.02 . 1 . . . . 123 THR HA . 15702 1 1186 . 1 1 123 123 THR HB H 1 4.02 0.02 . 1 . . . . 123 THR HB . 15702 1 1187 . 1 1 123 123 THR HG1 H 1 5.94 0.02 . 1 . . . . 123 THR HG1 . 15702 1 1188 . 1 1 123 123 THR HG21 H 1 0.99 0.02 . 1 . . . . 123 THR HG2 . 15702 1 1189 . 1 1 123 123 THR HG22 H 1 0.99 0.02 . 1 . . . . 123 THR HG2 . 15702 1 1190 . 1 1 123 123 THR HG23 H 1 0.99 0.02 . 1 . . . . 123 THR HG2 . 15702 1 1191 . 1 1 123 123 THR C C 13 174.4 0.2 . 1 . . . . 123 THR C . 15702 1 1192 . 1 1 123 123 THR CA C 13 68.7 0.2 . 1 . . . . 123 THR CA . 15702 1 1193 . 1 1 123 123 THR CB C 13 68.8 0.2 . 1 . . . . 123 THR CB . 15702 1 1194 . 1 1 123 123 THR CG2 C 13 22.3 0.2 . 1 . . . . 123 THR CG2 . 15702 1 1195 . 1 1 123 123 THR N N 15 119.6 0.2 . 1 . . . . 123 THR N . 15702 1 1196 . 1 1 124 124 GLN H H 1 8.58 0.02 . 1 . . . . 124 GLN H . 15702 1 1197 . 1 1 124 124 GLN HA H 1 3.24 0.02 . 1 . . . . 124 GLN HA . 15702 1 1198 . 1 1 124 124 GLN HB2 H 1 1.83 0.02 . 2 . . . . 124 GLN HB2 . 15702 1 1199 . 1 1 124 124 GLN HB3 H 1 1.85 0.02 . 2 . . . . 124 GLN HB3 . 15702 1 1200 . 1 1 124 124 GLN HG2 H 1 1.82 0.02 . 2 . . . . 124 GLN HG2 . 15702 1 1201 . 1 1 124 124 GLN HG3 H 1 2.26 0.02 . 2 . . . . 124 GLN HG3 . 15702 1 1202 . 1 1 124 124 GLN C C 13 177.7 0.2 . 1 . . . . 124 GLN C . 15702 1 1203 . 1 1 124 124 GLN CA C 13 60.1 0.2 . 1 . . . . 124 GLN CA . 15702 1 1204 . 1 1 124 124 GLN CB C 13 27.4 0.2 . 1 . . . . 124 GLN CB . 15702 1 1205 . 1 1 124 124 GLN CG C 13 34.2 0.2 . 1 . . . . 124 GLN CG . 15702 1 1206 . 1 1 124 124 GLN N N 15 121.5 0.2 . 1 . . . . 124 GLN N . 15702 1 1207 . 1 1 125 125 ALA H H 1 8.21 0.02 . 1 . . . . 125 ALA H . 15702 1 1208 . 1 1 125 125 ALA HA H 1 3.96 0.02 . 1 . . . . 125 ALA HA . 15702 1 1209 . 1 1 125 125 ALA HB1 H 1 1.37 0.02 . 1 . . . . 125 ALA HB . 15702 1 1210 . 1 1 125 125 ALA HB2 H 1 1.37 0.02 . 1 . . . . 125 ALA HB . 15702 1 1211 . 1 1 125 125 ALA HB3 H 1 1.37 0.02 . 1 . . . . 125 ALA HB . 15702 1 1212 . 1 1 125 125 ALA C C 13 167.8 0.2 . 1 . . . . 125 ALA C . 15702 1 1213 . 1 1 125 125 ALA CA C 13 54.8 0.2 . 1 . . . . 125 ALA CA . 15702 1 1214 . 1 1 125 125 ALA CB C 13 18.7 0.2 . 1 . . . . 125 ALA CB . 15702 1 1215 . 1 1 125 125 ALA N N 15 122.6 0.2 . 1 . . . . 125 ALA N . 15702 1 1216 . 1 1 126 126 ALA H H 1 8.90 0.02 . 1 . . . . 126 ALA H . 15702 1 1217 . 1 1 126 126 ALA HA H 1 4.11 0.02 . 1 . . . . 126 ALA HA . 15702 1 1218 . 1 1 126 126 ALA HB1 H 1 1.09 0.02 . 1 . . . . 126 ALA HB . 15702 1 1219 . 1 1 126 126 ALA HB2 H 1 1.09 0.02 . 1 . . . . 126 ALA HB . 15702 1 1220 . 1 1 126 126 ALA HB3 H 1 1.09 0.02 . 1 . . . . 126 ALA HB . 15702 1 1221 . 1 1 126 126 ALA C C 13 178.5 0.2 . 1 . . . . 126 ALA C . 15702 1 1222 . 1 1 126 126 ALA CA C 13 55.3 0.2 . 1 . . . . 126 ALA CA . 15702 1 1223 . 1 1 126 126 ALA CB C 13 18.1 0.2 . 1 . . . . 126 ALA CB . 15702 1 1224 . 1 1 126 126 ALA N N 15 124.6 0.2 . 1 . . . . 126 ALA N . 15702 1 1225 . 1 1 127 127 ALA H H 1 8.44 0.02 . 