data_16188 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 16188 _Entry.Title ; NMR structure of Rv2175c ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2009-02-27 _Entry.Accession_date 2009-02-27 _Entry.Last_release_date . _Entry.Original_release_date . _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 3.0.9.13 _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 Philippe Barthe . . . 16188 2 Martin Cohen-Gonsaud . . . 16188 3 Christian Roumestand . . . 16188 4 Virginie Molle . . . 16188 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 . 'not applicable' 'not applicable' . 16188 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID 'DNA binding' . 16188 Phosphorylation . 16188 wHTH . 16188 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 16188 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 369 16188 '15N chemical shifts' 152 16188 '1H chemical shifts' 998 16188 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 3 . . 2010-06-02 2009-02-27 update BMRB 'edit assembly name' 16188 2 . . 2009-07-13 2009-02-27 update BMRB 'complete entry citation' 16188 1 . . 2009-05-29 2009-02-27 original author 'original release' 16188 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 2KFS 'BMRB Entry Tracking System' 16188 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 16188 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 19457863 _Citation.Full_citation . _Citation.Title 'The Mycobacterium tuberculosis Ser/Thr kinase substrate Rv2175c is a DNA-binding protein regulated by phosphorylation' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'J. Biol. Chem.' _Citation.Journal_name_full . _Citation.Journal_volume 284 _Citation.Journal_issue 29 _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 19290 _Citation.Page_last 19300 _Citation.Year 2009 _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 Martin Cohen-Gonsaud . . . 16188 1 2 Philippe Barthe . . . 16188 1 3 Marc Canova . J. . 16188 1 4 Charlotte Stagier-Simon . . . 16188 1 5 Laurent Kremer . . . 16188 1 6 Christian Roumestand . . . 16188 1 7 Virginie Molle . . . 16188 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 16188 _Assembly.ID 1 _Assembly.Name Rv2175c _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 Rv2175c 1 $Rv2175c A . yes native no no . . . 16188 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_Rv2175c _Entity.Sf_category entity _Entity.Sf_framecode Rv2175c _Entity.Entry_ID 16188 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name Rv2175c _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 ; MPGRAPGSTLARVGSIPAGD DVLDPDEPTYDLPRVAELLG VPVSKVAQQLREGHLVAVRR AGGVVIPQVFFTNSGQVVKS LPGLLTILHDGGYRDTEIMR WLFTPDPSLTITRDGSRDAV SNARPVDALHAHQAREVVRR AQAMAY ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 146 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method man _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 15763.063 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-11-25 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 2KFS . "Nmr Structure Of Rv2175c" . . . . . 99.32 148 100.00 100.00 6.26e-97 . . . . 16188 1 2 no DBJ BAH26468 . "hypothetical regulatory protein [Mycobacterium bovis BCG str. Tokyo 172]" . . . . . 100.00 146 99.32 99.32 4.22e-97 . . . . 16188 1 3 no DBJ BAL66184 . "putative regulatory protein [Mycobacterium tuberculosis str. Erdman = ATCC 35801]" . . . . . 91.78 134 99.25 100.00 6.66e-89 . . . . 16188 1 4 no DBJ BAQ06242 . "putative regulatory protein [Mycobacterium tuberculosis str. Kurono]" . . . . . 91.78 134 99.25 100.00 6.66e-89 . . . . 16188 1 5 no EMBL CAL72178 . "conserved hypothetical regulatory protein [Mycobacterium bovis BCG str. Pasteur 1173P2]" . . . . . 100.00 146 99.32 99.32 4.22e-97 . . . . 16188 1 6 no EMBL CCC27256 . "conserved hypothetical regulatory protein [Mycobacterium africanum GM041182]" . . . . . 100.00 146 99.32 99.32 4.22e-97 . . . . 16188 1 7 no EMBL CCC44529 . "conserved hypothetical regulatory protein [Mycobacterium canettii CIPT 140010059]" . . . . . 100.00 146 100.00 100.00 1.92e-98 . . . . 16188 1 8 no EMBL CCC64767 . "conserved hypothetical regulatory protein [Mycobacterium bovis BCG str. Moreau RDJ]" . . . . . 100.00 146 99.32 99.32 4.22e-97 . . . . 16188 1 9 no EMBL CCE37647 . "unnamed protein product [Mycobacterium tuberculosis UT205]" . . . . . 100.00 146 100.00 100.00 1.92e-98 . . . . 16188 1 10 no GB AAK46516 . "conserved hypothetical protein [Mycobacterium tuberculosis CDC1551]" . . . . . 100.00 154 100.00 100.00 1.71e-98 . . . . 16188 1 11 no GB ABQ73952 . "hypothetical protein MRA_2190 [Mycobacterium tuberculosis H37Ra]" . . . . . 100.00 146 100.00 100.00 1.92e-98 . . . . 16188 1 12 no GB ABR06534 . "conserved hypothetical regulatory protein [Mycobacterium tuberculosis F11]" . . . . . 100.00 146 100.00 100.00 1.92e-98 . . . . 16188 1 13 no GB ACT24868 . "conserved hypothetical protein [Mycobacterium tuberculosis KZN 1435]" . . . . . 100.00 146 100.00 100.00 1.92e-98 . . . . 16188 1 14 no GB AEB03948 . "conserved hypothetical protein [Mycobacterium tuberculosis KZN 4207]" . . . . . 100.00 146 100.00 100.00 1.92e-98 . . . . 16188 1 15 no REF NP_216691 . "DNA-binding protein [Mycobacterium tuberculosis H37Rv]" . . . . . 100.00 146 100.00 100.00 1.92e-98 . . . . 16188 1 16 no REF NP_855846 . "regulatory protein [Mycobacterium bovis AF2122/97]" . . . . . 100.00 146 99.32 99.32 4.22e-97 . . . . 16188 1 17 no REF WP_003411249 . "MULTISPECIES: hypothetical protein [Mycobacterium]" . . . . . 91.78 134 98.51 99.25 1.03e-87 . . . . 16188 1 18 no REF WP_003900481 . "MULTISPECIES: DNA-binding protein Rv2175c [Mycobacterium tuberculosis complex]" . . . . . 100.00 146 100.00 100.00 1.92e-98 . . . . 16188 1 19 no REF WP_003910516 . "hypothetical protein [Mycobacterium bovis]" . . . . . 100.00 146 99.32 99.32 4.22e-97 . . . . 16188 1 20 no SP O53509 . "RecName: Full=DNA-binding protein Rv2175c" . . . . . 100.00 146 100.00 100.00 1.92e-98 . . . . 16188 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 . 16188 1 2 . PRO . 16188 1 3 . GLY . 16188 1 4 . ARG . 16188 1 5 . ALA . 16188 1 6 . PRO . 16188 1 7 . GLY . 16188 1 8 . SER . 16188 1 9 . THR . 16188 1 10 . LEU . 16188 1 11 . ALA . 16188 1 12 . ARG . 16188 1 13 . VAL . 16188 1 14 . GLY . 16188 1 15 . SER . 16188 1 16 . ILE . 16188 1 17 . PRO . 16188 1 18 . ALA . 16188 1 19 . GLY . 16188 1 20 . ASP . 16188 1 21 . ASP . 16188 1 22 . VAL . 16188 1 23 . LEU . 16188 1 24 . ASP . 16188 1 25 . PRO . 16188 1 26 . ASP . 16188 1 27 . GLU . 16188 1 28 . PRO . 16188 1 29 . THR . 16188 1 30 . TYR . 16188 1 31 . ASP . 16188 1 32 . LEU . 16188 1 33 . PRO . 16188 1 34 . ARG . 16188 1 35 . VAL . 16188 1 36 . ALA . 16188 1 37 . GLU . 16188 1 38 . LEU . 16188 1 39 . LEU . 16188 1 40 . GLY . 16188 1 41 . VAL . 16188 1 42 . PRO . 16188 1 43 . VAL . 16188 1 44 . SER . 16188 1 45 . LYS . 16188 1 46 . VAL . 16188 1 47 . ALA . 16188 1 48 . GLN . 16188 1 49 . GLN . 16188 1 50 . LEU . 16188 1 51 . ARG . 16188 1 52 . GLU . 16188 1 53 . GLY . 16188 1 54 . HIS . 16188 1 55 . LEU . 16188 1 56 . VAL . 16188 1 57 . ALA . 16188 1 58 . VAL . 16188 1 59 . ARG . 16188 1 60 . ARG . 16188 1 61 . ALA . 16188 1 62 . GLY . 16188 1 63 . GLY . 16188 1 64 . VAL . 16188 1 65 . VAL . 16188 1 66 . ILE . 16188 1 67 . PRO . 16188 1 68 . GLN . 16188 1 69 . VAL . 16188 1 70 . PHE . 16188 1 71 . PHE . 16188 1 72 . THR . 16188 1 73 . ASN . 16188 1 74 . SER . 16188 1 75 . GLY . 16188 1 76 . GLN . 16188 1 77 . VAL . 16188 1 78 . VAL . 16188 1 79 . LYS . 16188 1 80 . SER . 16188 1 81 . LEU . 16188 1 82 . PRO . 16188 1 83 . GLY . 16188 1 84 . LEU . 16188 1 85 . LEU . 16188 1 86 . THR . 16188 1 87 . ILE . 16188 1 88 . LEU . 16188 1 89 . HIS . 16188 1 90 . ASP . 16188 1 91 . GLY . 16188 1 92 . GLY . 16188 1 93 . TYR . 16188 1 94 . ARG . 16188 1 95 . ASP . 16188 1 96 . THR . 16188 1 97 . GLU . 16188 1 98 . ILE . 16188 1 99 . MET . 16188 1 100 . ARG . 16188 1 101 . TRP . 16188 1 102 . LEU . 16188 1 103 . PHE . 16188 1 104 . THR . 16188 1 105 . PRO . 16188 1 106 . ASP . 16188 1 107 . PRO . 16188 1 108 . SER . 16188 1 109 . LEU . 16188 1 110 . THR . 16188 1 111 . ILE . 16188 1 112 . THR . 16188 1 113 . ARG . 16188 1 114 . ASP . 16188 1 115 . GLY . 16188 1 116 . SER . 16188 1 117 . ARG . 16188 1 118 . ASP . 16188 1 119 . ALA . 16188 1 120 . VAL . 16188 1 121 . SER . 16188 1 122 . ASN . 16188 1 123 . ALA . 16188 1 124 . ARG . 16188 1 125 . PRO . 16188 1 126 . VAL . 16188 1 127 . ASP . 16188 1 128 . ALA . 16188 1 129 . LEU . 16188 1 130 . HIS . 16188 1 131 . ALA . 16188 1 132 . HIS . 16188 1 133 . GLN . 16188 1 134 . ALA . 16188 1 135 . ARG . 16188 1 136 . GLU . 16188 1 137 . VAL . 16188 1 138 . VAL . 16188 1 139 . ARG . 16188 1 140 . ARG . 16188 1 141 . ALA . 16188 1 142 . GLN . 16188 1 143 . ALA . 16188 1 144 . MET . 16188 1 145 . ALA . 16188 1 146 . TYR . 16188 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 16188 1 . PRO 2 2 16188 1 . GLY 3 3 16188 1 . ARG 4 4 16188 1 . ALA 5 5 16188 1 . PRO 6 6 16188 1 . GLY 7 7 16188 1 . SER 8 8 16188 1 . THR 9 9 16188 1 . LEU 10 10 16188 1 . ALA 11 11 16188 1 . ARG 12 12 16188 1 . VAL 13 13 16188 1 . GLY 14 14 16188 1 . SER 15 15 16188 1 . ILE 16 16 16188 1 . PRO 17 17 16188 1 . ALA 18 18 16188 1 . GLY 19 19 16188 1 . ASP 20 20 16188 1 . ASP 21 21 16188 1 . VAL 22 22 16188 1 . LEU 23 23 16188 1 . ASP 24 24 16188 1 . PRO 25 25 16188 1 . ASP 26 26 16188 1 . GLU 27 27 16188 1 . PRO 28 28 16188 1 . THR 29 29 16188 1 . TYR 30 30 16188 1 . ASP 31 31 16188 1 . LEU 32 32 16188 1 . PRO 33 33 16188 1 . ARG 34 34 16188 1 . VAL 35 35 16188 1 . ALA 36 36 16188 1 . GLU 37 37 16188 1 . LEU 38 38 16188 1 . LEU 39 39 16188 1 . GLY 40 40 16188 1 . VAL 41 41 16188 1 . PRO 42 42 16188 1 . VAL 43 43 16188 1 . SER 44 44 16188 1 . LYS 45 45 16188 1 . VAL 46 46 16188 1 . ALA 47 47 16188 1 . GLN 48 48 16188 1 . GLN 49 49 16188 1 . LEU 50 50 16188 1 . ARG 51 51 16188 1 . GLU 52 52 16188 1 . GLY 53 53 16188 1 . HIS 54 54 16188 1 . LEU 55 55 16188 1 . VAL 56 56 16188 1 . ALA 57 57 16188 1 . VAL 58 58 16188 1 . ARG 59 59 16188 1 . ARG 60 60 16188 1 . ALA 61 61 16188 1 . GLY 62 62 16188 1 . GLY 63 63 16188 1 . VAL 64 64 16188 1 . VAL 65 65 16188 1 . ILE 66 66 16188 1 . PRO 67 67 16188 1 . GLN 68 68 16188 1 . VAL 69 69 16188 1 . PHE 70 70 16188 1 . PHE 71 71 16188 1 . THR 72 72 16188 1 . ASN 73 73 16188 1 . SER 74 74 16188 1 . GLY 75 75 16188 1 . GLN 76 76 16188 1 . VAL 77 77 16188 1 . VAL 78 78 16188 1 . LYS 79 79 16188 1 . SER 80 80 16188 1 . LEU 81 81 16188 1 . PRO 82 82 16188 1 . GLY 83 83 16188 1 . LEU 84 84 16188 1 . LEU 85 85 16188 1 . THR 86 86 16188 1 . ILE 87 87 16188 1 . LEU 88 88 16188 1 . HIS 89 89 16188 1 . ASP 90 90 16188 1 . GLY 91 91 16188 1 . GLY 92 92 16188 1 . TYR 93 93 16188 1 . ARG 94 94 16188 1 . ASP 95 95 16188 1 . THR 96 96 16188 1 . GLU 97 97 16188 1 . ILE 98 98 16188 1 . MET 99 99 16188 1 . ARG 100 100 16188 1 . TRP 101 101 16188 1 . LEU 102 102 16188 1 . PHE 103 103 16188 1 . THR 104 104 16188 1 . PRO 105 105 16188 1 . ASP 106 106 16188 1 . PRO 107 107 16188 1 . SER 108 108 16188 1 . LEU 109 109 16188 1 . THR 110 110 16188 1 . ILE 111 111 16188 1 . THR 112 112 16188 1 . ARG 113 113 16188 1 . ASP 114 114 16188 1 . GLY 115 115 16188 1 . SER 116 116 16188 1 . ARG 117 117 16188 1 . ASP 118 118 16188 1 . ALA 119 119 16188 1 . VAL 120 120 16188 1 . SER 121 121 16188 1 . ASN 122 122 16188 1 . ALA 123 123 16188 1 . ARG 124 124 16188 1 . PRO 125 125 16188 1 . VAL 126 126 16188 1 . ASP 127 127 16188 1 . ALA 128 128 16188 1 . LEU 129 129 16188 1 . HIS 130 130 16188 1 . ALA 131 131 16188 1 . HIS 132 132 16188 1 . GLN 133 133 16188 1 . ALA 134 134 16188 1 . ARG 135 135 16188 1 . GLU 136 136 16188 1 . VAL 137 137 16188 1 . VAL 138 138 16188 1 . ARG 139 139 16188 1 . ARG 140 140 16188 1 . ALA 141 141 16188 1 . GLN 142 142 16188 1 . ALA 143 143 16188 1 . MET 144 144 16188 1 . ALA 145 145 16188 1 . TYR 146 146 16188 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 16188 _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 $Rv2175c . 83332 organism . 'Mycobacterium tuberculosis' 'Mycobacterium tuberculosis' . . Bacteria . Mycobacterium tuberculosis H37rv . . . . . . . . . . . . . . . rv2175c . . . . 16188 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 16188 _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 $Rv2175c . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . . . . . . . . . . . . . . pET15b-TEV . . . . . . 16188 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 16188 _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 Rv2175c [U-15N] . . 1 $Rv2175c . . 300 . . mM 15 . . . 16188 1 2 'sodium acetate' 'natural abundance' . . . . . . 10 . . mM 0.5 . . . 16188 1 3 'sodium chloride' 'natural abundance' . . . . . . 150 . . mM 7.5 . . . 16188 1 4 D2O 'natural abundance' . . . . . . 5 . . % . . . . 16188 1 5 H2O 'natural abundance' . . . . . . 95 . . % . . . . 16188 1 stop_ save_ save_sample_2 _Sample.Sf_category sample _Sample.Sf_framecode sample_2 _Sample.Entry_ID 16188 _Sample.ID 2 _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 Rv2175c '[U-13C; U-15N]' . . 1 $Rv2175c . . 300 . . mM 15 . . . 16188 2 2 'sodium acetate' 'natural abundance' . . . . . . 10 . . mM 0.5 . . . 16188 2 3 'sodium chloride' 'natural abundance' . . . . . . 150 . . mM 7.5 . . . 16188 2 4 D2O 'natural abundance' . . . . . . 5 . . % . . . . 16188 2 5 H2O 'natural abundance' . . . . . . 95 . . % . . . . 16188 2 stop_ save_ save_sample_3 _Sample.Sf_category sample _Sample.Sf_framecode sample_3 _Sample.Entry_ID 16188 _Sample.ID 3 _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 Rv2175c 'natural abundance' . . 1 $Rv2175c . . 300 . . mM 15 . . . 16188 3 2 'sodium acetate' 'natural abundance' . . . . . . 10 . . mM 0.5 . . . 16188 3 3 'sodium chloride' 'natural abundance' . . . . . . 150 . . mM 7.5 . . . 16188 3 4 D2O 'natural abundance' . . . . . . 100 . . % . . . . 16188 3 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 16188 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 0.15 0.0075 M 16188 1 pH 4.6 0.1 pH 16188 1 pressure 1 . atm 16188 1 temperature 303 0.1 K 16188 1 stop_ save_ ############################ # Computer software used # ############################ save_GIFA _Software.Sf_category software _Software.Sf_framecode GIFA _Software.Entry_ID 16188 _Software.ID 1 _Software.Name GIFA _Software.Version 4.44 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Delsuc . . 16188 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 16188 1 stop_ save_ save_CINDY _Software.Sf_category software _Software.Sf_framecode CINDY _Software.Entry_ID 16188 _Software.ID 2 _Software.Name CINDY _Software.Version 1.7a _Software.Details 'in-house software' loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Padilla ; CBS, 29 rue de Navacelles F-34090 Montpellier FRANCE ; andre.padilla@cbs.cnrs.fr 16188 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 16188 2 stop_ save_ save_CYANA _Software.Sf_category software _Software.Sf_framecode CYANA _Software.Entry_ID 16188 _Software.ID 3 _Software.Name CYANA _Software.Version 2.1 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Guntert, Mumenthaler and Wuthrich' . . 16188 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'structure solution' 16188 3 stop_ save_ save_CNS _Software.Sf_category software _Software.Sf_framecode CNS _Software.Entry_ID 16188 _Software.ID 4 _Software.Name CNS _Software.Version 1.2 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Brunger, Adams, Clore, Gros, Nilges and Read' . . 16188 4 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID refinement 16188 4 stop_ save_ save_Procheck _Software.Sf_category software _Software.Sf_framecode Procheck _Software.Entry_ID 16188 _Software.ID 5 _Software.Name Procheck _Software.Version 3.5.4 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Laskowski, MacArthur, Smith, Jones, Hutchinson, Morris, Moss and Tho' . . 16188 5 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 16188 5 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_1 _NMR_spectrometer.Entry_ID 16188 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _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 16188 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 Bruker Avance . 600 . . . 16188 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 16188 _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-15N NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 16188 1 2 '3D 1H-15N TOCSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 16188 1 3 '2D 1H-1H NOESY' no . . . . . . . . . . 3 $sample_3 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 16188 1 4 '3D HNCA' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 16188 1 5 '3D CBCA(CO)NH' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 16188 1 6 '3D HNCO' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 16188 1 7 '3D HCACO' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 16188 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 16188 _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 . . . . . . . . . 16188 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . . . . . 16188 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 . indirect 0.101329118 . . . . . . . . . 16188 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 16188 _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 0.001 _Assigned_chem_shift_list.Chem_shift_13C_err 0.001 _Assigned_chem_shift_list.Chem_shift_15N_err 0.001 _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '3D 1H-15N NOESY' . . . 16188 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 $GIFA . . 16188 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 H H 1 8.663 0.001 . 1 . . . . 1 MET H . 16188 1 2 . 1 1 1 1 MET HA H 1 4.916 0.001 . 1 . . . . 1 MET HA . 16188 1 3 . 1 1 1 1 MET HB2 H 1 2.181 0.001 . 2 . . . . 1 MET HB2 . 16188 1 4 . 1 1 1 1 MET HB3 H 1 2.061 0.001 . 2 . . . . 1 MET HB3 . 16188 1 5 . 1 1 1 1 MET HE1 H 1 2.071 0.001 . 1 . . . . 1 MET QE . 16188 1 6 . 1 1 1 1 MET HE2 H 1 2.071 0.001 . 1 . . . . 1 MET QE . 16188 1 7 . 1 1 1 1 MET HE3 H 1 2.071 0.001 . 1 . . . . 1 MET QE . 16188 1 8 . 1 1 1 1 MET HG2 H 1 2.721 0.001 . 2 . . . . 1 MET HG2 . 16188 1 9 . 1 1 1 1 MET HG3 H 1 2.661 0.001 . 2 . . . . 1 MET HG3 . 16188 1 10 . 1 1 1 1 MET CA C 13 53.601 0.001 . 1 . . . . 1 MET CA . 16188 1 11 . 1 1 1 1 MET N N 15 124.111 0.001 . 1 . . . . 1 MET N . 16188 1 12 . 1 1 2 2 PRO HA H 1 4.561 0.001 . 1 . . . . 2 PRO HA . 16188 1 13 . 1 1 2 2 PRO HD2 H 1 3.897 0.001 . 2 . . . . 2 PRO HD2 . 16188 1 14 . 1 1 2 2 PRO HD3 H 1 3.797 0.001 . 2 . . . . 2 PRO HD3 . 16188 1 15 . 1 1 2 2 PRO C C 13 177.451 0.001 . 1 . . . . 2 PRO C . 16188 1 16 . 1 1 2 2 PRO CA C 13 63.621 0.001 . 1 . . . . 2 PRO CA . 16188 1 17 . 1 1 2 2 PRO CB C 13 32.431 0.001 . 1 . . . . 2 PRO CB . 16188 1 18 . 1 1 3 3 GLY H H 1 8.523 0.001 . 1 . . . . 3 GLY H . 16188 1 19 . 1 1 3 3 GLY HA2 H 1 4.067 0.001 . 2 . . . . 3 GLY HA2 . 16188 1 20 . 1 1 3 3 GLY HA3 H 1 4.067 0.001 . 2 . . . . 3 GLY HA3 . 16188 1 21 . 1 1 3 3 GLY CA C 13 45.271 0.001 . 1 . . . . 3 GLY CA . 16188 1 22 . 1 1 3 3 GLY N N 15 109.381 0.001 . 1 . . . . 3 GLY N . 16188 1 23 . 1 1 4 4 ARG H H 1 8.196 0.001 . 1 . . . . 4 ARG H . 16188 1 24 . 1 1 4 4 ARG HA H 1 4.486 0.001 . 1 . . . . 4 ARG HA . 16188 1 25 . 1 1 4 4 ARG HB2 H 1 1.941 0.001 . 2 . . . . 4 ARG HB2 . 16188 1 26 . 1 1 4 4 ARG HB3 H 1 1.841 0.001 . 2 . . . . 4 ARG HB3 . 16188 1 27 . 1 1 4 4 ARG HD2 H 1 3.151 0.001 . 2 . . . . 4 ARG QD . 16188 1 28 . 1 1 4 4 ARG HD3 H 1 3.151 0.001 . 2 . . . . 4 ARG QD . 16188 1 29 . 1 1 4 4 ARG HG2 H 1 1.841 0.001 . 2 . . . . 4 ARG HG2 . 16188 1 30 . 1 1 4 4 ARG HG3 H 1 1.721 0.001 . 2 . . . . 4 ARG HG3 . 16188 1 31 . 1 1 4 4 ARG C C 13 175.881 0.001 . 1 . . . . 4 ARG C . 16188 1 32 . 1 1 4 4 ARG CA C 13 63.261 0.001 . 1 . . . . 4 ARG CA . 16188 1 33 . 1 1 4 4 ARG CB C 13 31.441 0.001 . 1 . . . . 4 ARG CB . 16188 1 34 . 1 1 4 4 ARG N N 15 120.571 0.001 . 1 . . . . 4 ARG N . 16188 1 35 . 1 1 5 5 ALA H H 1 8.511 0.001 . 1 . . . . 5 ALA H . 16188 1 36 . 1 1 5 5 ALA HA H 1 4.691 0.001 . 1 . . . . 5 ALA HA . 16188 1 37 . 1 1 5 5 ALA HB1 H 1 1.486 0.001 . 1 . . . . 5 ALA QB . 16188 1 38 . 1 1 5 5 ALA HB2 H 1 1.486 0.001 . 1 . . . . 5 ALA QB . 16188 1 39 . 1 1 5 5 ALA HB3 H 1 1.486 0.001 . 1 . . . . 5 ALA QB . 16188 1 40 . 1 1 5 5 ALA CA C 13 50.721 0.001 . 1 . . . . 5 ALA CA . 16188 1 41 . 1 1 5 5 ALA N N 15 127.261 0.001 . 1 . . . . 5 ALA N . 16188 1 42 . 1 1 6 6 PRO HA H 1 4.542 0.001 . 1 . . . . 6 PRO HA . 16188 1 43 . 1 1 6 6 PRO HB2 H 1 2.432 0.001 . 2 . . . . 6 PRO HB2 . 16188 1 44 . 1 1 6 6 PRO HB3 H 1 2.191 0.001 . 2 . . . . 6 PRO HB3 . 16188 1 45 . 1 1 6 6 PRO HD2 H 1 3.901 0.001 . 2 . . . . 6 PRO HD2 . 16188 1 46 . 1 1 6 6 PRO HD3 H 1 3.770 0.001 . 2 . . . . 6 PRO HD3 . 16188 1 47 . 1 1 6 6 PRO HG2 H 1 2.077 0.001 . 2 . . . . 6 PRO HG2 . 16188 1 48 . 1 1 6 6 PRO HG3 H 1 2.077 0.001 . 2 . . . . 6 PRO HG3 . 16188 1 49 . 1 1 6 6 PRO C C 13 177.791 0.001 . 1 . . . . 6 PRO C . 16188 1 50 . 1 1 6 6 PRO CA C 13 63.771 0.001 . 1 . . . . 6 PRO CA . 16188 1 51 . 1 1 6 6 PRO CB C 13 32.431 0.001 . 1 . . . . 6 PRO CB . 16188 1 52 . 1 1 7 7 GLY H H 1 8.582 0.001 . 1 . . . . 7 GLY H . 16188 1 53 . 1 1 7 7 GLY HA2 H 1 4.103 0.001 . 2 . . . . 7 GLY HA2 . 16188 1 54 . 1 1 7 7 GLY HA3 H 1 4.103 0.001 . 2 . . . . 7 GLY HA3 . 16188 1 55 . 1 1 7 7 GLY C C 13 174.511 0.001 . 1 . . . . 7 GLY C . 16188 1 56 . 1 1 7 7 GLY CA C 13 45.511 0.001 . 1 . . . . 7 GLY CA . 16188 1 57 . 1 1 7 7 GLY N N 15 109.381 0.001 . 1 . . . . 7 GLY N . 16188 1 58 . 1 1 8 8 SER H H 1 8.254 0.001 . 1 . . . . 8 SER H . 16188 1 59 . 1 1 8 8 SER HA H 1 4.637 0.001 . 1 . . . . 8 SER HA . 16188 1 60 . 1 1 8 8 SER HB2 H 1 4.084 0.001 . 2 . . . . 8 SER HB2 . 16188 1 61 . 1 1 8 8 SER HB3 H 1 4.084 0.001 . 2 . . . . 8 SER HB3 . 16188 1 62 . 1 1 8 8 SER C C 13 175.241 0.001 . 1 . . . . 8 SER C . 16188 1 63 . 1 1 8 8 SER CA C 13 58.691 0.001 . 1 . . . . 8 SER CA . 16188 1 64 . 1 1 8 8 SER CB C 13 64.361 0.001 . 1 . . . . 8 SER CB . 16188 1 65 . 1 1 8 8 SER N N 15 115.531 0.001 . 1 . . . . 8 SER N . 16188 1 66 . 1 1 9 9 THR H H 1 8.319 0.001 . 1 . . . . 9 THR H . 16188 1 67 . 1 1 9 9 THR HA H 1 4.445 0.001 . 