1 . . . . 127 ALA H . 15702 1 1226 . 1 1 127 127 ALA HA H 1 3.85 0.02 . 1 . . . . 127 ALA HA . 15702 1 1227 . 1 1 127 127 ALA HB1 H 1 1.36 0.02 . 1 . . . . 127 ALA HB . 15702 1 1228 . 1 1 127 127 ALA HB2 H 1 1.36 0.02 . 1 . . . . 127 ALA HB . 15702 1 1229 . 1 1 127 127 ALA HB3 H 1 1.36 0.02 . 1 . . . . 127 ALA HB . 15702 1 1230 . 1 1 127 127 ALA C C 13 178.4 0.2 . 1 . . . . 127 ALA C . 15702 1 1231 . 1 1 127 127 ALA CA C 13 55.5 0.2 . 1 . . . . 127 ALA CA . 15702 1 1232 . 1 1 127 127 ALA CB C 13 18.5 0.2 . 1 . . . . 127 ALA CB . 15702 1 1233 . 1 1 127 127 ALA N N 15 120.2 0.2 . 1 . . . . 127 ALA N . 15702 1 1234 . 1 1 128 128 ARG H H 1 7.79 0.02 . 1 . . . . 128 ARG H . 15702 1 1235 . 1 1 128 128 ARG HA H 1 4.02 0.02 . 1 . . . . 128 ARG HA . 15702 1 1236 . 1 1 128 128 ARG HB2 H 1 1.82 0.02 . 2 . . . . 128 ARG HB2 . 15702 1 1237 . 1 1 128 128 ARG HB3 H 1 1.93 0.02 . 2 . . . . 128 ARG HB3 . 15702 1 1238 . 1 1 128 128 ARG HG2 H 1 1.54 0.02 . 2 . . . . 128 ARG HG2 . 15702 1 1239 . 1 1 128 128 ARG HG3 H 1 1.56 0.02 . 2 . . . . 128 ARG HG3 . 15702 1 1240 . 1 1 128 128 ARG C C 13 179.4 0.2 . 1 . . . . 128 ARG C . 15702 1 1241 . 1 1 128 128 ARG CA C 13 59.6 0.2 . 1 . . . . 128 ARG CA . 15702 1 1242 . 1 1 128 128 ARG CB C 13 30.8 0.2 . 1 . . . . 128 ARG CB . 15702 1 1243 . 1 1 128 128 ARG CG C 13 27.9 0.2 . 1 . . . . 128 ARG CG . 15702 1 1244 . 1 1 128 128 ARG N N 15 115.9 0.2 . 1 . . . . 128 ARG N . 15702 1 1245 . 1 1 129 129 THR H H 1 8.44 0.02 . 1 . . . . 129 THR H . 15702 1 1246 . 1 1 129 129 THR HA H 1 3.77 0.02 . 1 . . . . 129 THR HA . 15702 1 1247 . 1 1 129 129 THR HB H 1 4.09 0.02 . 1 . . . . 129 THR HB . 15702 1 1248 . 1 1 129 129 THR HG21 H 1 1.10 0.02 . 1 . . . . 129 THR HG2 . 15702 1 1249 . 1 1 129 129 THR HG22 H 1 1.10 0.02 . 1 . . . . 129 THR HG2 . 15702 1 1250 . 1 1 129 129 THR HG23 H 1 1.10 0.02 . 1 . . . . 129 THR HG2 . 15702 1 1251 . 1 1 129 129 THR C C 13 175.3 0.2 . 1 . . . . 129 THR C . 15702 1 1252 . 1 1 129 129 THR CA C 13 67.3 0.2 . 1 . . . . 129 THR CA . 15702 1 1253 . 1 1 129 129 THR CB C 13 68.3 0.2 . 1 . . . . 129 THR CB . 15702 1 1254 . 1 1 129 129 THR CG2 C 13 21.5 0.2 . 1 . . . . 129 THR CG2 . 15702 1 1255 . 1 1 129 129 THR N N 15 116.4 0.2 . 1 . . . . 129 THR N . 15702 1 1256 . 1 1 130 130 TYR H H 1 8.79 0.02 . 1 . . . . 130 TYR H . 15702 1 1257 . 1 1 130 130 TYR HA H 1 3.60 0.02 . 1 . . . . 130 TYR HA . 15702 1 1258 . 1 1 130 130 TYR HB2 H 1 2.75 0.02 . 2 . . . . 130 TYR HB2 . 15702 1 1259 . 1 1 130 130 TYR HB3 H 1 3.11 0.02 . 2 . . . . 130 TYR HB3 . 15702 1 1260 . 1 1 130 130 TYR HD1 H 1 6.73 0.02 . 3 . . . . 130 TYR HD1 . 15702 1 1261 . 1 1 130 130 TYR HE1 H 1 6.83 0.02 . 3 . . . . 130 TYR HE1 . 15702 1 1262 . 1 1 130 130 TYR C C 13 175.5 0.2 . 1 . . . . 130 TYR C . 15702 1 1263 . 1 1 130 130 TYR CA C 13 62.6 0.2 . 1 . . . . 130 TYR CA . 15702 1 1264 . 1 1 130 130 TYR CB C 13 37.5 0.2 . 1 . . . . 130 TYR CB . 15702 1 1265 . 1 1 130 130 TYR N N 15 123.5 0.2 . 