1 . . . . 9 THR HA . 16188 1 68 . 1 1 9 9 THR HB H 1 4.375 0.001 . 1 . . . . 9 THR HB . 16188 1 69 . 1 1 9 9 THR HG21 H 1 1.333 0.001 . 1 . . . . 9 THR QG2 . 16188 1 70 . 1 1 9 9 THR HG22 H 1 1.333 0.001 . 1 . . . . 9 THR QG2 . 16188 1 71 . 1 1 9 9 THR HG23 H 1 1.333 0.001 . 1 . . . . 9 THR QG2 . 16188 1 72 . 1 1 9 9 THR C C 13 174.791 0.001 . 1 . . . . 9 THR C . 16188 1 73 . 1 1 9 9 THR CA C 13 62.581 0.001 . 1 . . . . 9 THR CA . 16188 1 74 . 1 1 9 9 THR CB C 13 69.861 0.001 . 1 . . . . 9 THR CB . 16188 1 75 . 1 1 9 9 THR N N 15 116.361 0.001 . 1 . . . . 9 THR N . 16188 1 76 . 1 1 10 10 LEU H H 1 8.237 0.001 . 1 . . . . 10 LEU H . 16188 1 77 . 1 1 10 10 LEU HA H 1 4.426 0.001 . 1 . . . . 10 LEU HA . 16188 1 78 . 1 1 10 10 LEU HB2 H 1 1.732 0.001 . 2 . . . . 10 LEU HB2 . 16188 1 79 . 1 1 10 10 LEU HB3 H 1 1.732 0.001 . 2 . . . . 10 LEU HB3 . 16188 1 80 . 1 1 10 10 LEU HD11 H 1 1.038 0.001 . 2 . . . . 10 LEU QD1 . 16188 1 81 . 1 1 10 10 LEU HD12 H 1 1.038 0.001 . 2 . . . . 10 LEU QD1 . 16188 1 82 . 1 1 10 10 LEU HD13 H 1 1.038 0.001 . 2 . . . . 10 LEU QD1 . 16188 1 83 . 1 1 10 10 LEU HD21 H 1 0.985 0.001 . 2 . . . . 10 LEU QD2 . 16188 1 84 . 1 1 10 10 LEU HD22 H 1 0.985 0.001 . 2 . . . . 10 LEU QD2 . 16188 1 85 . 1 1 10 10 LEU HD23 H 1 0.985 0.001 . 2 . . . . 10 LEU QD2 . 16188 1 86 . 1 1 10 10 LEU HG H 1 1.493 0.001 . 1 . . . . 10 LEU HG . 16188 1 87 . 1 1 10 10 LEU C C 13 177.211 0.001 . 1 . . . . 10 LEU C . 16188 1 88 . 1 1 10 10 LEU CA C 13 55.501 0.001 . 1 . . . . 10 LEU CA . 16188 1 89 . 1 1 10 10 LEU CB C 13 42.351 0.001 . 1 . . . . 10 LEU CB . 16188 1 90 . 1 1 10 10 LEU N N 15 124.111 0.001 . 1 . . . . 10 LEU N . 16188 1 91 . 1 1 11 11 ALA H H 1 8.231 0.001 . 1 . . . . 11 ALA H . 16188 1 92 . 1 1 11 11 ALA HA H 1 4.392 0.001 . 1 . . . . 11 ALA HA . 16188 1 93 . 1 1 11 11 ALA HB1 H 1 1.498 0.001 . 1 . . . . 11 ALA QB . 16188 1 94 . 1 1 11 11 ALA HB2 H 1 1.498 0.001 . 1 . . . . 11 ALA QB . 16188 1 95 . 1 1 11 11 ALA HB3 H 1 1.498 0.001 . 1 . . . . 11 ALA QB . 16188 1 96 . 1 1 11 11 ALA C C 13 177.751 0.001 . 1 . . . . 11 ALA C . 16188 1 97 . 1 1 11 11 ALA CA C 13 52.851 0.001 . 1 . . . . 11 ALA CA . 16188 1 98 . 1 1 11 11 ALA CB C 13 19.621 0.001 . 1 . . . . 11 ALA CB . 16188 1 99 . 1 1 11 11 ALA N N 15 124.541 0.001 . 1 . . . . 11 ALA N . 16188 1 100 . 1 1 12 12 ARG H H 1 8.278 0.001 . 1 . . . . 12 ARG H . 16188 1 101 . 1 1 12 12 ARG HA H 1 4.469 0.001 . 1 . . . . 12 ARG HA . 16188 1 102 . 1 1 12 12 ARG HB2 H 1 1.992 0.001 . 2 . . . . 12 ARG HB2 . 16188 1 103 . 1 1 12 12 ARG HB3 H 1 1.901 0.001 . 2 . . . . 12 ARG HB3 . 16188 1 104 . 1 1 12 12 ARG HD2 H 1 3.317 0.001 . 2 . . . . 12 ARG QD . 16188 1 105 . 1 1 12 12 ARG HD3 H 1 3.317 0.001 . 2 . . . . 12 ARG QD . 16188 1 106 . 1 1 12 12 ARG HG2 H 1 1.901 0.001 . 2 . . . . 12 ARG HG2 . 16188 1 107 . 1 1 12 12 ARG HG3 H 1 1.750 0.001 . 2 . . . . 12 ARG HG3 . 16188 1 108 . 1 1 12 12 ARG C C 13 173.881 0.001 . 1 . . . . 12 ARG C . 16188 1 109 . 1 1 12 12 ARG CA C 13 56.301 0.001 . 1 . . . . 12 ARG CA . 16188 1 110 . 1 1 12 12 ARG CB C 13 30.811 0.001 . 1 . . . . 12 ARG CB . 16188 1 111 . 1 1 12 12 ARG N N 15 119.701 0.001 . 1 . . . . 12 ARG N . 16188 1 112 . 1 1 13 13 VAL H H 1 8.171 0.001 . 1 . . . . 13 VAL H . 16188 1 113 . 1 1 13 13 VAL HA H 1 4.167 0.001 . 1 . . . . 13 VAL HA . 16188 1 114 . 1 1 13 13 VAL HB H 1 2.220 0.001 . 1 . . . . 13 VAL HB . 16188 1 115 . 1 1 13 13 VAL HG11 H 1 1.048 0.001 . 2 . . . . 13 VAL QG1 . 16188 1 116 . 1 1 13 13 VAL HG12 H 1 1.048 0.001 . 2 . . . . 13 VAL QG1 . 16188 1 117 . 1 1 13 13 VAL HG13 H 1 1.048 0.001 . 2 . . . . 13 VAL QG1 . 16188 1 118 . 1 1 13 13 VAL HG21 H 1 1.048 0.001 . 2 . . . . 13 VAL QG2 . 16188 1 119 . 1 1 13 13 VAL HG22 H 1 1.048 0.001 . 2 . . . . 13 VAL QG2 . 16188 1 120 . 1 1 13 13 VAL HG23 H 1 1.048 0.001 . 2 . . . . 13 VAL QG2 . 16188 1 121 . 1 1 13 13 VAL C C 13 176.631 0.001 . 1 . . . . 13 VAL C . 16188 1 122 . 1 1 13 13 VAL CA C 13 63.241 0.001 . 1 . . . . 13 VAL CA . 16188 1 123 . 1 1 13 13 VAL CB C 13 32.701 0.001 . 1 . . . . 13 VAL CB . 16188 1 124 . 1 1 13 13 VAL N N 15 120.371 0.001 . 1 . . . . 13 VAL N . 16188 1 125 . 1 1 14 14 GLY H H 1 8.435 0.001 . 1 . . . . 14 GLY H . 16188 1 126 . 1 1 14 14 GLY HA2 H 1 4.028 0.001 . 2 . . . . 14 GLY HA2 . 16188 1 127 . 1 1 14 14 GLY HA3 H 1 4.140 0.001 . 2 . . . . 14 GLY HA3 . 16188 1 128 . 1 1 14 14 GLY C C 13 173.991 0.001 . 1 . . . . 14 GLY C . 16188 1 129 . 1 1 14 14 GLY CA C 13 45.071 0.001 . 1 . . . . 14 GLY CA . 16188 1 130 . 1 1 14 14 GLY N N 15 111.371 0.001 . 1 . . . . 14 GLY N . 16188 1 131 . 1 1 15 15 SER H H 1 8.278 0.001 . 1 . . . . 15 SER H . 16188 1 132 . 1 1 15 15 SER HA H 1 4.508 0.001 . 1 . . . . 15 SER HA . 16188 1 133 . 1 1 15 15 SER HB2 H 1 3.964 0.001 . 2 . . . . 15 SER HB2 . 16188 1 134 . 1 1 15 15 SER HB3 H 1 3.964 0.001 . 2 . . . . 15 SER HB3 . 16188 1 135 . 1 1 15 15 SER C C 13 174.361 0.001 . 1 . . . . 15 SER C . 16188 1 136 . 1 1 15 15 SER CA C 13 58.731 0.001 . 1 . . . . 15 SER CA . 16188 1 137 . 1 1 15 15 SER CB C 13 64.271 0.001 . 1 . . . . 15 SER CB . 16188 1 138 . 1 1 15 15 SER N N 15 115.731 0.001 . 1 . . . . 15 SER N . 16188 1 139 . 1 1 16 16 ILE H H 1 8.272 0.001 . 1 . . . . 16 ILE H . 16188 1 140 . 1 1 16 16 ILE HA H 1 4.527 0.001 . 1 . . . . 16 ILE HA . 16188 1 141 . 1 1 16 16 ILE HB H 1 1.893 0.001 . 1 . . . . 16 ILE HB . 16188 1 142 . 1 1 16 16 ILE HD11 H 1 0.922 0.001 . 4 . . . . 16 ILE QD1 . 16188 1 143 . 1 1 16 16 ILE HD12 H 1 0.922 0.001 . 4 . . . . 16 ILE QD1 . 16188 1 144 . 1 1 16 16 ILE HD13 H 1 0.922 0.001 . 4 . . . . 16 ILE QD1 . 16188 1 145 . 1 1 16 16 ILE HG12 H 1 1.749 0.001 . 2 . . . . 16 ILE HG12 . 16188 1 146 . 1 1 16 16 ILE HG13 H 1 1.749 0.001 . 2 . . . . 16 ILE HG13 . 16188 1 147 . 1 1 16 16 ILE HG21 H 1 1.042 0.001 . 4 . . . . 16 ILE QG2 . 16188 1 148 . 1 1 16 16 ILE HG22 H 1 1.042 0.001 . 4 . . . . 16 ILE QG2 . 16188 1 149 . 1 1 16 16 ILE HG23 H 1 1.042 0.001 . 4 . . . . 16 ILE QG2 . 16188 1 150 . 1 1 16 16 ILE CA C 13 58.791 0.001 . 1 . . . . 16 ILE CA . 16188 1 151 . 1 1 16 16 ILE N N 15 123.531 0.001 . 1 . . . . 16 ILE N . 16188 1 152 . 1 1 17 17 PRO HA H 1 4.582 0.001 . 1 . . . . 17 PRO HA . 16188 1 153 . 1 1 17 17 PRO HB2 H 1 2.345 0.001 . 2 . . . . 17 PRO HB2 . 16188 1 154 . 1 1 17 17 PRO HB3 H 1 2.108 0.001 . 2 . . . . 17 PRO HB3 . 16188 1 155 . 1 1 17 17 PRO HD2 H 1 3.574 0.001 . 2 . . . . 17 PRO HD2 . 16188 1 156 . 1 1 17 17 PRO HD3 H 1 3.574 0.001 . 2 . . . . 17 PRO HD3 . 16188 1 157 . 1 1 17 17 PRO HG2 H 1 2.345 0.001 . 2 . . . . 17 PRO HG2 . 16188 1 158 . 1 1 17 17 PRO HG3 H 1 2.108 0.001 . 2 . . . . 17 PRO HG3 . 16188 1 159 . 1 1 17 17 PRO C C 13 175.731 0.001 . 1 . . . . 17 PRO C . 16188 1 160 . 1 1 17 17 PRO CA C 13 63.201 0.001 . 1 . . . . 17 PRO CA . 16188 1 161 . 1 1 17 17 PRO CB C 13 32.521 0.001 . 1 . . . . 17 PRO CB . 16188 1 162 . 1 1 18 18 ALA H H 1 7.974 0.001 . 1 . . . . 18 ALA H . 16188 1 163 . 1 1 18 18 ALA HA H 1 4.759 0.001 . 1 . . . . 18 ALA HA . 16188 1 164 . 1 1 18 18 ALA HB1 H 1 1.316 0.001 . 1 . . . . 18 ALA QB . 16188 1 165 . 1 1 18 18 ALA HB2 H 1 1.316 0.001 . 1 . . . . 18 ALA QB . 16188 1 166 . 1 1 18 18 ALA HB3 H 1 1.316 0.001 . 1 . . . . 18 ALA QB . 16188 1 167 . 1 1 18 18 ALA C C 13 177.281 0.001 . 1 . . . . 18 ALA C . 16188 1 168 . 1 1 18 18 ALA CA C 13 51.831 0.001 . 1 . . . . 18 ALA CA . 16188 1 169 . 1 1 18 18 ALA CB C 13 22.241 0.001 . 1 . . . . 18 ALA CB . 16188 1 170 . 1 1 18 18 ALA N N 15 121.541 0.001 . 1 . . . . 18 ALA N . 16188 1 171 . 1 1 19 19 GLY H H 1 8.903 0.001 . 1 . . . . 19 GLY H . 16188 1 172 . 1 1 19 19 GLY HA2 H 1 3.593 0.001 . 2 . . . . 19 GLY HA2 . 16188 1 173 . 1 1 19 19 GLY HA3 H 1 4.600 0.001 . 2 . . . . 19 GLY HA3 . 16188 1 174 . 1 1 19 19 GLY C C 13 172.641 0.001 . 1 . . . . 19 GLY C . 16188 1 175 . 1 1 19 19 GLY CA C 13 44.181 0.001 . 1 . . . . 19 GLY CA . 16188 1 176 . 1 1 19 19 GLY N N 15 108.801 0.001 . 1 . . . . 19 GLY N . 16188 1 177 . 1 1 20 20 ASP H H 1 8.435 0.001 . 1 . . . . 20 ASP H . 16188 1 178 . 1 1 20 20 ASP HA H 1 4.746 0.001 . 1 . . . . 20 ASP HA . 16188 1 179 . 1 1 20 20 ASP HB2 H 1 2.618 0.001 . 2 . . . . 20 ASP HB2 . 16188 1 180 . 1 1 20 20 ASP HB3 H 1 2.764 0.001 . 2 . . . . 20 ASP HB3 . 16188 1 181 . 1 1 20 20 ASP C C 13 175.901 0.001 . 1 . . . . 20 ASP C . 16188 1 182 . 1 1 20 20 ASP CA C 13 54.661 0.001 . 1 . . . . 20 ASP CA . 16188 1 183 . 1 1 20 20 ASP CB C 13 41.181 0.001 . 1 . . . . 20 ASP CB . 16188 1 184 . 1 1 20 20 ASP N N 15 119.021 0.001 . 1 . . . . 20 ASP N . 16188 1 185 . 1 1 21 21 ASP H H 1 8.599 0.001 . 1 . . . . 21 ASP H . 16188 1 186 . 1 1 21 21 ASP HA H 1 4.500 0.001 . 1 . . . . 21 ASP HA . 16188 1 187 . 1 1 21 21 ASP HB2 H 1 2.595 0.001 . 2 . . . . 21 ASP HB2 . 16188 1 188 . 1 1 21 21 ASP HB3 H 1 3.078 0.001 . 2 . . . . 21 ASP HB3 . 16188 1 189 . 1 1 21 21 ASP C C 13 176.741 0.001 . 1 . . . . 21 ASP C . 16188 1 190 . 1 1 21 21 ASP CA C 13 54.621 0.001 . 1 . . . . 21 ASP CA . 16188 1 191 . 1 1 21 21 ASP CB C 13 38.831 0.001 . 1 . . . . 21 ASP CB . 16188 1 192 . 1 1 21 21 ASP N N 15 117.041 0.001 . 1 . . . . 21 ASP N . 16188 1 193 . 1 1 22 22 VAL H H 1 7.454 0.001 . 1 . . . . 22 VAL H . 16188 1 194 . 1 1 22 22 VAL HA H 1 4.503 0.001 . 1 . . . . 22 VAL HA . 16188 1 195 . 1 1 22 22 VAL HB H 1 2.586 0.001 . 1 . . . . 22 VAL HB . 16188 1 196 . 1 1 22 22 VAL HG11 H 1 0.983 0.001 . 2 . . . . 22 VAL QG1 . 16188 1 197 . 1 1 22 22 VAL HG12 H 1 0.983 0.001 . 2 . . . . 22 VAL QG1 . 16188 1 198 . 1 1 22 22 VAL HG13 H 1 0.983 0.001 . 2 . . . . 22 VAL QG1 . 16188 1 199 . 1 1 22 22 VAL HG21 H 1 0.851 0.001 . 2 . . . . 22 VAL QG2 . 16188 1 200 . 1 1 22 22 VAL HG22 H 1 0.851 0.001 . 2 . . . . 22 VAL QG2 . 16188 1 201 . 1 1 22 22 VAL HG23 H 1 0.851 0.001 . 2 . . . . 22 VAL QG2 . 16188 1 202 . 1 1 22 22 VAL C C 13 175.411 0.001 . 1 . . . . 22 VAL C . 16188 1 203 . 1 1 22 22 VAL CA C 13 60.101 0.001 . 1 . . . . 22 VAL CA . 16188 1 204 . 1 1 22 22 VAL CB C 13 31.171 0.001 . 1 . . . . 22 VAL CB . 16188 1 205 . 1 1 22 22 VAL N N 15 118.831 0.001 . 1 . . . . 22 VAL N . 16188 1 206 . 1 1 23 23 LEU H H 1 7.565 0.001 . 1 . . . . 23 LEU H . 16188 1 207 . 1 1 23 23 LEU HA H 1 4.208 0.001 . 1 . . . . 23 LEU HA . 16188 1 208 . 1 1 23 23 LEU HB2 H 1 1.548 0.001 . 2 . . . . 23 LEU HB2 . 16188 1 209 . 1 1 23 23 LEU HB3 H 1 1.202 0.001 . 2 . . . . 23 LEU HB3 . 16188 1 210 . 1 1 23 23 LEU HD11 H 1 0.322 0.001 . 2 . . . . 23 LEU QD1 . 16188 1 211 . 1 1 23 23 LEU HD12 H 1 0.322 0.001 . 2 . . . . 23 LEU QD1 . 16188 1 212 . 1 1 23 23 LEU HD13 H 1 0.322 0.001 . 2 . . . . 23 LEU QD1 . 16188 1 213 . 1 1 23 23 LEU HD21 H 1 -0.079 0.001 . 2 . . . . 23 LEU QD2 . 16188 1 214 . 1 1 23 23 LEU HD22 H 1 -0.079 0.001 . 2 . . . . 23 LEU QD2 . 16188 1 215 . 1 1 23 23 LEU HD23 H 1 -0.079 0.001 . 2 . . . . 23 LEU QD2 . 16188 1 216 . 1 1 23 23 LEU HG H 1 1.329 0.001 . 1 . . . . 23 LEU HG . 16188 1 217 . 1 1 23 23 LEU C C 13 176.871 0.001 . 1 . . . . 23 LEU C . 16188 1 218 . 1 1 23 23 LEU CA C 13 53.201 0.001 . 1 . . . . 23 LEU CA . 16188 1 219 . 1 1 23 23 LEU CB C 13 42.441 0.001 . 1 . . . . 23 LEU CB . 16188 1 220 . 1 1 23 23 LEU N N 15 120.571 0.001 . 1 . . . . 23 LEU N . 16188 1 221 . 1 1 24 24 ASP H H 1 9.505 0.001 . 1 . . . . 24 ASP H . 16188 1 222 . 1 1 24 24 ASP HA H 1 4.746 0.001 . 1 . . . . 24 ASP HA . 16188 1 223 . 1 1 24 24 ASP HB2 H 1 2.823 0.001 . 2 . . . . 24 ASP HB2 . 16188 1 224 . 1 1 24 24 ASP HB3 H 1 2.823 0.001 . 2 . . . . 24 ASP HB3 . 16188 1 225 . 1 1 24 24 ASP CA C 13 53.251 0.001 . 1 . . . . 24 ASP CA . 16188 1 226 . 1 1 24 24 ASP N N 15 124.791 0.001 . 1 . . . . 24 ASP N . 16188 1 227 . 1 1 25 25 PRO HA H 1 4.069 0.001 . 1 . . . . 25 PRO HA . 16188 1 228 . 1 1 25 25 PRO HB2 H 1 2.428 0.001 . 2 . . . . 25 PRO HB2 . 16188 1 229 . 1 1 25 25 PRO HB3 H 1 1.967 0.001 . 2 . . . . 25 PRO HB3 . 16188 1 230 . 1 1 25 25 PRO HD2 H 1 3.891 0.001 . 2 . . . . 25 PRO HD2 . 16188 1 231 . 1 1 25 25 PRO HD3 H 1 3.891 0.001 . 2 . . . . 25 PRO HD3 . 16188 1 232 . 1 1 25 25 PRO HG2 H 1 2.295 0.001 . 2 . . . . 25 PRO HG2 . 16188 1 233 . 1 1 25 25 PRO HG3 H 1 2.295 0.001 . 2 . . . . 25 PRO HG3 . 16188 1 234 . 1 1 25 25 PRO C C 13 176.871 0.001 . 1 . . . . 25 PRO C . 16188 1 235 . 1 1 25 25 PRO CA C 13 65.411 0.001 . 1 . . . . 25 PRO CA . 16188 1 236 . 1 1 25 25 PRO CB C 13 32.251 0.001 . 1 . . . . 25 PRO CB . 16188 1 237 . 1 1 26 26 ASP H H 1 8.549 0.001 . 1 . . . . 26 ASP H . 16188 1 238 . 1 1 26 26 ASP HA H 1 4.723 0.001 . 1 . . . . 26 ASP HA . 16188 1 239 . 1 1 26 26 ASP HB2 H 1 2.710 0.001 . 2 . . . . 26 ASP HB2 . 16188 1 240 . 1 1 26 26 ASP HB3 H 1 2.840 0.001 . 2 . . . . 26 ASP HB3 . 16188 1 241 . 1 1 26 26 ASP C C 13 176.381 0.001 . 1 . . . . 26 ASP C . 16188 1 242 . 1 1 26 26 ASP CA C 13 53.291 0.001 . 1 . . . . 26 ASP CA . 16188 1 243 . 1 1 26 26 ASP CB C 13 40.191 0.001 . 1 . . . . 26 ASP CB . 16188 1 244 . 1 1 26 26 ASP N N 15 113.921 0.001 . 1 . . . . 26 ASP N . 16188 1 245 . 1 1 27 27 GLU H H 1 7.980 0.001 . 1 . . . . 27 GLU H . 16188 1 246 . 1 1 27 27 GLU HA H 1 4.316 0.001 . 1 . . . . 27 GLU HA . 16188 1 247 . 1 1 27 27 GLU HB2 H 1 1.928 0.001 . 2 . . . . 27 GLU HB2 . 16188 1 248 . 1 1 27 27 GLU HB3 H 1 2.042 0.001 . 2 . . . . 27 GLU HB3 . 16188 1 249 . 1 1 27 27 GLU HG2 H 1 2.311 0.001 . 2 . . . . 27 GLU HG2 . 16188 1 250 . 1 1 27 27 GLU HG3 H 1 2.311 0.001 . 2 . . . . 27 GLU HG3 . 16188 1 251 . 1 1 27 27 GLU CA C 13 54.621 0.001 . 1 . . . . 27 GLU CA . 16188 1 252 . 1 1 27 27 GLU N N 15 125.321 0.001 . 1 . . . . 27 GLU N . 16188 1 253 . 1 1 28 28 PRO HD2 H 1 3.894 0.001 . 2 . . . . 28 PRO HD2 . 16188 1 254 . 1 1 28 28 PRO HD3 H 1 3.698 0.001 . 2 . . . . 28 PRO HD3 . 16188 1 255 . 1 1 29 29 THR HA H 1 3.934 0.001 . 1 . . . . 29 THR HA . 16188 1 256 . 1 1 29 29 THR HB H 1 4.346 0.001 . 1 . . . . 29 THR HB . 16188 1 257 . 1 1 29 29 THR HG21 H 1 0.846 0.001 . 1 . . . . 29 THR QG2 . 16188 1 258 . 1 1 29 29 THR HG22 H 1 0.846 0.001 . 1 . . . . 29 THR QG2 . 16188 1 259 . 1 1 29 29 THR HG23 H 1 0.846 0.001 . 1 . . . . 29 THR QG2 . 16188 1 260 . 1 1 30 30 TYR H H 1 9.219 0.001 . 1 . . . . 30 TYR H . 16188 1 261 . 1 1 30 30 TYR HA H 1 5.468 0.001 . 1 . . . . 30 TYR HA . 16188 1 262 . 1 1 30 30 TYR HB2 H 1 3.234 0.001 . 2 . . . . 30 TYR HB2 . 16188 1 263 . 1 1 30 30 TYR HB3 H 1 2.682 0.001 . 2 . . . . 30 TYR HB3 . 16188 1 264 . 1 1 30 30 TYR HD1 H 1 6.968 0.001 . 3 . . . . 30 TYR QD . 16188 1 265 . 1 1 30 30 TYR HD2 H 1 6.968 0.001 . 3 . . . . 30 TYR QD . 16188 1 266 . 1 1 30 30 TYR HE1 H 1 6.677 0.001 . 3 . . . . 30 TYR QE . 16188 1 267 . 1 1 30 30 TYR HE2 H 1 6.677 0.001 . 3 . . . . 30 TYR QE . 16188 1 268 . 1 1 30 30 TYR C C 13 175.601 0.001 . 1 . . . . 30 TYR C . 16188 1 269 . 1 1 30 30 TYR CA C 13 54.331 0.001 . 1 . . . . 30 TYR CA . 16188 1 270 . 1 1 30 30 TYR N N 15 119.841 0.001 . 1 . . . . 30 TYR N . 16188 1 271 . 1 1 31 31 ASP H H 1 8.412 0.001 . 1 . . . . 31 ASP H . 16188 1 272 . 1 1 31 31 ASP HA H 1 5.109 0.001 . 1 . . . . 31 ASP HA . 16188 1 273 . 1 1 31 31 ASP HB2 H 1 2.930 0.001 . 2 . . . . 31 ASP HB2 . 16188 1 274 . 1 1 31 31 ASP HB3 H 1 3.352 0.001 . 2 . . . . 31 ASP HB3 . 16188 1 275 . 1 1 31 31 ASP C C 13 169.871 0.001 . 1 . . . . 31 ASP C . 16188 1 276 . 1 1 31 31 ASP CA C 13 52.281 0.001 . 1 . . . . 31 ASP CA . 16188 1 277 . 1 1 31 31 ASP N N 15 119.511 0.001 . 1 . . . . 31 ASP N . 16188 1 278 . 1 1 32 32 LEU H H 1 8.815 0.001 . 1 . . . . 32 LEU H . 16188 1 279 . 1 1 32 32 LEU HA H 1 4.241 0.001 . 1 . . . . 32 LEU HA . 16188 1 280 . 1 1 32 32 LEU HB2 H 1 2.088 0.001 . 2 . . . . 32 LEU HB2 . 16188 1 281 . 1 1 32 32 LEU HB3 H 1 1.940 0.001 . 2 . . . . 32 LEU HB3 . 16188 1 282 . 1 1 32 32 LEU HD11 H 1 0.936 0.001 . 2 . . . . 32 LEU QD1 . 16188 1 283 . 1 1 32 32 LEU HD12 H 1 0.936 0.001 . 2 . . . . 32 LEU QD1 . 16188 1 284 . 1 1 32 32 LEU HD13 H 1 0.936 0.001 . 2 . . . . 32 LEU QD1 . 16188 1 285 . 1 1 32 32 LEU HD21 H 1 0.891 0.001 . 2 . . . . 32 LEU QD2 . 16188 1 286 . 1 1 32 32 LEU HD22 H 1 0.891 0.001 . 2 . . . . 32 LEU QD2 . 16188 1 287 . 1 1 32 32 LEU HD23 H 1 0.891 0.001 . 2 . . . . 32 LEU QD2 . 16188 1 288 . 1 1 32 32 LEU HG H 1 1.569 0.001 . 1 . . . . 32 LEU HG . 16188 1 289 . 1 1 32 32 LEU CA C 13 55.461 0.001 . 1 . . . . 32 LEU CA . 16188 1 290 . 1 1 32 32 LEU N N 15 118.051 0.001 . 1 . . . . 32 LEU N . 16188 1 291 . 1 1 33 33 PRO HB2 H 1 1.971 0.001 . 2 . . . . 33 PRO HB2 . 16188 1 292 . 1 1 33 33 PRO HB3 H 1 2.432 0.001 . 2 . . . . 33 PRO HB3 . 16188 1 293 . 1 1 33 33 PRO HD2 H 1 3.906 0.001 . 2 . . . . 33 PRO HD2 . 16188 1 294 . 1 1 33 33 PRO HD3 H 1 3.851 0.001 . 2 . . . . 33 PRO HD3 . 16188 1 295 . 1 1 33 33 PRO HG2 H 1 2.306 0.001 . 2 . . . . 33 PRO HG2 . 16188 1 296 . 1 1 33 33 PRO HG3 H 1 2.306 0.001 . 2 . . . . 33 PRO HG3 . 16188 1 297 . 1 1 33 33 PRO C C 13 179.041 0.001 . 1 . . . . 33 PRO C . 16188 1 298 . 1 1 33 33 PRO CA C 13 66.291 0.001 . 1 . . . . 33 PRO CA . 16188 1 299 . 1 1 33 33 PRO CB C 13 31.001 0.001 . 1 . . . . 33 PRO CB . 16188 1 300 . 1 1 34 34 ARG H H 1 7.758 0.001 . 1 . . . . 34 ARG H . 16188 1 301 . 1 1 34 34 ARG HA H 1 4.224 0.001 . 1 . . . . 34 ARG HA . 16188 1 302 . 1 1 34 34 ARG HB2 H 1 2.097 0.001 . 2 . . . . 34 ARG HB2 . 16188 1 303 . 1 1 34 34 ARG HB3 H 1 1.776 0.001 . 2 . . . . 34 ARG HB3 . 16188 1 304 . 1 1 34 34 ARG HD2 H 1 3.439 0.001 . 2 . . . . 34 ARG HD2 . 16188 1 305 . 1 1 34 34 ARG HD3 H 1 3.156 0.001 . 2 . . . . 34 ARG HD3 . 16188 1 306 . 1 1 34 34 ARG HE H 1 6.983 0.001 . 1 . . . . 34 ARG HE . 16188 1 307 . 1 1 34 34 ARG HG2 H 1 1.776 0.001 . 2 . . . . 34 ARG HG2 . 16188 1 308 . 1 1 34 34 ARG HG3 H 1 1.128 0.001 . 2 . . . . 34 ARG HG3 . 16188 1 309 . 1 1 34 34 ARG CA C 13 57.851 0.001 . 1 . . . . 34 ARG CA . 16188 1 310 . 1 1 34 34 ARG N N 15 118.921 0.001 . 1 . . . . 34 ARG N . 16188 1 311 . 1 1 34 34 ARG NE N 15 85.461 0.001 . 1 . . . . 34 ARG NE . 16188 1 312 . 1 1 35 35 VAL H H 1 8.217 0.001 . 1 . . . . 35 VAL H . 16188 1 313 . 1 1 35 35 VAL HA H 1 3.142 0.001 . 1 . . . . 35 VAL HA . 16188 1 314 . 1 1 35 35 VAL HB H 1 2.357 0.001 . 1 . . . . 35 VAL HB . 16188 1 315 . 1 1 35 35 VAL HG11 H 1 1.113 0.001 . 2 . . . . 35 VAL QG1 . 16188 1 316 . 1 1 35 35 VAL HG12 H 1 1.113 0.001 . 2 . . . . 35 VAL QG1 . 16188 1 317 . 1 1 35 35 VAL HG13 H 1 1.113 0.001 . 2 . . . . 35 VAL QG1 . 16188 1 318 . 1 1 35 35 VAL HG21 H 1 0.965 0.001 . 2 . . . . 35 VAL QG2 . 16188 1 319 . 1 1 35 35 VAL HG22 H 1 0.965 0.001 . 2 . . . . 35 VAL QG2 . 16188 1 320 . 1 1 35 35 VAL HG23 H 1 0.965 0.001 . 2 . . . . 35 VAL QG2 . 16188 1 321 . 1 1 35 35 VAL C C 13 176.931 0.001 . 1 . . . . 35 VAL C . 16188 1 322 . 1 1 35 35 VAL CA C 13 67.311 0.001 . 1 . . . . 35 VAL CA . 16188 1 323 . 1 1 35 35 VAL CB C 13 31.571 0.001 . 1 . . . . 35 VAL CB . 16188 1 324 . 1 1 35 35 VAL N N 15 120.561 0.001 . 1 . . . . 35 VAL N . 16188 1 325 . 1 1 36 36 ALA H H 1 8.395 0.001 . 1 . . . . 36 ALA H . 16188 1 326 . 1 1 36 36 ALA HA H 1 3.833 0.001 . 1 . . . . 36 ALA HA . 16188 1 327 . 1 1 36 36 ALA HB1 H 1 1.675 0.001 . 1 . . . . 36 ALA QB . 16188 1 328 . 1 1 36 36 ALA HB2 H 1 1.675 0.001 . 1 . . . . 36 ALA QB . 16188 1 329 . 1 1 36 36 ALA HB3 H 1 1.675 0.001 . 1 . . . . 36 ALA QB . 16188 1 330 . 1 1 36 36 ALA C C 13 179.341 0.001 . 1 . . . . 36 ALA C . 16188 1 331 . 1 1 36 36 ALA CA C 13 55.801 0.001 . 1 . . . . 36 ALA CA . 16188 1 332 . 1 1 36 36 ALA CB C 13 18.121 0.001 . 1 . . . . 36 ALA CB . 16188 1 333 . 1 1 36 36 ALA N N 15 121.641 0.001 . 1 . . . . 36 ALA N . 16188 1 334 . 1 1 37 37 GLU H H 1 7.728 0.001 . 1 . . . . 37 GLU H . 16188 1 335 . 1 1 37 37 GLU HA H 1 4.081 0.001 . 1 . . . . 37 GLU HA . 16188 1 336 . 1 1 37 37 GLU HB2 H 1 2.251 0.001 . 2 . . . . 37 GLU HB2 . 16188 1 337 . 1 1 37 37 GLU HB3 H 1 2.251 0.001 . 2 . . . . 37 GLU HB3 . 16188 1 338 . 1 1 37 37 GLU HG2 H 1 2.503 0.001 . 2 . . . . 37 GLU HG2 . 16188 1 339 . 1 1 37 37 GLU HG3 H 1 2.503 0.001 . 2 . . . . 37 GLU HG3 . 16188 1 340 . 1 1 37 37 GLU C C 13 179.471 0.001 . 1 . . . . 37 GLU C . 16188 1 341 . 1 1 37 37 GLU CA C 13 59.081 0.001 . 1 . . . . 37 GLU CA . 16188 1 342 . 1 1 37 37 GLU CB C 13 29.351 0.001 . 1 . . . . 37 GLU CB . 16188 1 343 . 1 1 37 37 GLU N N 15 117.661 0.001 . 1 . . . . 37 GLU N . 16188 1 344 . 1 1 38 38 LEU H H 1 8.208 0.001 . 1 . . . . 38 LEU H . 16188 1 345 . 1 1 38 38 LEU HA H 1 4.031 0.001 . 1 . . . . 38 LEU HA . 16188 1 346 . 1 1 38 38 LEU HB2 H 1 1.679 0.001 . 2 . . . . 38 LEU HB2 . 16188 1 347 . 1 1 38 38 LEU HB3 H 1 1.607 0.001 . 2 . . . . 38 LEU HB3 . 16188 1 348 . 1 1 38 38 LEU HD11 H 1 0.596 0.001 . 2 . . . . 38 LEU QD1 . 16188 1 349 . 1 1 38 38 LEU HD12 H 1 0.596 0.001 . 2 . . . . 38 LEU QD1 . 16188 1 350 . 1 1 38 38 LEU HD13 H 1 0.596 0.001 . 2 . . . . 38 LEU QD1 . 16188 1 351 . 1 1 38 38 LEU HD21 H 1 0.254 0.001 . 2 . . . . 38 LEU QD2 . 16188 1 352 . 1 1 38 38 LEU HD22 H 1 0.254 0.001 . 2 . . . . 38 LEU QD2 . 16188 1 353 . 1 1 38 38 LEU HD23 H 1 0.254 0.001 . 2 . . . . 38 LEU QD2 . 16188 1 354 . 1 1 38 38 LEU HG H 1 1.513 0.001 . 1 . . . . 38 LEU HG . 16188 1 355 . 1 1 38 38 LEU C C 13 179.121 0.001 . 1 . . . . 38 LEU C . 16188 1 356 . 1 1 38 38 LEU CA C 13 58.291 0.001 . 1 . . . . 38 LEU CA . 16188 1 357 . 1 1 38 38 LEU CB C 13 42.281 0.001 . 1 . . . . 38 LEU CB . 16188 1 358 . 1 1 38 38 LEU N N 15 121.981 0.001 . 1 . . . . 38 LEU N . 16188 1 359 . 1 1 39 39 LEU H H 1 8.360 0.001 . 1 . . . . 39 LEU H . 16188 1 360 . 1 1 39 39 LEU HA H 1 4.412 0.001 . 1 . . . . 39 LEU HA . 16188 1 361 . 1 1 39 39 LEU HB2 H 1 1.895 0.001 . 2 . . . . 39 LEU HB2 . 16188 1 362 . 1 1 39 39 LEU HB3 H 1 1.682 0.001 . 2 . . . . 39 LEU HB3 . 16188 1 363 . 1 1 39 39 LEU HD11 H 1 1.228 0.001 . 2 . . . . 39 LEU QD1 . 16188 1 364 . 1 1 39 39 LEU HD12 H 1 1.228 0.001 . 2 . . . . 39 LEU QD1 . 16188 1 365 . 1 1 39 39 LEU HD13 H 1 1.228 0.001 . 2 . . . . 39 LEU QD1 . 16188 1 366 . 1 1 39 39 LEU HD21 H 1 0.982 0.001 . 2 . . . . 39 LEU QD2 . 16188 1 367 . 1 1 39 39 LEU HD22 H 1 0.982 0.001 . 2 . . . . 39 LEU QD2 . 16188 1 368 . 1 1 39 39 LEU HD23 H 1 0.982 0.001 . 2 . . . . 39 LEU QD2 . 16188 1 369 . 1 1 39 39 LEU HG H 1 2.072 0.001 . 1 . . . . 39 LEU HG . 16188 1 370 . 1 1 39 39 LEU C C 13 178.261 0.001 . 1 . . . . 39 LEU C . 16188 1 371 . 1 1 39 39 LEU CA C 13 55.761 0.001 . 1 . . . . 39 LEU CA . 16188 1 372 . 1 1 39 39 LEU CB C 13 45.711 0.001 . 1 . . . . 39 LEU CB . 16188 1 373 . 1 1 39 39 LEU N N 15 115.441 0.001 . 1 . . . . 39 LEU N . 16188 1 374 . 