1 . . . . 130 TYR N . 15702 1 1266 . 1 1 131 131 ASN H H 1 7.80 0.02 . 1 . . . . 131 ASN H . 15702 1 1267 . 1 1 131 131 ASN HA H 1 4.22 0.02 . 1 . . . . 131 ASN HA . 15702 1 1268 . 1 1 131 131 ASN HB2 H 1 2.83 0.02 . 2 . . . . 131 ASN HB2 . 15702 1 1269 . 1 1 131 131 ASN HB3 H 1 2.99 0.02 . 2 . . . . 131 ASN HB3 . 15702 1 1270 . 1 1 131 131 ASN C C 13 179.2 0.2 . 1 . . . . 131 ASN C . 15702 1 1271 . 1 1 131 131 ASN CA C 13 55.5 0.2 . 1 . . . . 131 ASN CA . 15702 1 1272 . 1 1 131 131 ASN CB C 13 37.1 0.2 . 1 . . . . 131 ASN CB . 15702 1 1273 . 1 1 131 131 ASN N N 15 117.7 0.2 . 1 . . . . 131 ASN N . 15702 1 1274 . 1 1 132 132 ILE H H 1 7.52 0.02 . 1 . . . . 132 ILE H . 15702 1 1275 . 1 1 132 132 ILE HA H 1 3.71 0.02 . 1 . . . . 132 ILE HA . 15702 1 1276 . 1 1 132 132 ILE HB H 1 1.90 0.02 . 1 . . . . 132 ILE HB . 15702 1 1277 . 1 1 132 132 ILE HD11 H 1 0.82 0.02 . 1 . . . . 132 ILE HD1 . 15702 1 1278 . 1 1 132 132 ILE HD12 H 1 0.82 0.02 . 1 . . . . 132 ILE HD1 . 15702 1 1279 . 1 1 132 132 ILE HD13 H 1 0.82 0.02 . 1 . . . . 132 ILE HD1 . 15702 1 1280 . 1 1 132 132 ILE HG12 H 1 1.08 0.02 . 2 . . . . 132 ILE HG12 . 15702 1 1281 . 1 1 132 132 ILE HG13 H 1 1.74 0.02 . 2 . . . . 132 ILE HG13 . 15702 1 1282 . 1 1 132 132 ILE HG21 H 1 0.85 0.02 . 1 . . . . 132 ILE HG2 . 15702 1 1283 . 1 1 132 132 ILE HG22 H 1 0.85 0.02 . 1 . . . . 132 ILE HG2 . 15702 1 1284 . 1 1 132 132 ILE HG23 H 1 0.85 0.02 . 1 . . . . 132 ILE HG2 . 15702 1 1285 . 1 1 132 132 ILE C C 13 178.1 0.2 . 1 . . . . 132 ILE C . 15702 1 1286 . 1 1 132 132 ILE CA C 13 64.9 0.2 . 1 . . . . 132 ILE CA . 15702 1 1287 . 1 1 132 132 ILE CB C 13 38.5 0.2 . 1 . . . . 132 ILE CB . 15702 1 1288 . 1 1 132 132 ILE CD1 C 13 13.3 0.2 . 1 . . . . 132 ILE CD1 . 15702 1 1289 . 1 1 132 132 ILE CG1 C 13 29.0 0.2 . 1 . . . . 132 ILE CG1 . 15702 1 1290 . 1 1 132 132 ILE CG2 C 13 17.0 0.2 . 1 . . . . 132 ILE CG2 . 15702 1 1291 . 1 1 132 132 ILE N N 15 121.0 0.2 . 1 . . . . 132 ILE N . 15702 1 1292 . 1 1 133 133 LEU H H 1 8.42 0.02 . 1 . . . . 133 LEU H . 15702 1 1293 . 1 1 133 133 LEU HA H 1 3.91 0.02 . 1 . . . . 133 LEU HA . 15702 1 1294 . 1 1 133 133 LEU HB2 H 1 0.98 0.02 . 2 . . . . 133 LEU HB2 . 15702 1 1295 . 1 1 133 133 LEU HB3 H 1 1.62 0.02 . 2 . . . . 133 LEU HB3 . 15702 1 1296 . 1 1 133 133 LEU HD11 H 1 0.75 0.02 . 1 . . . . 133 LEU HD1 . 15702 1 1297 . 1 1 133 133 LEU HD12 H 1 0.75 0.02 . 1 . . . . 133 LEU HD1 . 15702 1 1298 . 1 1 133 133 LEU HD13 H 1 0.75 0.02 . 1 . . . . 133 LEU HD1 . 15702 1 1299 . 1 1 133 133 LEU HD21 H 1 0.71 0.02 . 1 . . . . 133 LEU HD2 . 15702 1 1300 . 1 1 133 133 LEU HD22 H 1 0.71 0.02 . 1 . . . . 133 LEU HD2 . 15702 1 1301 . 1 1 133 133 LEU HD23 H 1 0.71 0.02 . 1 . . . . 133 LEU HD2 . 15702 1 1302 . 1 1 133 133 LEU HG H 1 1.80 0.02 . 1 . . . . 133 LEU HG . 15702 1 1303 . 1 1 133 133 LEU C C 13 179.6 0.2 . 1 . . . . 133 LEU C . 15702 1 1304 . 1 1 133 133 LEU CA C 13 57.9 0.2 . 1 . . . . 133 LEU CA . 15702 1 1305 . 1 1 133 133 LEU CB C 13 41.7 0.2 . 1 . . . . 133 LEU CB . 15702 1 1306 . 1 1 133 133 LEU CD1 C 13 25.6 0.2 . 1 . . . . 133 LEU CD1 . 15702 1 1307 . 1 1 133 133 LEU CD2 C 13 22.4 0.2 . 1 . . . . 133 LEU CD2 . 15702 1 1308 . 1 1 133 133 LEU CG C 13 27.2 0.2 . 1 . . . . 133 LEU CG . 15702 1 1309 . 1 1 133 133 LEU N N 15 120.5 0.2 . 1 . . . . 133 LEU N . 15702 1 1310 . 1 1 134 134 MET H H 1 8.99 0.02 . 1 . . . . 134 MET H . 15702 1 1311 . 1 1 134 134 MET HA H 1 3.87 0.02 . 1 . . . . 134 MET HA . 15702 1 1312 . 1 1 134 134 MET HB2 H 1 1.40 0.02 . 2 . . . . 134 MET HB2 . 15702 1 1313 . 1 1 134 134 MET HB3 H 1 1.75 0.02 . 2 . . . . 134 MET HB3 . 15702 1 1314 . 1 1 134 134 MET HE1 H 1 2.08 0.02 . 1 . . . . 134 MET HE . 15702 1 1315 . 1 1 134 134 MET HE2 H 1 2.08 0.02 . 1 . . . . 134 MET HE . 15702 1 1316 . 1 1 134 134 MET HE3 H 1 2.08 0.02 . 1 . . . . 134 MET HE . 15702 1 1317 . 1 1 134 134 MET HG2 H 1 2.21 0.02 . 2 . . . . 134 MET HG2 . 15702 1 1318 . 1 1 134 134 MET HG3 H 1 2.64 0.02 . 2 . . . . 134 MET HG3 . 15702 1 1319 . 1 1 134 134 MET C C 13 167.4 0.2 . 1 . . . . 134 MET C . 15702 1 1320 . 1 1 134 134 MET CA C 13 58.4 0.2 . 1 . . . . 134 MET CA . 15702 1 1321 . 1 1 134 134 MET CB C 13 30.7 0.2 . 1 . . . . 134 MET CB . 15702 1 1322 . 1 1 134 134 MET CE C 13 17.6 0.2 . 1 . . . . 134 MET CE . 15702 1 1323 . 1 1 134 134 MET CG C 13 31.4 0.2 . 1 . . . . 134 MET CG . 15702 1 1324 . 1 1 134 134 MET N N 15 119.9 0.2 . 1 . . . . 134 MET N . 15702 1 1325 . 1 1 135 135 ALA H H 1 7.49 0.02 . 1 . . . . 135 ALA H . 15702 1 1326 . 1 1 135 135 ALA HA H 1 4.06 0.02 . 1 . . . . 135 ALA HA . 15702 1 1327 . 1 1 135 135 ALA HB1 H 1 1.51 0.02 . 1 . . . . 135 ALA HB . 15702 1 1328 . 1 1 135 135 ALA HB2 H 1 1.51 0.02 . 1 . . . . 135 ALA HB . 15702 1 1329 . 1 1 135 135 ALA HB3 H 1 1.51 0.02 . 1 . . . . 135 ALA HB . 15702 1 1330 . 1 1 135 135 ALA C C 13 179.1 0.2 . 1 . . . . 135 ALA C . 15702 1 1331 . 1 1 135 135 ALA CA C 13 54.7 0.2 . 1 . . . . 135 ALA CA . 15702 1 1332 . 1 1 135 135 ALA CB C 13 18.0 0.2 . 1 . . . . 135 ALA CB . 15702 1 1333 . 1 1 135 135 ALA N N 15 124.6 0.2 . 1 . . . . 135 ALA N . 15702 1 1334 . 1 1 136 136 GLU H H 1 7.54 0.02 . 1 . . . . 136 GLU H . 15702 1 1335 . 1 1 136 136 GLU HA H 1 4.23 0.02 . 1 . . . . 136 GLU HA . 15702 1 1336 . 1 1 136 136 GLU HB2 H 1 2.11 0.02 . 2 . . . . 136 GLU HB2 . 15702 1 1337 . 1 1 136 136 GLU HB3 H 1 2.20 0.02 . 2 . . . . 136 GLU HB3 . 15702 1 1338 . 1 1 136 136 GLU HG2 H 1 2.26 0.02 . 2 . . . . 136 GLU HG2 . 15702 1 1339 . 1 1 136 136 GLU HG3 H 1 2.49 0.02 . 2 . . . . 136 GLU HG3 . 15702 1 1340 . 1 1 136 136 GLU C C 13 176.9 0.2 . 1 . . . . 136 GLU C . 15702 1 1341 . 1 1 136 136 GLU CA C 13 56.4 0.2 . 1 . . . . 136 GLU CA . 15702 1 1342 . 1 1 136 136 GLU CB C 13 30.3 0.2 . 1 . . . . 136 GLU CB . 15702 1 1343 . 1 1 136 136 GLU CG C 13 36.3 0.2 . 1 . . . . 136 GLU CG . 15702 1 1344 . 1 1 136 136 GLU N N 15 116.5 0.2 . 1 . . . . 136 GLU N . 15702 1 1345 . 