1 1 40 40 GLY H H 1 8.237 0.001 . 1 . . . . 40 GLY H . 16188 1 375 . 1 1 40 40 GLY HA2 H 1 4.000 0.001 . 2 . . . . 40 GLY HA2 . 16188 1 376 . 1 1 40 40 GLY HA3 H 1 4.100 0.001 . 2 . . . . 40 GLY HA3 . 16188 1 377 . 1 1 40 40 GLY C C 13 175.111 0.001 . 1 . . . . 40 GLY C . 16188 1 378 . 1 1 40 40 GLY CA C 13 46.701 0.001 . 1 . . . . 40 GLY CA . 16188 1 379 . 1 1 40 40 GLY N N 15 110.401 0.001 . 1 . . . . 40 GLY N . 16188 1 380 . 1 1 41 41 VAL H H 1 8.079 0.001 . 1 . . . . 41 VAL H . 16188 1 381 . 1 1 41 41 VAL HA H 1 5.076 0.001 . 1 . . . . 41 VAL HA . 16188 1 382 . 1 1 41 41 VAL HB H 1 2.272 0.001 . 1 . . . . 41 VAL HB . 16188 1 383 . 1 1 41 41 VAL HG11 H 1 0.984 0.001 . 2 . . . . 41 VAL QG1 . 16188 1 384 . 1 1 41 41 VAL HG12 H 1 0.984 0.001 . 2 . . . . 41 VAL QG1 . 16188 1 385 . 1 1 41 41 VAL HG13 H 1 0.984 0.001 . 2 . . . . 41 VAL QG1 . 16188 1 386 . 1 1 41 41 VAL HG21 H 1 0.828 0.001 . 2 . . . . 41 VAL QG2 . 16188 1 387 . 1 1 41 41 VAL HG22 H 1 0.828 0.001 . 2 . . . . 41 VAL QG2 . 16188 1 388 . 1 1 41 41 VAL HG23 H 1 0.828 0.001 . 2 . . . . 41 VAL QG2 . 16188 1 389 . 1 1 41 41 VAL CA C 13 57.631 0.001 . 1 . . . . 41 VAL CA . 16188 1 390 . 1 1 41 41 VAL N N 15 112.051 0.001 . 1 . . . . 41 VAL N . 16188 1 391 . 1 1 42 42 PRO HA H 1 4.742 0.001 . 1 . . . . 42 PRO HA . 16188 1 392 . 1 1 42 42 PRO HB2 H 1 1.675 0.001 . 2 . . . . 42 PRO HB2 . 16188 1 393 . 1 1 42 42 PRO HB3 H 1 2.601 0.001 . 2 . . . . 42 PRO HB3 . 16188 1 394 . 1 1 42 42 PRO HD2 H 1 3.921 0.001 . 2 . . . . 42 PRO HD2 . 16188 1 395 . 1 1 42 42 PRO HD3 H 1 3.636 0.001 . 2 . . . . 42 PRO HD3 . 16188 1 396 . 1 1 42 42 PRO HG2 H 1 2.145 0.001 . 2 . . . . 42 PRO HG2 . 16188 1 397 . 1 1 42 42 PRO HG3 H 1 2.145 0.001 . 2 . . . . 42 PRO HG3 . 16188 1 398 . 1 1 42 42 PRO C C 13 178.761 0.001 . 1 . . . . 42 PRO C . 16188 1 399 . 1 1 42 42 PRO CA C 13 62.221 0.001 . 1 . . . . 42 PRO CA . 16188 1 400 . 1 1 42 42 PRO CB C 13 32.721 0.001 . 1 . . . . 42 PRO CB . 16188 1 401 . 1 1 43 43 VAL H H 1 9.020 0.001 . 1 . . . . 43 VAL H . 16188 1 402 . 1 1 43 43 VAL HA H 1 3.636 0.001 . 1 . . . . 43 VAL HA . 16188 1 403 . 1 1 43 43 VAL HB H 1 2.142 0.001 . 1 . . . . 43 VAL HB . 16188 1 404 . 1 1 43 43 VAL HG11 H 1 1.108 0.001 . 2 . . . . 43 VAL QG1 . 16188 1 405 . 1 1 43 43 VAL HG12 H 1 1.108 0.001 . 2 . . . . 43 VAL QG1 . 16188 1 406 . 1 1 43 43 VAL HG13 H 1 1.108 0.001 . 2 . . . . 43 VAL QG1 . 16188 1 407 . 1 1 43 43 VAL HG21 H 1 1.053 0.001 . 2 . . . . 43 VAL QG2 . 16188 1 408 . 1 1 43 43 VAL HG22 H 1 1.053 0.001 . 2 . . . . 43 VAL QG2 . 16188 1 409 . 1 1 43 43 VAL HG23 H 1 1.053 0.001 . 2 . . . . 43 VAL QG2 . 16188 1 410 . 1 1 43 43 VAL C C 13 177.771 0.001 . 1 . . . . 43 VAL C . 16188 1 411 . 1 1 43 43 VAL CA C 13 67.271 0.001 . 1 . . . . 43 VAL CA . 16188 1 412 . 1 1 43 43 VAL CB C 13 32.091 0.001 . 1 . . . . 43 VAL CB . 16188 1 413 . 1 1 43 43 VAL N N 15 123.191 0.001 . 1 . . . . 43 VAL N . 16188 1 414 . 1 1 44 44 SER H H 1 8.544 0.001 . 1 . . . . 44 SER H . 16188 1 415 . 1 1 44 44 SER HA H 1 4.251 0.001 . 1 . . . . 44 SER HA . 16188 1 416 . 1 1 44 44 SER HB2 H 1 3.882 0.001 . 2 . . . . 44 SER HB2 . 16188 1 417 . 1 1 44 44 SER HB3 H 1 3.882 0.001 . 2 . . . . 44 SER HB3 . 16188 1 418 . 1 1 44 44 SER C C 13 177.471 0.001 . 1 . . . . 44 SER C . 16188 1 419 . 1 1 44 44 SER CA C 13 61.131 0.001 . 1 . . . . 44 SER CA . 16188 1 420 . 1 1 44 44 SER N N 15 114.021 0.001 . 1 . . . . 44 SER N . 16188 1 421 . 1 1 45 45 LYS H H 1 7.784 0.001 . 1 . . . . 45 LYS H . 16188 1 422 . 1 1 45 45 LYS HA H 1 4.460 0.001 . 1 . . . . 45 LYS HA . 16188 1 423 . 1 1 45 45 LYS HB2 H 1 2.121 0.001 . 2 . . . . 45 LYS QB . 16188 1 424 . 1 1 45 45 LYS HB3 H 1 2.121 0.001 . 2 . . . . 45 LYS QB . 16188 1 425 . 1 1 45 45 LYS HD2 H 1 2.101 0.001 . 2 . . . . 45 LYS QD . 16188 1 426 . 1 1 45 45 LYS HD3 H 1 2.101 0.001 . 2 . . . . 45 LYS QD . 16188 1 427 . 1 1 45 45 LYS HE2 H 1 3.119 0.001 . 2 . . . . 45 LYS QE . 16188 1 428 . 1 1 45 45 LYS HE3 H 1 3.119 0.001 . 2 . . . . 45 LYS QE . 16188 1 429 . 1 1 45 45 LYS HG2 H 1 1.599 0.001 . 2 . . . . 45 LYS QG . 16188 1 430 . 1 1 45 45 LYS HG3 H 1 1.599 0.001 . 2 . . . . 45 LYS QG . 16188 1 431 . 1 1 45 45 LYS C C 13 179.151 0.001 . 1 . . . . 45 LYS C . 16188 1 432 . 1 1 45 45 LYS CA C 13 57.901 0.001 . 1 . . . . 45 LYS CA . 16188 1 433 . 1 1 45 45 LYS CB C 13 31.821 0.001 . 1 . . . . 45 LYS CB . 16188 1 434 . 1 1 45 45 LYS N N 15 123.491 0.001 . 1 . . . . 45 LYS N . 16188 1 435 . 1 1 46 46 VAL H H 1 7.553 0.001 . 1 . . . . 46 VAL H . 16188 1 436 . 1 1 46 46 VAL HA H 1 3.619 0.001 . 1 . . . . 46 VAL HA . 16188 1 437 . 1 1 46 46 VAL HB H 1 2.373 0.001 . 1 . . . . 46 VAL HB . 16188 1 438 . 1 1 46 46 VAL HG11 H 1 0.959 0.001 . 2 . . . . 46 VAL QG1 . 16188 1 439 . 1 1 46 46 VAL HG12 H 1 0.959 0.001 . 2 . . . . 46 VAL QG1 . 16188 1 440 . 1 1 46 46 VAL HG13 H 1 0.959 0.001 . 2 . . . . 46 VAL QG1 . 16188 1 441 . 1 1 46 46 VAL HG21 H 1 0.959 0.001 . 2 . . . . 46 VAL QG2 . 16188 1 442 . 1 1 46 46 VAL HG22 H 1 0.959 0.001 . 2 . . . . 46 VAL QG2 . 16188 1 443 . 1 1 46 46 VAL HG23 H 1 0.959 0.001 . 2 . . . . 46 VAL QG2 . 16188 1 444 . 1 1 46 46 VAL CA C 13 66.841 0.001 . 1 . . . . 46 VAL CA . 16188 1 445 . 1 1 46 46 VAL CB C 13 31.461 0.001 . 1 . . . . 46 VAL CB . 16188 1 446 . 1 1 46 46 VAL N N 15 121.931 0.001 . 1 . . . . 46 VAL N . 16188 1 447 . 1 1 47 47 ALA H H 1 8.389 0.001 . 1 . . . . 47 ALA H . 16188 1 448 . 1 1 47 47 ALA HA H 1 4.072 0.001 . 1 . . . . 47 ALA HA . 16188 1 449 . 1 1 47 47 ALA HB1 H 1 1.585 0.001 . 1 . . . . 47 ALA QB . 16188 1 450 . 1 1 47 47 ALA HB2 H 1 1.585 0.001 . 1 . . . . 47 ALA QB . 16188 1 451 . 1 1 47 47 ALA HB3 H 1 1.585 0.001 . 1 . . . . 47 ALA QB . 16188 1 452 . 1 1 47 47 ALA C C 13 179.361 0.001 . 1 . . . . 47 ALA C . 16188 1 453 . 1 1 47 47 ALA CA C 13 55.801 0.001 . 1 . . . . 47 ALA CA . 16188 1 454 . 1 1 47 47 ALA CB C 13 18.201 0.001 . 1 . . . . 47 ALA CB . 16188 1 455 . 1 1 47 47 ALA N N 15 120.571 0.001 . 1 . . . . 47 ALA N . 16188 1 456 . 1 1 48 48 GLN H H 1 7.869 0.001 . 1 . . . . 48 GLN H . 16188 1 457 . 1 1 48 48 GLN HA H 1 4.067 0.001 . 1 . . . . 48 GLN HA . 16188 1 458 . 1 1 48 48 GLN HB2 H 1 2.357 0.001 . 2 . . . . 48 GLN HB2 . 16188 1 459 . 1 1 48 48 GLN HB3 H 1 2.357 0.001 . 2 . . . . 48 GLN HB3 . 16188 1 460 . 1 1 48 48 GLN HE21 H 1 8.012 0.001 . 2 . . . . 48 GLN HE21 . 16188 1 461 . 1 1 48 48 GLN HE22 H 1 6.985 0.001 . 2 . . . . 48 GLN HE22 . 16188 1 462 . 1 1 48 48 GLN HG2 H 1 2.576 0.001 . 2 . . . . 48 GLN HG2 . 16188 1 463 . 1 1 48 48 GLN HG3 H 1 2.471 0.001 . 2 . . . . 48 GLN HG3 . 16188 1 464 . 1 1 48 48 GLN C C 13 177.731 0.001 . 1 . . . . 48 GLN C . 16188 1 465 . 1 1 48 48 GLN CA C 13 59.491 0.001 . 1 . . . . 48 GLN CA . 16188 1 466 . 1 1 48 48 GLN CB C 13 28.571 0.001 . 1 . . . . 48 GLN CB . 16188 1 467 . 1 1 48 48 GLN N N 15 117.811 0.001 . 1 . . . . 48 GLN N . 16188 1 468 . 1 1 48 48 GLN NE2 N 15 112.631 0.001 . 1 . . . . 48 GLN NE2 . 16188 1 469 . 1 1 49 49 GLN H H 1 7.927 0.001 . 1 . . . . 49 GLN H . 16188 1 470 . 1 1 49 49 GLN HA H 1 4.213 0.001 . 1 . . . . 49 GLN HA . 16188 1 471 . 1 1 49 49 GLN HB2 H 1 2.472 0.001 . 2 . . . . 49 GLN HB2 . 16188 1 472 . 1 1 49 49 GLN HB3 H 1 2.359 0.001 . 2 . . . . 49 GLN HB3 . 16188 1 473 . 1 1 49 49 GLN HE21 H 1 7.118 0.001 . 2 . . . . 49 GLN HE21 . 16188 1 474 . 1 1 49 49 GLN HE22 H 1 6.501 0.001 . 2 . . . . 49 GLN HE22 . 16188 1 475 . 1 1 49 49 GLN HG2 H 1 2.588 0.001 . 2 . . . . 49 GLN HG2 . 16188 1 476 . 1 1 49 49 GLN HG3 H 1 2.727 0.001 . 2 . . . . 49 GLN HG3 . 16188 1 477 . 1 1 49 49 GLN C C 13 179.341 0.001 . 1 . . . . 49 GLN C . 16188 1 478 . 1 1 49 49 GLN CA C 13 59.761 0.001 . 1 . . . . 49 GLN CA . 16188 1 479 . 1 1 49 49 GLN CB C 13 28.931 0.001 . 1 . . . . 49 GLN CB . 16188 1 480 . 1 1 49 49 GLN N N 15 118.491 0.001 . 1 . . . . 49 GLN N . 16188 1 481 . 1 1 49 49 GLN NE2 N 15 108.461 0.001 . 1 . . . . 49 GLN NE2 . 16188 1 482 . 1 1 50 50 LEU H H 1 7.886 0.001 . 1 . . . . 50 LEU H . 16188 1 483 . 1 1 50 50 LEU HA H 1 4.302 0.001 . 1 . . . . 50 LEU HA . 16188 1 484 . 1 1 50 50 LEU HB2 H 1 2.331 0.001 . 2 . . . . 50 LEU HB2 . 16188 1 485 . 1 1 50 50 LEU HB3 H 1 1.820 0.001 . 2 . . . . 50 LEU HB3 . 16188 1 486 . 1 1 50 50 LEU HD11 H 1 0.961 0.001 . 2 . . . . 50 LEU QD1 . 16188 1 487 . 1 1 50 50 LEU HD12 H 1 0.961 0.001 . 2 . . . . 50 LEU QD1 . 16188 1 488 . 1 1 50 50 LEU HD13 H 1 0.961 0.001 . 2 . . . . 50 LEU QD1 . 16188 1 489 . 1 1 50 50 LEU HD21 H 1 0.854 0.001 . 2 . . . . 50 LEU QD2 . 16188 1 490 . 1 1 50 50 LEU HD22 H 1 0.854 0.001 . 2 . . . . 50 LEU QD2 . 16188 1 491 . 1 1 50 50 LEU HD23 H 1 0.854 0.001 . 2 . . . . 50 LEU QD2 . 16188 1 492 . 1 1 50 50 LEU HG H 1 1.581 0.001 . 1 . . . . 50 LEU HG . 16188 1 493 . 1 1 50 50 LEU C C 13 180.201 0.001 . 1 . . . . 50 LEU C . 16188 1 494 . 1 1 50 50 LEU CA C 13 58.021 0.001 . 1 . . . . 50 LEU CA . 16188 1 495 . 1 1 50 50 LEU CB C 13 41.921 0.001 . 1 . . . . 50 LEU CB . 16188 1 496 . 1 1 50 50 LEU N N 15 118.921 0.001 . 1 . . . . 50 LEU N . 16188 1 497 . 1 1 51 51 ARG H H 1 8.506 0.001 . 1 . . . . 51 ARG H . 16188 1 498 . 1 1 51 51 ARG HA H 1 4.018 0.001 . 1 . . . . 51 ARG HA . 16188 1 499 . 1 1 51 51 ARG HB2 H 1 2.136 0.001 . 2 . . . . 51 ARG HB2 . 16188 1 500 . 1 1 51 51 ARG HB3 H 1 2.009 0.001 . 2 . . . . 51 ARG HB3 . 16188 1 501 . 1 1 51 51 ARG HD2 H 1 3.466 0.001 . 2 . . . . 51 ARG HD2 . 16188 1 502 . 1 1 51 51 ARG HD3 H 1 3.292 0.001 . 2 . . . . 51 ARG HD3 . 16188 1 503 . 1 1 51 51 ARG HE H 1 7.372 0.001 . 1 . . . . 51 ARG HE . 16188 1 504 . 1 1 51 51 ARG HG2 H 1 2.009 0.001 . 2 . . . . 51 ARG HG2 . 16188 1 505 . 1 1 51 51 ARG HG3 H 1 1.716 0.001 . 2 . . . . 51 ARG HG3 . 16188 1 506 . 1 1 51 51 ARG C C 13 178.761 0.001 . 1 . . . . 51 ARG C . 16188 1 507 . 1 1 51 51 ARG CA C 13 60.661 0.001 . 1 . . . . 51 ARG CA . 16188 1 508 . 1 1 51 51 ARG CB C 13 30.551 0.001 . 1 . . . . 51 ARG CB . 16188 1 509 . 1 1 51 51 ARG N N 15 120.721 0.001 . 1 . . . . 51 ARG N . 16188 1 510 . 1 1 51 51 ARG NE N 15 84.521 0.001 . 1 . . . . 51 ARG NE . 16188 1 511 . 1 1 52 52 GLU H H 1 8.243 0.001 . 1 . . . . 52 GLU H . 16188 1 512 . 1 1 52 52 GLU HA H 1 4.209 0.001 . 1 . . . . 52 GLU HA . 16188 1 513 . 1 1 52 52 GLU HB2 H 1 1.934 0.001 . 2 . . . . 52 GLU HB2 . 16188 1 514 . 1 1 52 52 GLU HB3 H 1 1.823 0.001 . 2 . . . . 52 GLU HB3 . 16188 1 515 . 1 1 52 52 GLU HG2 H 1 2.585 0.001 . 2 . . . . 52 GLU HG2 . 16188 1 516 . 1 1 52 52 GLU HG3 H 1 2.363 0.001 . 2 . . . . 52 GLU HG3 . 16188 1 517 . 1 1 52 52 GLU C C 13 176.291 0.001 . 1 . . . . 52 GLU C . 16188 1 518 . 1 1 52 52 GLU CA C 13 56.231 0.001 . 1 . . . . 52 GLU CA . 16188 1 519 . 1 1 52 52 GLU CB C 13 30.011 0.001 . 1 . . . . 52 GLU CB . 16188 1 520 . 1 1 52 52 GLU N N 15 115.341 0.001 . 1 . . . . 52 GLU N . 16188 1 521 . 1 1 53 53 GLY H H 1 7.775 0.001 . 1 . . . . 53 GLY H . 16188 1 522 . 1 1 53 53 GLY HA2 H 1 4.002 0.001 . 2 . . . . 53 GLY HA2 . 16188 1 523 . 1 1 53 53 GLY HA3 H 1 4.177 0.001 . 2 . . . . 53 GLY HA3 . 16188 1 524 . 1 1 53 53 GLY C C 13 174.161 0.001 . 1 . . . . 53 GLY C . 16188 1 525 . 1 1 53 53 GLY CA C 13 46.311 0.001 . 1 . . . . 53 GLY CA . 16188 1 526 . 1 1 53 53 GLY N N 15 106.811 0.001 . 1 . . . . 53 GLY N . 16188 1 527 . 1 1 54 54 HIS H H 1 8.395 0.001 . 1 . . . . 54 HIS H . 16188 1 528 . 1 1 54 54 HIS HA H 1 4.900 0.001 . 1 . . . . 54 HIS HA . 16188 1 529 . 1 1 54 54 HIS HB2 H 1 3.577 0.001 . 2 . . . . 54 HIS HB2 . 16188 1 530 . 1 1 54 54 HIS HB3 H 1 3.094 0.001 . 2 . . . . 54 HIS HB3 . 16188 1 531 . 1 1 54 54 HIS HD2 H 1 7.251 0.001 . 1 . . . . 54 HIS HD2 . 16188 1 532 . 1 1 54 54 HIS HE1 H 1 9.783 0.001 . 1 . . . . 54 HIS HE1 . 16188 1 533 . 1 1 54 54 HIS C C 13 172.301 0.001 . 1 . . . . 54 HIS C . 16188 1 534 . 1 1 54 54 HIS CA C 13 54.871 0.001 . 1 . . . . 54 HIS CA . 16188 1 535 . 1 1 54 54 HIS CB C 13 30.191 0.001 . 1 . . . . 54 HIS CB . 16188 1 536 . 1 1 54 54 HIS N N 15 115.051 0.001 . 1 . . . . 54 HIS N . 16188 1 537 . 1 1 55 55 LEU H H 1 7.793 0.001 . 1 . . . . 55 LEU H . 16188 1 538 . 1 1 55 55 LEU HA H 1 4.123 0.001 . 1 . . . . 55 LEU HA . 16188 1 539 . 1 1 55 55 LEU HB2 H 1 1.485 0.001 . 2 . . . . 55 LEU HB2 . 16188 1 540 . 1 1 55 55 LEU HB3 H 1 1.425 0.001 . 2 . . . . 55 LEU HB3 . 16188 1 541 . 1 1 55 55 LEU HD11 H 1 0.556 0.001 . 2 . . . . 55 LEU QD1 . 16188 1 542 . 1 1 55 55 LEU HD12 H 1 0.556 0.001 . 2 . . . . 55 LEU QD1 . 16188 1 543 . 1 1 55 55 LEU HD13 H 1 0.556 0.001 . 2 . . . . 55 LEU QD1 . 16188 1 544 . 1 1 55 55 LEU HD21 H 1 0.199 0.001 . 2 . . . . 55 LEU QD2 . 16188 1 545 . 1 1 55 55 LEU HD22 H 1 0.199 0.001 . 2 . . . . 55 LEU QD2 . 16188 1 546 . 1 1 55 55 LEU HD23 H 1 0.199 0.001 . 2 . . . . 55 LEU QD2 . 16188 1 547 . 1 1 55 55 LEU HG H 1 1.096 0.001 . 1 . . . . 55 LEU HG . 16188 1 548 . 1 1 55 55 LEU C C 13 173.281 0.001 . 1 . . . . 55 LEU C . 16188 1 549 . 1 1 55 55 LEU CA C 13 54.751 0.001 . 1 . . . . 55 LEU CA . 16188 1 550 . 1 1 55 55 LEU CB C 13 48.501 0.001 . 1 . . . . 55 LEU CB . 16188 1 551 . 1 1 55 55 LEU N N 15 116.601 0.001 . 1 . . . . 55 LEU N . 16188 1 552 . 1 1 56 56 VAL H H 1 6.583 0.001 . 1 . . . . 56 VAL H . 16188 1 553 . 1 1 56 56 VAL HA H 1 4.893 0.001 . 1 . . . . 56 VAL HA . 16188 1 554 . 1 1 56 56 VAL HB H 1 2.227 0.001 . 1 . . . . 56 VAL HB . 16188 1 555 . 1 1 56 56 VAL HG11 H 1 1.180 0.001 . 2 . . . . 56 VAL QQG . 16188 1 556 . 1 1 56 56 VAL HG12 H 1 1.180 0.001 . 2 . . . . 56 VAL QQG . 16188 1 557 . 1 1 56 56 VAL HG13 H 1 1.180 0.001 . 2 . . . . 56 VAL QQG . 16188 1 558 . 1 1 56 56 VAL HG21 H 1 1.180 0.001 . 2 . . . . 56 VAL QQG . 16188 1 559 . 1 1 56 56 VAL HG22 H 1 1.180 0.001 . 2 . . . . 56 VAL QQG . 16188 1 560 . 1 1 56 56 VAL HG23 H 1 1.180 0.001 . 2 . . . . 56 VAL QQG . 16188 1 561 . 1 1 56 56 VAL C C 13 171.371 0.001 . 1 . . . . 56 VAL C . 16188 1 562 . 1 1 56 56 VAL CA C 13 60.541 0.001 . 1 . . . . 56 VAL CA . 16188 1 563 . 1 1 56 56 VAL CB C 13 35.611 0.001 . 1 . . . . 56 VAL CB . 16188 1 564 . 1 1 56 56 VAL N N 15 115.731 0.001 . 1 . . . . 56 VAL N . 16188 1 565 . 1 1 57 57 ALA H H 1 8.739 0.001 . 1 . . . . 57 ALA H . 16188 1 566 . 1 1 57 57 ALA HA H 1 5.133 0.001 . 1 . . . . 57 ALA HA . 16188 1 567 . 1 1 57 57 ALA HB1 H 1 1.500 0.001 . 1 . . . . 57 ALA QB . 16188 1 568 . 1 1 57 57 ALA HB2 H 1 1.500 0.001 . 1 . . . . 57 ALA QB . 16188 1 569 . 1 1 57 57 ALA HB3 H 1 1.500 0.001 . 1 . . . . 57 ALA QB . 16188 1 570 . 1 1 57 57 ALA C C 13 176.851 0.001 . 1 . . . . 57 ALA C . 16188 1 571 . 1 1 57 57 ALA CA C 13 50.431 0.001 . 1 . . . . 57 ALA CA . 16188 1 572 . 1 1 57 57 ALA CB C 13 25.591 0.001 . 1 . . . . 57 ALA CB . 16188 1 573 . 1 1 57 57 ALA N N 15 125.411 0.001 . 1 . . . . 57 ALA N . 16188 1 574 . 1 1 58 58 VAL H H 1 8.739 0.001 . 1 . . . . 58 VAL H . 16188 1 575 . 1 1 58 58 VAL HA H 1 5.091 0.001 . 1 . . . . 58 VAL HA . 16188 1 576 . 1 1 58 58 VAL HB H 1 1.893 0.001 . 1 . . . . 58 VAL HB . 16188 1 577 . 1 1 58 58 VAL HG11 H 1 0.907 0.001 . 2 . . . . 58 VAL QG1 . 16188 1 578 . 1 1 58 58 VAL HG12 H 1 0.907 0.001 . 2 . . . . 58 VAL QG1 . 16188 1 579 . 1 1 58 58 VAL HG13 H 1 0.907 0.001 . 2 . . . . 58 VAL QG1 . 16188 1 580 . 1 1 58 58 VAL HG21 H 1 0.672 0.001 . 2 . . . . 58 VAL QG2 . 16188 1 581 . 1 1 58 58 VAL HG22 H 1 0.672 0.001 . 2 . . . . 58 VAL QG2 . 16188 1 582 . 1 1 58 58 VAL HG23 H 1 0.672 0.001 . 2 . . . . 58 VAL QG2 . 16188 1 583 . 1 1 58 58 VAL C C 13 174.381 0.001 . 1 . . . . 58 VAL C . 16188 1 584 . 1 1 58 58 VAL CA C 13 59.231 0.001 . 1 . . . . 58 VAL CA . 16188 1 585 . 1 1 58 58 VAL CB C 13 35.921 0.001 . 1 . . . . 58 VAL CB . 16188 1 586 . 1 1 58 58 VAL N N 15 109.821 0.001 . 1 . . . . 58 VAL N . 16188 1 587 . 1 1 59 59 ARG H H 1 8.284 0.001 . 1 . . . . 59 ARG H . 16188 1 588 . 1 1 59 59 ARG HA H 1 4.954 0.001 . 1 . . . . 59 ARG HA . 16188 1 589 . 1 1 59 59 ARG HB2 H 1 1.881 0.001 . 2 . . . . 59 ARG HB2 . 16188 1 590 . 1 1 59 59 ARG HB3 H 1 1.719 0.001 . 2 . . . . 59 ARG HB3 . 16188 1 591 . 1 1 59 59 ARG HD2 H 1 3.317 0.001 . 2 . . . . 59 ARG HD2 . 16188 1 592 . 1 1 59 59 ARG HD3 H 1 3.243 0.001 . 2 . . . . 59 ARG HD3 . 16188 1 593 . 1 1 59 59 ARG HE H 1 7.363 0.001 . 1 . . . . 59 ARG HE . 16188 1 594 . 1 1 59 59 ARG HG2 H 1 1.719 0.001 . 2 . . . . 59 ARG HG2 . 16188 1 595 . 1 1 59 59 ARG HG3 H 1 1.568 0.001 . 2 . . . . 59 ARG HG3 . 16188 1 596 . 1 1 59 59 ARG C C 13 175.171 0.001 . 1 . . . . 59 ARG C . 16188 1 597 . 1 1 59 59 ARG CA C 13 55.531 0.001 . 1 . . . . 59 ARG CA . 16188 1 598 . 1 1 59 59 ARG N N 15 122.221 0.001 . 1 . . . . 59 ARG N . 16188 1 599 . 1 1 59 59 ARG NE N 15 85.121 0.001 . 1 . . . . 59 ARG NE . 16188 1 600 . 1 1 60 60 ARG H H 1 8.494 0.001 . 1 . . . . 60 ARG H . 16188 1 601 . 1 1 60 60 ARG HA H 1 4.726 0.001 . 1 . . . . 60 ARG HA . 16188 1 602 . 1 1 60 60 ARG HB2 H 1 1.744 0.001 . 2 . . . . 60 ARG HB2 . 16188 1 603 . 1 1 60 60 ARG HB3 H 1 1.662 0.001 . 2 . . . . 60 ARG HB3 . 16188 1 604 . 1 1 60 60 ARG HD2 H 1 3.327 0.001 . 2 . . . . 60 ARG HD2 . 16188 1 605 . 1 1 60 60 ARG HD3 H 1 2.934 0.001 . 2 . . . . 60 ARG HD3 . 16188 1 606 . 1 1 60 60 ARG HE H 1 8.184 0.001 . 1 . . . . 60 ARG HE . 16188 1 607 . 1 1 60 60 ARG HG2 H 1 1.744 0.001 . 2 . . . . 60 ARG HG2 . 16188 1 608 . 1 1 60 60 ARG HG3 H 1 1.662 0.001 . 2 . . . . 60 ARG HG3 . 16188 1 609 . 1 1 60 60 ARG C C 13 175.541 0.001 . 1 . . . . 60 ARG C . 16188 1 610 . 1 1 60 60 ARG CA C 13 55.641 0.001 . 1 . . . . 60 ARG CA . 16188 1 611 . 1 1 60 60 ARG CB C 13 34.701 0.001 . 1 . . . . 60 ARG CB . 16188 1 612 . 1 1 60 60 ARG N N 15 125.321 0.001 . 1 . . . . 60 ARG N . 16188 1 613 . 1 1 60 60 ARG NE N 15 85.291 0.001 . 1 . . . . 60 ARG NE . 16188 1 614 . 1 1 61 61 ALA H H 1 9.346 0.001 . 1 . . . . 61 ALA H . 16188 1 615 . 1 1 61 61 ALA HA H 1 4.163 0.001 . 1 . . . . 61 ALA HA . 16188 1 616 . 1 1 61 61 ALA HB1 H 1 1.514 0.001 . 1 . . . . 61 ALA QB . 16188 1 617 . 1 1 61 61 ALA HB2 H 1 1.514 0.001 . 1 . . . . 61 ALA QB . 16188 1 618 . 1 1 61 61 ALA HB3 H 1 1.514 0.001 . 1 . . . . 61 ALA QB . 16188 1 619 . 1 1 61 61 ALA C C 13 177.751 0.001 . 1 . . . . 61 ALA C . 16188 1 620 . 1 1 61 61 ALA CA C 13 53.741 0.001 . 1 . . . . 61 ALA CA . 16188 1 621 . 1 1 61 61 ALA CB C 13 17.661 0.001 . 1 . . . . 61 ALA CB . 16188 1 622 . 1 1 61 61 ALA N N 15 130.131 0.001 . 1 . . . . 61 ALA N . 16188 1 623 . 1 1 62 62 GLY H H 1 8.675 0.001 . 1 . . . . 62 GLY H . 16188 1 624 . 1 1 62 62 GLY HA2 H 1 3.879 0.001 . 2 . . . . 62 GLY HA2 . 16188 1 625 . 1 1 62 62 GLY HA3 H 1 4.216 0.001 . 2 . . . . 62 GLY HA3 . 16188 1 626 . 1 1 62 62 GLY C C 13 174.291 0.001 . 1 . . . . 62 GLY C . 16188 1 627 . 1 1 62 62 GLY CA C 13 45.561 0.001 . 1 . . . . 62 GLY CA . 16188 1 628 . 1 1 62 62 GLY N N 15 105.261 0.001 . 1 . . . . 62 GLY N . 16188 1 629 . 1 1 63 63 GLY H H 1 7.974 0.001 . 1 . . . . 63 GLY H . 16188 1 630 . 1 1 63 63 GLY HA2 H 1 4.049 0.001 . 2 . . . . 63 GLY HA2 . 16188 1 631 . 1 1 63 63 GLY HA3 H 1 4.568 0.001 . 2 . . . . 63 GLY HA3 . 16188 1 632 . 1 1 63 63 GLY C C 13 172.161 0.001 . 1 . . . . 63 GLY C . 16188 1 633 . 1 1 63 63 GLY CA C 13 44.151 0.001 . 1 . . . . 63 GLY CA . 16188 1 634 . 1 1 63 63 GLY N N 15 109.431 0.001 . 1 . . . . 63 GLY N . 16188 1 635 . 1 1 64 64 VAL H H 1 8.284 0.001 . 1 . . . . 64 VAL H . 16188 1 636 . 1 1 64 64 VAL HA H 1 4.776 0.001 . 1 . . . . 64 VAL HA . 16188 1 637 . 1 1 64 64 VAL HB H 1 2.010 0.001 . 1 . . . . 64 VAL HB . 16188 1 638 . 1 1 64 64 VAL HG11 H 1 0.960 0.001 . 2 . . . . 64 VAL QG1 . 16188 1 639 . 1 1 64 64 VAL HG12 H 1 0.960 0.001 . 2 . . . . 64 VAL QG1 . 16188 1 640 . 1 1 64 64 VAL HG13 H 1 0.960 0.001 . 2 . . . . 64 VAL QG1 . 16188 1 641 . 1 1 64 64 VAL HG21 H 1 0.869 0.001 . 2 . . . . 64 VAL QG2 . 16188 1 642 . 1 1 64 64 VAL HG22 H 1 0.869 0.001 . 2 . . . . 64 VAL QG2 . 16188 1 643 . 1 1 64 64 VAL HG23 H 1 0.869 0.001 . 2 . . . . 64 VAL QG2 . 16188 1 644 . 1 1 64 64 VAL C C 13 175.581 0.001 . 1 . . . . 64 VAL C . 16188 1 645 . 1 1 64 64 VAL CA C 13 62.451 0.001 . 1 . . . . 64 VAL CA . 16188 1 646 . 1 1 64 64 VAL CB C 13 32.991 0.001 . 1 . . . . 64 VAL CB . 16188 1 647 . 1 1 64 64 VAL N N 15 120.621 0.001 . 1 . . . . 64 VAL N . 16188 1 648 . 1 1 65 65 VAL H H 1 9.125 0.001 . 1 . . . . 65 VAL H . 16188 1 649 . 1 1 65 65 VAL HA H 1 5.348 0.001 . 1 . . . . 65 VAL HA . 16188 1 650 . 1 1 65 65 VAL HB H 1 2.003 0.001 . 1 . . . . 65 VAL HB . 16188 1 651 . 1 1 65 65 VAL HG11 H 1 0.892 0.001 . 2 . . . . 65 VAL QG1 . 16188 1 652 . 1 1 65 65 VAL HG12 H 1 0.892 0.001 . 2 . . . . 65 VAL QG1 . 16188 1 653 . 1 1 65 65 VAL HG13 H 1 0.892 0.001 . 2 . . . . 65 VAL QG1 . 16188 1 654 . 1 1 65 65 VAL HG21 H 1 0.691 0.001 . 2 . . . . 65 VAL QG2 . 16188 1 655 . 1 1 65 65 VAL HG22 H 1 0.691 0.001 . 2 . . . . 65 VAL QG2 . 16188 1 656 . 1 1 65 65 VAL HG23 H 1 0.691 0.001 . 2 . . . . 65 VAL QG2 . 16188 1 657 . 1 1 65 65 VAL C C 13 174.421 0.001 . 1 . . . . 65 VAL C . 16188 1 658 . 1 1 65 65 VAL CA C 13 58.881 0.001 . 1 . . . . 65 VAL CA . 16188 1 659 . 1 1 65 65 VAL CB C 13 36.511 0.001 . 1 . . . . 65 VAL CB . 16188 1 660 . 1 1 65 65 VAL N N 15 117.041 0.001 . 1 . . . . 65 VAL N . 16188 1 661 . 1 1 66 66 ILE H H 1 9.277 0.001 . 1 . . . . 66 ILE H . 16188 1 662 . 1 1 66 66 ILE HA H 1 4.996 0.001 . 1 . . . . 66 ILE HA . 16188 1 663 . 1 1 66 66 ILE HB H 1 2.014 0.001 . 1 . . . . 66 ILE HB . 16188 1 664 . 1 1 66 66 ILE HD11 H 1 0.850 0.001 . 4 . . . . 66 ILE QD1 . 16188 1 665 . 1 1 66 66 ILE HD12 H 1 0.850 0.001 . 4 . . . . 66 ILE QD1 . 16188 1 666 . 1 1 66 66 ILE HD13 H 1 0.850 0.001 . 4 . . . . 66 ILE QD1 . 16188 1 667 . 1 1 66 66 ILE HG12 H 1 1.784 0.001 . 2 . . . . 66 ILE HG12 . 16188 1 668 . 1 1 66 66 ILE HG13 H 1 1.474 0.001 . 2 . . . . 66 ILE HG13 . 16188 1 669 . 1 1 66 66 ILE HG21 H 1 1.117 0.001 . 4 . . . . 66 ILE QG2 . 16188 1 670 . 1 1 66 66 ILE HG22 H 1 1.117 0.001 . 4 . . . . 66 ILE QG2 . 16188 1 671 . 1 1 66 66 ILE HG23 H 1 1.117 0.001 . 4 . . . . 66 ILE QG2 . 16188 1 672 . 1 1 66 66 ILE CA C 13 58.431 0.001 . 1 . . . . 66 ILE CA . 16188 1 673 . 1 1 66 66 ILE N N 15 118.881 0.001 . 1 . . . . 66 ILE N . 16188 1 674 . 1 1 67 67 PRO HA H 1 4.603 0.001 . 1 . . . . 67 PRO HA . 16188 1 675 . 1 1 67 67 PRO HD2 H 1 3.461 0.001 . 2 . . . . 67 PRO HD2 . 16188 1 676 . 1 1 67 67 PRO HD3 H 1 3.461 0.001 . 2 . . . . 67 PRO HD3 . 16188 1 677 . 1 1 67 67 PRO C C 13 179.191 0.001 . 1 . . . . 67 PRO C . 16188 1 678 . 1 1 67 67 PRO CA C 13 63.501 0.001 . 1 . . . . 67 PRO CA . 16188 1 679 . 1 1 67 67 PRO CB C 13 32.631 0.001 . 1 . . . . 67 PRO CB . 