1 1 137 137 GLY H H 1 7.87 0.02 . 1 . . . . 137 GLY H . 15702 1 1346 . 1 1 137 137 GLY HA2 H 1 3.76 0.02 . 2 . . . . 137 GLY HA2 . 15702 1 1347 . 1 1 137 137 GLY HA3 H 1 4.14 0.02 . 2 . . . . 137 GLY HA3 . 15702 1 1348 . 1 1 137 137 GLY C C 13 175.1 0.2 . 1 . . . . 137 GLY C . 15702 1 1349 . 1 1 137 137 GLY CA C 13 45.6 0.2 . 1 . . . . 137 GLY CA . 15702 1 1350 . 1 1 137 137 GLY N N 15 107.1 0.2 . 1 . . . . 137 GLY N . 15702 1 1351 . 1 1 138 138 ARG H H 1 7.58 0.02 . 1 . . . . 138 ARG H . 15702 1 1352 . 1 1 138 138 ARG HA H 1 4.27 0.02 . 1 . . . . 138 ARG HA . 15702 1 1353 . 1 1 138 138 ARG HB2 H 1 1.44 0.02 . 2 . . . . 138 ARG HB2 . 15702 1 1354 . 1 1 138 138 ARG HB3 H 1 1.58 0.02 . 2 . . . . 138 ARG HB3 . 15702 1 1355 . 1 1 138 138 ARG HG2 H 1 1.59 0.02 . 2 . . . . 138 ARG HG2 . 15702 1 1356 . 1 1 138 138 ARG HG3 H 1 1.61 0.02 . 2 . . . . 138 ARG HG3 . 15702 1 1357 . 1 1 138 138 ARG C C 13 176.9 0.2 . 1 . . . . 138 ARG C . 15702 1 1358 . 1 1 138 138 ARG CA C 13 54.5 0.2 . 1 . . . . 138 ARG CA . 15702 1 1359 . 1 1 138 138 ARG CB C 13 30.1 0.2 . 1 . . . . 138 ARG CB . 15702 1 1360 . 1 1 138 138 ARG CG C 13 26.9 0.2 . 1 . . . . 138 ARG CG . 15702 1 1361 . 1 1 138 138 ARG N N 15 118.1 0.2 . 1 . . . . 138 ARG N . 15702 1 1362 . 1 1 139 139 ARG H H 1 9.24 0.02 . 1 . . . . 139 ARG H . 15702 1 1363 . 1 1 139 139 ARG HA H 1 4.47 0.02 . 1 . . . . 139 ARG HA . 15702 1 1364 . 1 1 139 139 ARG HB2 H 1 1.91 0.02 . 2 . . . . 139 ARG HB2 . 15702 1 1365 . 1 1 139 139 ARG HB3 H 1 1.93 0.02 . 2 . . . . 139 ARG HB3 . 15702 1 1366 . 1 1 139 139 ARG HD2 H 1 3.22 0.02 . 2 . . . . 139 ARG HD2 . 15702 1 1367 . 1 1 139 139 ARG HD3 H 1 3.24 0.02 . 2 . . . . 139 ARG HD3 . 15702 1 1368 . 1 1 139 139 ARG HG2 H 1 1.79 0.02 . 2 . . . . 139 ARG HG2 . 15702 1 1369 . 1 1 139 139 ARG HG3 H 1 1.81 0.02 . 2 . . . . 139 ARG HG3 . 15702 1 1370 . 1 1 139 139 ARG C C 13 174.4 0.2 . 1 . . . . 139 ARG C . 15702 1 1371 . 1 1 139 139 ARG CA C 13 55.7 0.2 . 1 . . . . 139 ARG CA . 15702 1 1372 . 1 1 139 139 ARG CB C 13 28.0 0.2 . 1 . . . . 139 ARG CB . 15702 1 1373 . 1 1 139 139 ARG CD C 13 43.2 0.2 . 1 . . . . 139 ARG CD . 15702 1 1374 . 1 1 139 139 ARG CG C 13 27.1 0.2 . 1 . . . . 139 ARG CG . 15702 1 1375 . 1 1 139 139 ARG N N 15 124.4 0.2 . 1 . . . . 139 ARG N . 15702 1 1376 . 1 1 140 140 VAL H H 1 7.25 0.02 . 1 . . . . 140 VAL H . 15702 1 1377 . 1 1 140 140 VAL HA H 1 5.18 0.02 . 1 . . . . 140 VAL HA . 15702 1 1378 . 1 1 140 140 VAL HB H 1 1.62 0.02 . 1 . . . . 140 VAL HB . 15702 1 1379 . 1 1 140 140 VAL HG11 H 1 0.76 0.02 . 1 . . . . 140 VAL HG1 . 15702 1 1380 . 1 1 140 140 VAL HG12 H 1 0.76 0.02 . 1 . . . . 140 VAL HG1 . 15702 1 1381 . 1 1 140 140 VAL HG13 H 1 0.76 0.02 . 1 . . . . 140 VAL HG1 . 15702 1 1382 . 1 1 140 140 VAL HG21 H 1 0.91 0.02 . 1 . . . . 140 VAL HG2 . 15702 1 1383 . 1 1 140 140 VAL HG22 H 1 0.91 0.02 . 1 . . . . 140 VAL HG2 . 15702 1 1384 . 1 1 140 140 VAL HG23 H 1 0.91 0.02 . 1 . . . . 140 VAL HG2 . 