16188 1 680 . 1 1 68 68 GLN H H 1 9.119 0.001 . 1 . . . . 68 GLN H . 16188 1 681 . 1 1 68 68 GLN HA H 1 4.797 0.001 . 1 . . . . 68 GLN HA . 16188 1 682 . 1 1 68 68 GLN HB2 H 1 1.993 0.001 . 2 . . . . 68 GLN HB2 . 16188 1 683 . 1 1 68 68 GLN HB3 H 1 1.572 0.001 . 2 . . . . 68 GLN HB3 . 16188 1 684 . 1 1 68 68 GLN HE21 H 1 6.828 0.001 . 2 . . . . 68 GLN HE21 . 16188 1 685 . 1 1 68 68 GLN HE22 H 1 6.525 0.001 . 2 . . . . 68 GLN HE22 . 16188 1 686 . 1 1 68 68 GLN HG2 H 1 2.310 0.001 . 2 . . . . 68 GLN HG2 . 16188 1 687 . 1 1 68 68 GLN HG3 H 1 2.310 0.001 . 2 . . . . 68 GLN HG3 . 16188 1 688 . 1 1 68 68 GLN C C 13 178.721 0.001 . 1 . . . . 68 GLN C . 16188 1 689 . 1 1 68 68 GLN CA C 13 61.021 0.001 . 1 . . . . 68 GLN CA . 16188 1 690 . 1 1 68 68 GLN N N 15 116.111 0.001 . 1 . . . . 68 GLN N . 16188 1 691 . 1 1 68 68 GLN NE2 N 15 109.961 0.001 . 1 . . . . 68 GLN NE2 . 16188 1 692 . 1 1 69 69 VAL H H 1 8.681 0.001 . 1 . . . . 69 VAL H . 16188 1 693 . 1 1 69 69 VAL HA H 1 4.461 0.001 . 1 . . . . 69 VAL HA . 16188 1 694 . 1 1 69 69 VAL HB H 1 2.380 0.001 . 1 . . . . 69 VAL HB . 16188 1 695 . 1 1 69 69 VAL HG11 H 1 1.150 0.001 . 2 . . . . 69 VAL QG1 . 16188 1 696 . 1 1 69 69 VAL HG12 H 1 1.150 0.001 . 2 . . . . 69 VAL QG1 . 16188 1 697 . 1 1 69 69 VAL HG13 H 1 1.150 0.001 . 2 . . . . 69 VAL QG1 . 16188 1 698 . 1 1 69 69 VAL HG21 H 1 1.091 0.001 . 2 . . . . 69 VAL QG2 . 16188 1 699 . 1 1 69 69 VAL HG22 H 1 1.091 0.001 . 2 . . . . 69 VAL QG2 . 16188 1 700 . 1 1 69 69 VAL HG23 H 1 1.091 0.001 . 2 . . . . 69 VAL QG2 . 16188 1 701 . 1 1 69 69 VAL C C 13 175.971 0.001 . 1 . . . . 69 VAL C . 16188 1 702 . 1 1 69 69 VAL N N 15 114.951 0.001 . 1 . . . . 69 VAL N . 16188 1 703 . 1 1 70 70 PHE H H 1 7.500 0.001 . 1 . . . . 70 PHE H . 16188 1 704 . 1 1 70 70 PHE HA H 1 4.701 0.001 . 1 . . . . 70 PHE HA . 16188 1 705 . 1 1 70 70 PHE HB2 H 1 3.183 0.001 . 2 . . . . 70 PHE HB2 . 16188 1 706 . 1 1 70 70 PHE HB3 H 1 2.974 0.001 . 2 . . . . 70 PHE HB3 . 16188 1 707 . 1 1 70 70 PHE HD1 H 1 7.103 0.001 . 3 . . . . 70 PHE QD . 16188 1 708 . 1 1 70 70 PHE HD2 H 1 7.103 0.001 . 3 . . . . 70 PHE QD . 16188 1 709 . 1 1 70 70 PHE HE1 H 1 7.597 0.001 . 3 . . . . 70 PHE QE . 16188 1 710 . 1 1 70 70 PHE HE2 H 1 7.597 0.001 . 3 . . . . 70 PHE QE . 16188 1 711 . 1 1 70 70 PHE HZ H 1 7.348 0.001 . 1 . . . . 70 PHE HZ . 16188 1 712 . 1 1 70 70 PHE C C 13 173.331 0.001 . 1 . . . . 70 PHE C . 16188 1 713 . 1 1 70 70 PHE CA C 13 55.081 0.001 . 1 . . . . 70 PHE CA . 16188 1 714 . 1 1 70 70 PHE N N 15 119.811 0.001 . 1 . . . . 70 PHE N . 16188 1 715 . 1 1 71 71 PHE H H 1 8.435 0.001 . 1 . . . . 71 PHE H . 16188 1 716 . 1 1 71 71 PHE HA H 1 5.640 0.001 . 1 . . . . 71 PHE HA . 16188 1 717 . 1 1 71 71 PHE HB2 H 1 3.447 0.001 . 2 . . . . 71 PHE HB2 . 16188 1 718 . 1 1 71 71 PHE HB3 H 1 3.327 0.001 . 2 . . . . 71 PHE HB3 . 16188 1 719 . 1 1 71 71 PHE HD1 H 1 7.481 0.001 . 3 . . . . 71 PHE QD . 16188 1 720 . 1 1 71 71 PHE HD2 H 1 7.481 0.001 . 3 . . . . 71 PHE QD . 16188 1 721 . 1 1 71 71 PHE HE1 H 1 7.415 0.001 . 3 . . . . 71 PHE QE . 16188 1 722 . 1 1 71 71 PHE HE2 H 1 7.415 0.001 . 3 . . . . 71 PHE QE . 16188 1 723 . 1 1 71 71 PHE HZ H 1 7.314 0.001 . 1 . . . . 71 PHE HZ . 16188 1 724 . 1 1 71 71 PHE C C 13 176.681 0.001 . 1 . . . . 71 PHE C . 16188 1 725 . 1 1 71 71 PHE CA C 13 56.731 0.001 . 1 . . . . 71 PHE CA . 16188 1 726 . 1 1 71 71 PHE CB C 13 42.191 0.001 . 1 . . . . 71 PHE CB . 16188 1 727 . 1 1 71 71 PHE N N 15 117.181 0.001 . 1 . . . . 71 PHE N . 16188 1 728 . 1 1 72 72 THR H H 1 9.604 0.001 . 1 . . . . 72 THR H . 16188 1 729 . 1 1 72 72 THR HA H 1 4.866 0.001 . 1 . . . . 72 THR HA . 16188 1 730 . 1 1 72 72 THR HB H 1 4.965 0.001 . 1 . . . . 72 THR HB . 16188 1 731 . 1 1 72 72 THR HG21 H 1 1.418 0.001 . 1 . . . . 72 THR QG2 . 16188 1 732 . 1 1 72 72 THR HG22 H 1 1.418 0.001 . 1 . . . . 72 THR QG2 . 16188 1 733 . 1 1 72 72 THR HG23 H 1 1.418 0.001 . 1 . . . . 72 THR QG2 . 16188 1 734 . 1 1 72 72 THR C C 13 177.131 0.001 . 1 . . . . 72 THR C . 16188 1 735 . 1 1 72 72 THR CA C 13 60.291 0.001 . 1 . . . . 72 THR CA . 16188 1 736 . 1 1 72 72 THR CB C 13 71.881 0.001 . 1 . . . . 72 THR CB . 16188 1 737 . 1 1 72 72 THR N N 15 111.511 0.001 . 1 . . . . 72 THR N . 16188 1 738 . 1 1 73 73 ASN H H 1 9.223 0.001 . 1 . . . . 73 ASN H . 16188 1 739 . 1 1 73 73 ASN HA H 1 4.756 0.001 . 1 . . . . 73 ASN HA . 16188 1 740 . 1 1 73 73 ASN HB2 H 1 3.129 0.001 . 2 . . . . 73 ASN QB . 16188 1 741 . 1 1 73 73 ASN HB3 H 1 3.129 0.001 . 2 . . . . 73 ASN QB . 16188 1 742 . 1 1 73 73 ASN HD21 H 1 7.811 0.001 . 2 . . . . 73 ASN HD21 . 16188 1 743 . 1 1 73 73 ASN HD22 H 1 7.132 0.001 . 2 . . . . 73 ASN HD22 . 16188 1 744 . 1 1 73 73 ASN C C 13 176.331 0.001 . 1 . . . . 73 ASN C . 16188 1 745 . 1 1 73 73 ASN CA C 13 55.911 0.001 . 1 . . . . 73 ASN CA . 16188 1 746 . 1 1 73 73 ASN CB C 13 38.041 0.001 . 1 . . . . 73 ASN CB . 16188 1 747 . 1 1 73 73 ASN N N 15 119.701 0.001 . 1 . . . . 73 ASN N . 16188 1 748 . 1 1 73 73 ASN ND2 N 15 112.771 0.001 . 1 . . . . 73 ASN ND2 . 16188 1 749 . 1 1 74 74 SER H H 1 8.098 0.001 . 1 . . . . 74 SER H . 16188 1 750 . 1 1 74 74 SER HA H 1 4.759 0.001 . 1 . . . . 74 SER HA . 16188 1 751 . 1 1 74 74 SER HB2 H 1 4.240 0.001 . 2 . . . . 74 SER QB . 16188 1 752 . 1 1 74 74 SER HB3 H 1 4.240 0.001 . 2 . . . . 74 SER QB . 16188 1 753 . 1 1 74 74 SER C C 13 174.981 0.001 . 1 . . . . 74 SER C . 16188 1 754 . 1 1 74 74 SER CA C 13 58.091 0.001 . 1 . . . . 74 SER CA . 16188 1 755 . 1 1 74 74 SER CB C 13 63.931 0.001 . 1 . . . . 74 SER CB . 16188 1 756 . 1 1 74 74 SER N N 15 112.231 0.001 . 1 . . . . 74 SER N . 16188 1 757 . 1 1 75 75 GLY H H 1 8.254 0.001 . 1 . . . . 75 GLY H . 16188 1 758 . 1 1 75 75 GLY HA2 H 1 3.777 0.001 . 2 . . . . 75 GLY HA2 . 16188 1 759 . 1 1 75 75 GLY HA3 H 1 4.291 0.001 . 2 . . . . 75 GLY HA3 . 16188 1 760 . 1 1 75 75 GLY C C 13 171.931 0.001 . 1 . . . . 75 GLY C . 16188 1 761 . 1 1 75 75 GLY CA C 13 46.741 0.001 . 1 . . . . 75 GLY CA . 16188 1 762 . 1 1 75 75 GLY N N 15 111.271 0.001 . 1 . . . . 75 GLY N . 16188 1 763 . 1 1 76 76 GLN H H 1 7.179 0.001 . 1 . . . . 76 GLN H . 16188 1 764 . 1 1 76 76 GLN HA H 1 4.810 0.001 . 1 . . . . 76 GLN HA . 16188 1 765 . 1 1 76 76 GLN HB2 H 1 2.282 0.001 . 2 . . . . 76 GLN HB2 . 16188 1 766 . 1 1 76 76 GLN HB3 H 1 1.939 0.001 . 2 . . . . 76 GLN HB3 . 16188 1 767 . 1 1 76 76 GLN HE21 H 1 7.725 0.001 . 2 . . . . 76 GLN HE21 . 16188 1 768 . 1 1 76 76 GLN HE22 H 1 6.982 0.001 . 2 . . . . 76 GLN HE22 . 16188 1 769 . 1 1 76 76 GLN HG2 H 1 2.456 0.001 . 2 . . . . 76 GLN HG2 . 16188 1 770 . 1 1 76 76 GLN HG3 H 1 2.456 0.001 . 2 . . . . 76 GLN HG3 . 16188 1 771 . 1 1 76 76 GLN C C 13 176.181 0.001 . 1 . . . . 76 GLN C . 16188 1 772 . 1 1 76 76 GLN CA C 13 53.771 0.001 . 1 . . . . 76 GLN CA . 16188 1 773 . 1 1 76 76 GLN CB C 13 29.831 0.001 . 1 . . . . 76 GLN CB . 16188 1 774 . 1 1 76 76 GLN N N 15 113.451 0.001 . 1 . . . . 76 GLN N . 16188 1 775 . 1 1 76 76 GLN NE2 N 15 113.891 0.001 . 1 . . . . 76 GLN NE2 . 16188 1 776 . 1 1 77 77 VAL H H 1 8.681 0.001 . 1 . . . . 77 VAL H . 16188 1 777 . 1 1 77 77 VAL HA H 1 4.092 0.001 . 1 . . . . 77 VAL HA . 16188 1 778 . 1 1 77 77 VAL HB H 1 1.985 0.001 . 1 . . . . 77 VAL HB . 16188 1 779 . 1 1 77 77 VAL HG11 H 1 1.162 0.001 . 2 . . . . 77 VAL QG1 . 16188 1 780 . 1 1 77 77 VAL HG12 H 1 1.162 0.001 . 2 . . . . 77 VAL QG1 . 16188 1 781 . 1 1 77 77 VAL HG13 H 1 1.162 0.001 . 2 . . . . 77 VAL QG1 . 16188 1 782 . 1 1 77 77 VAL HG21 H 1 1.088 0.001 . 2 . . . . 77 VAL QG2 . 16188 1 783 . 1 1 77 77 VAL HG22 H 1 1.088 0.001 . 2 . . . . 77 VAL QG2 . 16188 1 784 . 1 1 77 77 VAL HG23 H 1 1.088 0.001 . 2 . . . . 77 VAL QG2 . 16188 1 785 . 1 1 77 77 VAL C C 13 177.431 0.001 . 1 . . . . 77 VAL C . 16188 1 786 . 1 1 77 77 VAL CA C 13 63.611 0.001 . 1 . . . . 77 VAL CA . 16188 1 787 . 1 1 77 77 VAL N N 15 122.461 0.001 . 1 . . . . 77 VAL N . 16188 1 788 . 1 1 78 78 VAL H H 1 8.564 0.001 . 1 . . . . 78 VAL H . 16188 1 789 . 1 1 78 78 VAL HA H 1 3.828 0.001 . 1 . . . . 78 VAL HA . 16188 1 790 . 1 1 78 78 VAL HB H 1 1.856 0.001 . 1 . . . . 78 VAL HB . 16188 1 791 . 1 1 78 78 VAL HG11 H 1 0.888 0.001 . 2 . . . . 78 VAL QG1 . 16188 1 792 . 1 1 78 78 VAL HG12 H 1 0.888 0.001 . 2 . . . . 78 VAL QG1 . 16188 1 793 . 1 1 78 78 VAL HG13 H 1 0.888 0.001 . 2 . . . . 78 VAL QG1 . 16188 1 794 . 1 1 78 78 VAL HG21 H 1 0.888 0.001 . 2 . . . . 78 VAL QG2 . 16188 1 795 . 1 1 78 78 VAL HG22 H 1 0.888 0.001 . 2 . . . . 78 VAL QG2 . 16188 1 796 . 1 1 78 78 VAL HG23 H 1 0.888 0.001 . 2 . . . . 78 VAL QG2 . 16188 1 797 . 1 1 78 78 VAL C C 13 178.221 0.001 . 1 . . . . 78 VAL C . 16188 1 798 . 1 1 78 78 VAL CA C 13 64.061 0.001 . 1 . . . . 78 VAL CA . 16188 1 799 . 1 1 78 78 VAL CB C 13 32.541 0.001 . 1 . . . . 78 VAL CB . 16188 1 800 . 1 1 78 78 VAL N N 15 128.031 0.001 . 1 . . . . 78 VAL N . 16188 1 801 . 1 1 79 79 LYS H H 1 8.348 0.001 . 1 . . . . 79 LYS H . 16188 1 802 . 1 1 79 79 LYS HA H 1 3.944 0.001 . 1 . . . . 79 LYS HA . 16188 1 803 . 1 1 79 79 LYS HB2 H 1 2.026 0.001 . 2 . . . . 79 LYS HB2 . 16188 1 804 . 1 1 79 79 LYS HB3 H 1 1.971 0.001 . 2 . . . . 79 LYS HB3 . 16188 1 805 . 1 1 79 79 LYS HD2 H 1 1.971 0.001 . 2 . . . . 79 LYS QD . 16188 1 806 . 1 1 79 79 LYS HD3 H 1 1.971 0.001 . 2 . . . . 79 LYS QD . 16188 1 807 . 1 1 79 79 LYS HG2 H 1 1.661 0.001 . 2 . . . . 79 LYS QG . 16188 1 808 . 1 1 79 79 LYS HG3 H 1 1.661 0.001 . 2 . . . . 79 LYS QG . 16188 1 809 . 1 1 79 79 LYS C C 13 178.261 0.001 . 1 . . . . 79 LYS C . 16188 1 810 . 1 1 79 79 LYS CA C 13 59.971 0.001 . 1 . . . . 79 LYS CA . 16188 1 811 . 1 1 79 79 LYS CB C 13 32.811 0.001 . 1 . . . . 79 LYS CB . 16188 1 812 . 1 1 79 79 LYS N N 15 127.011 0.001 . 1 . . . . 79 LYS N . 16188 1 813 . 1 1 80 80 SER H H 1 8.009 0.001 . 1 . . . . 80 SER H . 16188 1 814 . 1 1 80 80 SER HA H 1 4.361 0.001 . 1 . . . . 80 SER HA . 16188 1 815 . 1 1 80 80 SER HB2 H 1 3.840 0.001 . 2 . . . . 80 SER HB2 . 16188 1 816 . 1 1 80 80 SER HB3 H 1 3.840 0.001 . 2 . . . . 80 SER HB3 . 16188 1 817 . 1 1 80 80 SER C C 13 175.391 0.001 . 1 . . . . 80 SER C . 16188 1 818 . 1 1 80 80 SER CA C 13 59.591 0.001 . 1 . . . . 80 SER CA . 16188 1 819 . 1 1 80 80 SER CB C 13 63.291 0.001 . 1 . . . . 80 SER CB . 16188 1 820 . 1 1 80 80 SER N N 15 110.451 0.001 . 1 . . . . 80 SER N . 16188 1 821 . 1 1 81 81 LEU H H 1 7.793 0.001 . 1 . . . . 81 LEU H . 16188 1 822 . 1 1 81 81 LEU HA H 1 4.148 0.001 . 1 . . . . 81 LEU HA . 16188 1 823 . 1 1 81 81 LEU HB2 H 1 1.972 0.001 . 2 . . . . 81 LEU HB2 . 16188 1 824 . 1 1 81 81 LEU HB3 H 1 1.185 0.001 . 2 . . . . 81 LEU HB3 . 16188 1 825 . 1 1 81 81 LEU HD11 H 1 0.403 0.001 . 2 . . . . 81 LEU QD1 . 16188 1 826 . 1 1 81 81 LEU HD12 H 1 0.403 0.001 . 2 . . . . 81 LEU QD1 . 16188 1 827 . 1 1 81 81 LEU HD13 H 1 0.403 0.001 . 2 . . . . 81 LEU QD1 . 16188 1 828 . 1 1 81 81 LEU HD21 H 1 0.194 0.001 . 2 . . . . 81 LEU QD2 . 16188 1 829 . 1 1 81 81 LEU HD22 H 1 0.194 0.001 . 2 . . . . 81 LEU QD2 . 16188 1 830 . 1 1 81 81 LEU HD23 H 1 0.194 0.001 . 2 . . . . 81 LEU QD2 . 16188 1 831 . 1 1 81 81 LEU HG H 1 1.097 0.001 . 1 . . . . 81 LEU HG . 16188 1 832 . 1 1 81 81 LEU CA C 13 59.591 0.001 . 1 . . . . 