15702 1 1385 . 1 1 140 140 VAL C C 13 172.8 0.2 . 1 . . . . 140 VAL C . 15702 1 1386 . 1 1 140 140 VAL CA C 13 57.7 0.2 . 1 . . . . 140 VAL CA . 15702 1 1387 . 1 1 140 140 VAL CB C 13 34.7 0.2 . 1 . . . . 140 VAL CB . 15702 1 1388 . 1 1 140 140 VAL CG1 C 13 18.7 0.2 . 1 . . . . 140 VAL CG1 . 15702 1 1389 . 1 1 140 140 VAL CG2 C 13 22.7 0.2 . 1 . . . . 140 VAL CG2 . 15702 1 1390 . 1 1 140 140 VAL N N 15 121.9 0.2 . 1 . . . . 140 VAL N . 15702 1 1391 . 1 1 141 141 VAL H H 1 8.18 0.02 . 1 . . . . 141 VAL H . 15702 1 1392 . 1 1 141 141 VAL HA H 1 4.51 0.02 . 1 . . . . 141 VAL HA . 15702 1 1393 . 1 1 141 141 VAL HB H 1 1.63 0.02 . 1 . . . . 141 VAL HB . 15702 1 1394 . 1 1 141 141 VAL HG11 H 1 0.70 0.02 . 1 . . . . 141 VAL HG1 . 15702 1 1395 . 1 1 141 141 VAL HG12 H 1 0.70 0.02 . 1 . . . . 141 VAL HG1 . 15702 1 1396 . 1 1 141 141 VAL HG13 H 1 0.70 0.02 . 1 . . . . 141 VAL HG1 . 15702 1 1397 . 1 1 141 141 VAL HG21 H 1 0.87 0.02 . 1 . . . . 141 VAL HG2 . 15702 1 1398 . 1 1 141 141 VAL HG22 H 1 0.87 0.02 . 1 . . . . 141 VAL HG2 . 15702 1 1399 . 1 1 141 141 VAL HG23 H 1 0.87 0.02 . 1 . . . . 141 VAL HG2 . 15702 1 1400 . 1 1 141 141 VAL C C 13 172.6 0.2 . 1 . . . . 141 VAL C . 15702 1 1401 . 1 1 141 141 VAL CA C 13 60.3 0.2 . 1 . . . . 141 VAL CA . 15702 1 1402 . 1 1 141 141 VAL CB C 13 35.6 0.2 . 1 . . . . 141 VAL CB . 15702 1 1403 . 1 1 141 141 VAL CG1 C 13 21.6 0.2 . 1 . . . . 141 VAL CG1 . 15702 1 1404 . 1 1 141 141 VAL CG2 C 13 22.0 0.2 . 1 . . . . 141 VAL CG2 . 15702 1 1405 . 1 1 141 141 VAL N N 15 123.9 0.2 . 1 . . . . 141 VAL N . 15702 1 1406 . 1 1 142 142 VAL H H 1 8.43 0.02 . 1 . . . . 142 VAL H . 15702 1 1407 . 1 1 142 142 VAL HA H 1 5.22 0.02 . 1 . . . . 142 VAL HA . 15702 1 1408 . 1 1 142 142 VAL HB H 1 1.23 0.02 . 1 . . . . 142 VAL HB . 15702 1 1409 . 1 1 142 142 VAL HG11 H 1 -0.83 0.02 . 1 . . . . 142 VAL HG1 . 15702 1 1410 . 1 1 142 142 VAL HG12 H 1 -0.83 0.02 . 1 . . . . 142 VAL HG1 . 15702 1 1411 . 1 1 142 142 VAL HG13 H 1 -0.83 0.02 . 1 . . . . 142 VAL HG1 . 15702 1 1412 . 1 1 142 142 VAL HG21 H 1 0.31 0.02 . 1 . . . . 142 VAL HG2 . 15702 1 1413 . 1 1 142 142 VAL HG22 H 1 0.31 0.02 . 1 . . . . 142 VAL HG2 . 15702 1 1414 . 1 1 142 142 VAL HG23 H 1 0.31 0.02 . 1 . . . . 142 VAL HG2 . 15702 1 1415 . 1 1 142 142 VAL C C 13 170.0 0.2 . 1 . . . . 142 VAL C . 15702 1 1416 . 1 1 142 142 VAL CA C 13 57.6 0.2 . 1 . . . . 142 VAL CA . 15702 1 1417 . 1 1 142 142 VAL CB C 13 35.5 0.2 . 1 . . . . 142 VAL CB . 15702 1 1418 . 1 1 142 142 VAL CG1 C 13 19.2 0.2 . 1 . . . . 142 VAL CG1 . 15702 1 1419 . 1 1 142 142 VAL CG2 C 13 22.1 0.2 . 1 . . . . 142 VAL CG2 . 15702 1 1420 . 1 1 142 142 VAL N N 15 124.6 0.2 . 1 . . . . 142 VAL N . 15702 1 1421 . 1 1 143 143 ALA H H 1 8.22 0.02 . 1 . . . . 143 ALA H . 15702 1 1422 . 1 1 143 143 ALA HA H 1 4.68 0.02 . 1 . . . . 143 ALA HA . 15702 1 1423 . 1 1 143 143 ALA HB1 H 1 -0.26 0.02 . 1 . . . . 143 ALA HB . 15702 1 1424 . 1 1 143 143 ALA HB2 H 1 -0.26 0.02 . 1 . . . . 143 ALA HB . 15702 1 1425 . 1 1 143 143 ALA HB3 H 1 -0.26 0.02 . 1 . . . . 143 ALA HB . 15702 1 1426 . 1 1 143 143 ALA C C 13 175.4 0.2 . 1 . . . . 143 ALA C . 15702 1 1427 . 1 1 143 143 ALA CA C 13 49.9 0.2 . 1 . . . . 143 ALA CA . 15702 1 1428 . 1 1 143 143 ALA CB C 13 19.6 0.2 . 1 . . . . 143 ALA CB . 15702 1 1429 . 1 1 143 143 ALA N N 15 129.1 0.2 . 1 . . . . 143 ALA N . 15702 1 1430 . 1 1 144 144 LEU H H 1 9.07 0.02 . 1 . . . . 144 LEU H . 15702 1 1431 . 1 1 144 144 LEU HA H 1 4.84 0.02 . 1 . . . . 144 LEU HA . 15702 1 1432 . 1 1 144 144 LEU HB2 H 1 1.21 0.02 . 2 . . . . 144 LEU HB2 . 15702 1 1433 . 1 1 144 144 LEU HB3 H 1 1.68 0.02 . 2 . . . . 144 LEU HB3 . 15702 1 1434 . 1 1 144 144 LEU HD11 H 1 0.76 0.02 . 1 . . . . 144 LEU HD1 . 15702 1 1435 . 1 1 144 144 LEU HD12 H 1 0.76 0.02 . 1 . . . . 144 LEU HD1 . 15702 1 1436 . 1 1 144 144 LEU HD13 H 1 0.76 0.02 . 1 . . . . 144 LEU HD1 . 15702 1 1437 . 1 1 144 144 LEU HD21 H 1 0.73 0.02 . 1 . . . . 144 LEU HD2 . 15702 1 1438 . 1 1 144 144 LEU HD22 H 1 0.73 0.02 . 1 . . . . 144 LEU HD2 . 15702 1 1439 . 1 1 144 144 LEU HD23 H 1 0.73 0.02 . 1 . . . . 144 LEU HD2 . 15702 1 1440 . 1 1 144 144 LEU HG H 1 1.20 0.02 . 1 . . . . 144 LEU HG . 15702 1 1441 . 1 1 144 144 LEU CA C 13 53.4 0.2 . 1 . . . . 144 LEU CA . 15702 1 1442 . 1 1 144 144 LEU CB C 13 46.5 0.2 . 1 . . . . 144 LEU CB . 15702 1 1443 . 1 1 144 144 LEU CD1 C 13 26.6 0.2 . 1 . . . . 144 LEU CD1 . 15702 1 1444 . 1 1 144 144 LEU CD2 C 13 25.1 0.2 . 1 . . . . 144 LEU CD2 . 15702 1 1445 . 1 1 144 144 LEU N N 15 119.6 0.2 . 1 . . . . 144 LEU N . 15702 1 1446 . 1 1 145 145 LEU HA H 1 4.83 0.02 . 1 . . . . 145 LEU HA . 15702 1 1447 . 1 1 145 145 LEU HB2 H 1 1.42 0.02 . 2 . . . . 145 LEU HB2 . 15702 1 1448 . 1 1 145 145 LEU HB3 H 1 1.58 0.02 . 2 . . . . 145 LEU HB3 . 15702 1 1449 . 1 1 145 145 LEU HD11 H 1 0.70 0.02 . 1 . . . . 145 LEU HD1 . 15702 1 1450 . 1 1 145 145 LEU HD12 H 1 0.70 0.02 . 1 . . . . 145 LEU HD1 . 15702 1 1451 . 1 1 145 145 LEU HD13 H 1 0.70 0.02 . 1 . . . . 145 LEU HD1 . 15702 1 1452 . 1 1 145 145 LEU HD21 H 1 0.57 0.02 . 1 . . . . 145 LEU HD2 . 15702 1 1453 . 1 1 145 145 LEU HD22 H 1 0.57 0.02 . 1 . . . . 145 LEU HD2 . 15702 1 1454 . 1 1 145 145 LEU HD23 H 1 0.57 0.02 . 1 . . . . 145 LEU HD2 . 15702 1 1455 . 1 1 145 145 LEU HG H 1 1.74 0.02 . 1 . . . . 145 LEU HG . 15702 1 1456 . 1 1 145 145 LEU CA C 13 51.8 0.2 . 1 . . . . 145 LEU CA . 15702 1 1457 . 1 1 145 145 LEU CB C 13 41.7 0.2 . 1 . . . . 145 LEU CB . 15702 1 1458 . 1 1 145 145 LEU CD1 C 13 24.7 0.2 . 1 . . . . 145 LEU CD1 . 15702 1 1459 . 1 1 145 145 LEU CD2 C 13 25.2 0.2 . 1 . . . . 145 LEU CD2 . 15702 1 1460 . 1 1 145 145 LEU CG C 13 27.7 0.2 . 1 . . . . 145 LEU CG . 15702 1 1461 . 1 1 146 146 PRO HA H 1 4.33 0.02 . 1 . . . . 146 PRO HA . 15702 1 1462 . 1 1 146 146 PRO HD2 H 1 3.61 0.02 . 2 . . . . 146 PRO HD2 . 15702 1 1463 . 1 1 146 146 PRO HD3 H 1 3.77 0.02 . 2 . . . . 146 PRO HD3 . 15702 1 1464 . 1 1 146 146 PRO HG2 H 1 1.58 0.02 . 2 . . . . 146 PRO HG2 . 15702 1 1465 . 1 1 146 146 PRO HG3 H 1 1.90 0.02 . 2 . . . . 146 PRO HG3 . 15702 1 1466 . 1 1 146 146 PRO C C 13 175.7 0.2 . 1 . . . . 146 PRO C . 15702 1 1467 . 1 1 146 146 PRO CA C 13 62.8 0.2 . 1 . . . . 146 PRO CA . 15702 1 1468 . 1 1 146 146 PRO CB C 13 31.5 0.2 . 1 . . . . 146 PRO CB . 15702 1 1469 . 1 1 146 146 PRO CD C 13 50.2 0.2 . 1 . . . . 146 PRO CD . 15702 1 1470 . 1 1 147 147 ASP H H 1 8.66 0.02 . 1 . . . . 147 ASP H . 15702 1 1471 . 1 1 147 147 ASP HA H 1 4.51 0.02 . 1 . . . . 147 ASP HA . 15702 1 1472 . 1 1 147 147 ASP HB2 H 1 2.49 0.02 . 2 . . . . 147 ASP HB2 . 15702 1 1473 . 1 1 147 147 ASP HB3 H 1 2.67 0.02 . 2 . . . . 147 ASP HB3 . 15702 1 1474 . 1 1 147 147 ASP C C 13 176.3 0.2 . 1 . . . . 147 ASP C . 15702 1 1475 . 1 1 147 147 ASP CA C 13 54.3 0.2 . 1 . . . . 147 ASP CA . 15702 1 1476 . 1 1 147 147 ASP CB C 13 42.1 0.2 . 1 . . . . 147 ASP CB . 15702 1 1477 . 1 1 147 147 ASP N N 15 120.7 0.2 . 1 . . . . 147 ASP N . 15702 1 1478 . 1 1 148 148 GLY H H 1 8.31 0.02 . 1 . . . . 148 GLY H . 15702 1 1479 . 1 1 148 148 GLY HA2 H 1 4.02 0.02 . 2 . . . . 148 GLY HA2 . 15702 1 1480 . 1 1 148 148 GLY HA3 H 1 4.05 0.02 . 2 . . . . 148 GLY HA3 . 15702 1 1481 . 1 1 148 148 GLY C C 13 173.6 0.2 . 1 . . . . 148 GLY C . 15702 1 1482 . 1 1 148 148 GLY CA C 13 45.2 0.2 . 1 . . . . 148 GLY CA . 15702 1 1483 . 1 1 148 148 GLY N N 15 109.4 0.2 . 1 . . . . 148 GLY N . 15702 1 1484 . 1 1 149 149 ASP H H 1 8.55 0.02 . 1 . . . . 149 ASP H . 15702 1 1485 . 1 1 149 149 ASP HA H 1 4.65 0.02 . 1 . . . . 149 ASP HA . 15702 1 1486 . 1 1 149 149 ASP HB2 H 1 2.63 0.02 . 2 . . . . 149 ASP HB2 . 15702 1 1487 . 1 1 149 149 ASP HB3 H 1 2.69 0.02 . 2 . . . . 149 ASP HB3 . 15702 1 1488 . 1 1 149 149 ASP C C 13 176.7 0.2 . 1 . . . . 149 ASP C . 15702 1 1489 . 1 1 149 149 ASP CA C 13 54.5 0.2 . 1 . . . . 149 ASP CA . 15702 1 1490 . 1 1 149 149 ASP CB C 13 41.6 0.2 . 1 . . . . 149 ASP CB . 15702 1 1491 . 1 1 149 149 ASP N N 15 120.8 0.2 . 1 . . . . 149 ASP N . 15702 1 1492 . 1 1 150 150 SER H H 1 8.60 0.02 . 1 . . . . 150 SER H . 15702 1 1493 . 1 1 150 150 SER HA H 1 4.35 0.02 . 1 . . . . 150 SER HA . 15702 1 1494 . 1 1 150 150 SER HB2 H 1 3.86 0.02 . 2 . . . . 150 SER HB2 . 15702 1 1495 . 1 1 150 150 SER HB3 H 1 3.90 0.02 . 2 . . . . 150 SER HB3 . 15702 1 1496 . 1 1 150 150 SER C C 13 175.0 0.2 . 1 . . . . 150 SER C . 15702 1 1497 . 1 1 150 150 SER CA C 13 58.9 0.2 . 1 . . . . 150 SER CA . 15702 1 1498 . 1 1 150 150 SER CB C 13 63.5 0.2 . 1 . . . . 150 SER CB . 15702 1 1499 . 1 1 150 150 SER N N 15 116.4 0.2 . 1 . . . . 150 SER N . 15702 1 1500 . 1 1 151 151 LEU H H 1 8.29 0.02 . 1 . . . . 151 LEU H . 15702 1 1501 . 1 1 151 151 LEU CA C 13 55.5 0.2 . 1 . . . . 151 LEU CA . 15702 1 1502 . 1 1 151 151 LEU CB C 13 41.9 0.2 . 1 . . . . 151 LEU CB . 15702 1 1503 . 1 1 151 151 LEU N N 15 123.5 0.2 . 1 . . . . 151 LEU N . 15702 1 stop_ save_