81 LEU CA . 16188 1 833 . 1 1 81 81 LEU N N 15 121.731 0.001 . 1 . . . . 81 LEU N . 16188 1 834 . 1 1 82 82 PRO HA H 1 3.911 0.001 . 1 . . . . 82 PRO HA . 16188 1 835 . 1 1 82 82 PRO HB2 H 1 1.942 0.001 . 2 . . . . 82 PRO HB2 . 16188 1 836 . 1 1 82 82 PRO HB3 H 1 2.245 0.001 . 2 . . . . 82 PRO HB3 . 16188 1 837 . 1 1 82 82 PRO HD2 H 1 3.781 0.001 . 2 . . . . 82 PRO HD2 . 16188 1 838 . 1 1 82 82 PRO HD3 H 1 3.781 0.001 . 2 . . . . 82 PRO HD3 . 16188 1 839 . 1 1 82 82 PRO HG2 H 1 2.050 0.001 . 2 . . . . 82 PRO HG2 . 16188 1 840 . 1 1 82 82 PRO HG3 H 1 2.050 0.001 . 2 . . . . 82 PRO HG3 . 16188 1 841 . 1 1 82 82 PRO C C 13 179.471 0.001 . 1 . . . . 82 PRO C . 16188 1 842 . 1 1 82 82 PRO CA C 13 67.071 0.001 . 1 . . . . 82 PRO CA . 16188 1 843 . 1 1 82 82 PRO CB C 13 31.011 0.001 . 1 . . . . 82 PRO CB . 16188 1 844 . 1 1 83 83 GLY H H 1 8.453 0.001 . 1 . . . . 83 GLY H . 16188 1 845 . 1 1 83 83 GLY HA2 H 1 3.922 0.001 . 2 . . . . 83 GLY HA2 . 16188 1 846 . 1 1 83 83 GLY HA3 H 1 3.922 0.001 . 2 . . . . 83 GLY HA3 . 16188 1 847 . 1 1 83 83 GLY C C 13 176.571 0.001 . 1 . . . . 83 GLY C . 16188 1 848 . 1 1 83 83 GLY CA C 13 46.851 0.001 . 1 . . . . 83 GLY CA . 16188 1 849 . 1 1 83 83 GLY N N 15 105.511 0.001 . 1 . . . . 83 GLY N . 16188 1 850 . 1 1 84 84 LEU H H 1 7.803 0.001 . 1 . . . . 84 LEU H . 16188 1 851 . 1 1 84 84 LEU HA H 1 4.156 0.001 . 1 . . . . 84 LEU HA . 16188 1 852 . 1 1 84 84 LEU HB2 H 1 2.122 0.001 . 2 . . . . 84 LEU HB2 . 16188 1 853 . 1 1 84 84 LEU HB3 H 1 2.028 0.001 . 2 . . . . 84 LEU HB3 . 16188 1 854 . 1 1 84 84 LEU HD11 H 1 0.980 0.001 . 2 . . . . 84 LEU QD1 . 16188 1 855 . 1 1 84 84 LEU HD12 H 1 0.980 0.001 . 2 . . . . 84 LEU QD1 . 16188 1 856 . 1 1 84 84 LEU HD13 H 1 0.980 0.001 . 2 . . . . 84 LEU QD1 . 16188 1 857 . 1 1 84 84 LEU HD21 H 1 0.400 0.001 . 2 . . . . 84 LEU QD2 . 16188 1 858 . 1 1 84 84 LEU HD22 H 1 0.400 0.001 . 2 . . . . 84 LEU QD2 . 16188 1 859 . 1 1 84 84 LEU HD23 H 1 0.400 0.001 . 2 . . . . 84 LEU QD2 . 16188 1 860 . 1 1 84 84 LEU HG H 1 1.736 0.001 . 1 . . . . 84 LEU HG . 16188 1 861 . 1 1 84 84 LEU C C 13 178.201 0.001 . 1 . . . . 84 LEU C . 16188 1 862 . 1 1 84 84 LEU CA C 13 57.941 0.001 . 1 . . . . 84 LEU CA . 16188 1 863 . 1 1 84 84 LEU CB C 13 42.461 0.001 . 1 . . . . 84 LEU CB . 16188 1 864 . 1 1 84 84 LEU N N 15 123.741 0.001 . 1 . . . . 84 LEU N . 16188 1 865 . 1 1 85 85 LEU H H 1 8.389 0.001 . 1 . . . . 85 LEU H . 16188 1 866 . 1 1 85 85 LEU HA H 1 3.794 0.001 . 1 . . . . 85 LEU HA . 16188 1 867 . 1 1 85 85 LEU HB2 H 1 2.247 0.001 . 2 . . . . 85 LEU HB2 . 16188 1 868 . 1 1 85 85 LEU HB3 H 1 2.021 0.001 . 2 . . . . 85 LEU HB3 . 16188 1 869 . 1 1 85 85 LEU HD11 H 1 0.666 0.001 . 2 . . . . 85 LEU QD1 . 16188 1 870 . 1 1 85 85 LEU HD12 H 1 0.666 0.001 . 2 . . . . 85 LEU QD1 . 16188 1 871 . 1 1 85 85 LEU HD13 H 1 0.666 0.001 . 2 . . . . 85 LEU QD1 . 16188 1 872 . 1 1 85 85 LEU HD21 H 1 0.551 0.001 . 2 . . . . 85 LEU QD2 . 16188 1 873 . 1 1 85 85 LEU HD22 H 1 0.551 0.001 . 2 . . . . 85 LEU QD2 . 16188 1 874 . 1 1 85 85 LEU HD23 H 1 0.551 0.001 . 2 . . . . 85 LEU QD2 . 16188 1 875 . 1 1 85 85 LEU HG H 1 1.812 0.001 . 1 . . . . 85 LEU HG . 16188 1 876 . 1 1 85 85 LEU C C 13 179.121 0.001 . 1 . . . . 85 LEU C . 16188 1 877 . 1 1 85 85 LEU CA C 13 58.091 0.001 . 1 . . . . 85 LEU CA . 16188 1 878 . 1 1 85 85 LEU CB C 13 40.661 0.001 . 1 . . . . 85 LEU CB . 16188 1 879 . 1 1 85 85 LEU N N 15 117.911 0.001 . 1 . . . . 85 LEU N . 16188 1 880 . 1 1 86 86 THR H H 1 8.172 0.001 . 1 . . . . 86 THR H . 16188 1 881 . 1 1 86 86 THR HA H 1 4.249 0.001 . 1 . . . . 86 THR HA . 16188 1 882 . 1 1 86 86 THR HB H 1 4.459 0.001 . 1 . . . . 86 THR HB . 16188 1 883 . 1 1 86 86 THR HG21 H 1 1.423 0.001 . 1 . . . . 86 THR QG2 . 16188 1 884 . 1 1 86 86 THR HG22 H 1 1.423 0.001 . 1 . . . . 86 THR QG2 . 16188 1 885 . 1 1 86 86 THR HG23 H 1 1.423 0.001 . 1 . . . . 86 THR QG2 . 16188 1 886 . 1 1 86 86 THR C C 13 175.861 0.001 . 1 . . . . 86 THR C . 16188 1 887 . 1 1 86 86 THR CA C 13 67.521 0.001 . 1 . . . . 86 THR CA . 16188 1 888 . 1 1 86 86 THR CB C 13 69.611 0.001 . 1 . . . . 86 THR CB . 16188 1 889 . 1 1 86 86 THR N N 15 116.791 0.001 . 1 . . . . 86 THR N . 16188 1 890 . 1 1 87 87 ILE H H 1 7.629 0.001 . 1 . . . . 87 ILE H . 16188 1 891 . 1 1 87 87 ILE HA H 1 3.863 0.001 . 1 . . . . 87 ILE HA . 16188 1 892 . 1 1 87 87 ILE HB H 1 2.003 0.001 . 1 . . . . 87 ILE HB . 16188 1 893 . 1 1 87 87 ILE HD11 H 1 0.767 0.001 . 4 . . . . 87 ILE QD1 . 16188 1 894 . 1 1 87 87 ILE HD12 H 1 0.767 0.001 . 4 . . . . 87 ILE QD1 . 16188 1 895 . 1 1 87 87 ILE HD13 H 1 0.767 0.001 . 4 . . . . 87 ILE QD1 . 16188 1 896 . 1 1 87 87 ILE HG12 H 1 1.905 0.001 . 2 . . . . 87 ILE HG12 . 16188 1 897 . 1 1 87 87 ILE HG13 H 1 1.261 0.001 . 2 . . . . 87 ILE HG13 . 16188 1 898 . 1 1 87 87 ILE HG21 H 1 0.973 0.001 . 4 . . . . 87 ILE QG2 . 16188 1 899 . 1 1 87 87 ILE HG22 H 1 0.973 0.001 . 4 . . . . 87 ILE QG2 . 16188 1 900 . 1 1 87 87 ILE HG23 H 1 0.973 0.001 . 4 . . . . 87 ILE QG2 . 16188 1 901 . 1 1 87 87 ILE C C 13 179.121 0.001 . 1 . . . . 87 ILE C . 16188 1 902 . 1 1 87 87 ILE CA C 13 65.451 0.001 . 1 . . . . 87 ILE CA . 16188 1 903 . 1 1 87 87 ILE CB C 13 38.491 0.001 . 1 . . . . 87 ILE CB . 16188 1 904 . 1 1 87 87 ILE N N 15 121.391 0.001 . 1 . . . . 87 ILE N . 16188 1 905 . 1 1 88 88 LEU H H 1 7.933 0.001 . 1 . . . . 88 LEU H . 16188 1 906 . 1 1 88 88 LEU HA H 1 4.101 0.001 . 1 . . . . 88 LEU HA . 16188 1 907 . 1 1 88 88 LEU HB2 H 1 1.700 0.001 . 2 . . . . 88 LEU HB2 . 16188 1 908 . 1 1 88 88 LEU HB3 H 1 1.560 0.001 . 2 . . . . 88 LEU HB3 . 16188 1 909 . 1 1 88 88 LEU HD11 H 1 0.652 0.001 . 2 . . . . 88 LEU QD1 . 16188 1 910 . 1 1 88 88 LEU HD12 H 1 0.652 0.001 . 2 . . . . 88 LEU QD1 . 16188 1 911 . 1 1 88 88 LEU HD13 H 1 0.652 0.001 . 2 . . . . 88 LEU QD1 . 16188 1 912 . 1 1 88 88 LEU HD21 H 1 0.112 0.001 . 2 . . . . 88 LEU QD2 . 16188 1 913 . 1 1 88 88 LEU HD22 H 1 0.112 0.001 . 2 . . . . 88 LEU QD2 . 16188 1 914 . 1 1 88 88 LEU HD23 H 1 0.112 0.001 . 2 . . . . 88 LEU QD2 . 16188 1 915 . 1 1 88 88 LEU HG H 1 1.109 0.001 . 1 . . . . 88 LEU HG . 16188 1 916 . 1 1 88 88 LEU CA C 13 57.941 0.001 . 1 . . . . 88 LEU CA . 16188 1 917 . 1 1 88 88 LEU CB C 13 42.011 0.001 . 1 . . . . 88 LEU CB . 16188 1 918 . 1 1 88 88 LEU N N 15 118.101 0.001 . 1 . . . . 88 LEU N . 16188 1 919 . 1 1 89 89 HIS H H 1 9.172 0.001 . 1 . . . . 89 HIS H . 16188 1 920 . 1 1 89 89 HIS HA H 1 4.942 0.001 . 1 . . . . 89 HIS HA . 16188 1 921 . 1 1 89 89 HIS HB2 H 1 3.565 0.001 . 2 . . . . 89 HIS HB2 . 16188 1 922 . 1 1 89 89 HIS HB3 H 1 3.490 0.001 . 2 . . . . 89 HIS HB3 . 16188 1 923 . 1 1 89 89 HIS C C 13 180.071 0.001 . 1 . . . . 89 HIS C . 16188 1 924 . 1 1 89 89 HIS CA C 13 59.031 0.001 . 1 . . . . 89 HIS CA . 16188 1 925 . 1 1 89 89 HIS CB C 13 28.571 0.001 . 1 . . . . 89 HIS CB . 16188 1 926 . 1 1 89 89 HIS N N 15 119.601 0.001 . 1 . . . . 89 HIS N . 16188 1 927 . 1 1 90 90 ASP H H 1 9.160 0.001 . 1 . . . . 90 ASP H . 16188 1 928 . 1 1 90 90 ASP HA H 1 4.632 0.001 . 1 . . . . 90 ASP HA . 16188 1 929 . 1 1 90 90 ASP HB2 H 1 2.849 0.001 . 2 . . . . 90 ASP HB2 . 16188 1 930 . 1 1 90 90 ASP HB3 H 1 3.152 0.001 . 2 . . . . 90 ASP HB3 . 16188 1 931 . 1 1 90 90 ASP C C 13 177.711 0.001 . 1 . . . . 90 ASP C . 16188 1 932 . 1 1 90 90 ASP CA C 13 57.041 0.001 . 1 . . . . 90 ASP CA . 16188 1 933 . 1 1 90 90 ASP CB C 13 38.941 0.001 . 1 . . . . 90 ASP CB . 16188 1 934 . 1 1 90 90 ASP N N 15 123.381 0.001 . 1 . . . . 90 ASP N . 16188 1 935 . 1 1 91 91 GLY H H 1 7.901 0.001 . 1 . . . . 91 GLY H . 16188 1 936 . 1 1 91 91 GLY HA2 H 1 3.721 0.001 . 2 . . . . 91 GLY HA2 . 16188 1 937 . 1 1 91 91 GLY HA3 H 1 4.494 0.001 . 2 . . . . 91 GLY HA3 . 16188 1 938 . 1 1 91 91 GLY C C 13 173.521 0.001 . 1 . . . . 91 GLY C . 16188 1 939 . 1 1 91 91 GLY CA C 13 45.541 0.001 . 1 . . . . 91 GLY CA . 16188 1 940 . 1 1 91 91 GLY N N 15 106.111 0.001 . 1 . . . . 91 GLY N . 16188 1 941 . 1 1 92 92 GLY H H 1 7.939 0.001 . 1 . . . . 92 GLY H . 16188 1 942 . 1 1 92 92 GLY HA2 H 1 3.809 0.001 . 2 . . . . 92 GLY HA2 . 16188 1 943 . 1 1 92 92 GLY HA3 H 1 4.308 0.001 . 2 . . . . 92 GLY HA3 . 16188 1 944 . 1 1 92 92 GLY C C 13 174.681 0.001 . 1 . . . . 92 GLY C . 16188 1 945 . 1 1 92 92 GLY CA C 13 45.241 0.001 . 1 . . . . 92 GLY CA . 16188 1 946 . 1 1 92 92 GLY N N 15 106.261 0.001 . 1 . . . . 92 GLY N . 16188 1 947 . 1 1 93 93 TYR H H 1 8.102 0.001 . 1 . . . . 93 TYR H . 16188 1 948 . 1 1 93 93 TYR HA H 1 4.496 0.001 . 1 . . . . 93 TYR HA . 16188 1 949 . 1 1 93 93 TYR HB2 H 1 2.852 0.001 . 2 . . . . 93 TYR HB2 . 16188 1 950 . 1 1 93 93 TYR HB3 H 1 2.729 0.001 . 2 . . . . 93 TYR HB3 . 16188 1 951 . 1 1 93 93 TYR HD1 H 1 7.189 0.001 . 3 . . . . 93 TYR QD . 16188 1 952 . 1 1 93 93 TYR HD2 H 1 7.189 0.001 . 3 . . . . 93 TYR QD . 16188 1 953 . 1 1 93 93 TYR HE1 H 1 6.696 0.001 . 3 . . . . 93 TYR QE . 16188 1 954 . 1 1 93 93 TYR HE2 H 1 6.696 0.001 . 3 . . . . 93 TYR QE . 16188 1 955 . 1 1 93 93 TYR C C 13 176.221 0.001 . 1 . . . . 93 TYR C . 16188 1 956 . 1 1 93 93 TYR CA C 13 59.181 0.001 . 1 . . . . 93 TYR CA . 16188 1 957 . 1 1 93 93 TYR CB C 13 38.761 0.001 . 1 . . . . 93 TYR CB . 16188 1 958 . 1 1 93 93 TYR N N 15 119.941 0.001 . 1 . . . . 93 TYR N . 16188 1 959 . 1 1 94 94 ARG H H 1 9.014 0.001 . 1 . . . . 94 ARG H . 16188 1 960 . 1 1 94 94 ARG HA H 1 4.843 0.001 . 1 . . . . 94 ARG HA . 16188 1 961 . 1 1 94 94 ARG HB2 H 1 2.422 0.001 . 2 . . . . 94 ARG HB2 . 16188 1 962 . 1 1 94 94 ARG HB3 H 1 2.119 0.001 . 2 . . . . 94 ARG HB3 . 16188 1 963 . 1 1 94 94 ARG HD2 H 1 3.436 0.001 . 2 . . . . 94 ARG QD . 16188 1 964 . 1 1 94 94 ARG HD3 H 1 3.436 0.001 . 2 . . . . 94 ARG QD . 16188 1 965 . 1 1 94 94 ARG HE H 1 7.437 0.001 . 1 . . . . 94 ARG HE . 16188 1 966 . 1 1 94 94 ARG HG2 H 1 2.119 0.001 . 2 . . . . 94 ARG HG2 . 16188 1 967 . 1 1 94 94 ARG HG3 H 1 1.963 0.001 . 2 . . . . 94 ARG HG3 . 16188 1 968 . 1 1 94 94 ARG C C 13 177.961 0.001 . 1 . . . . 94 ARG C . 16188 1 969 . 1 1 94 94 ARG CA C 13 54.631 0.001 . 1 . . . . 94 ARG CA . 16188 1 970 . 1 1 94 94 ARG CB C 13 31.641 0.001 . 1 . . . . 94 ARG CB . 16188 1 971 . 1 1 94 94 ARG N N 15 121.881 0.001 . 1 . . . . 94 ARG N . 16188 1 972 . 1 1 94 94 ARG NE N 15 85.371 0.001 . 1 . . . . 94 ARG NE . 16188 1 973 . 1 1 95 95 ASP H H 1 8.862 0.001 . 1 . . . . 95 ASP H . 16188 1 974 . 1 1 95 95 ASP HA H 1 4.546 0.001 . 1 . . . . 95 ASP HA . 16188 1 975 . 1 1 95 95 ASP HB2 H 1 2.700 0.001 . 2 . . . . 95 ASP HB2 . 16188 1 976 . 1 1 95 95 ASP HB3 H 1 2.797 0.001 . 2 . . . . 95 ASP HB3 . 16188 1 977 . 1 1 95 95 ASP C C 13 178.441 0.001 . 1 . . . . 95 ASP C . 16188 1 978 . 1 1 95 95 ASP CA C 13 59.441 0.001 . 1 . . . . 95 ASP CA . 16188 1 979 . 1 1 95 95 ASP CB C 13 40.391 0.001 . 1 . . . . 95 ASP CB . 16188 1 980 . 1 1 95 95 ASP N N 15 121.781 0.001 . 1 . . . . 95 ASP N . 16188 1 981 . 1 1 96 96 THR H H 1 9.008 0.001 . 1 . . . . 96 THR H . 16188 1 982 . 1 1 96 96 THR HA H 1 4.275 0.001 . 1 . . . . 96 THR HA . 16188 1 983 . 1 1 96 96 THR HB H 1 4.037 0.001 . 1 . . . . 96 THR HB . 16188 1 984 . 1 1 96 96 THR HG21 H 1 1.464 0.001 . 1 . . . . 96 THR QG2 . 16188 1 985 . 1 1 96 96 THR HG22 H 1 1.464 0.001 . 1 . . . . 96 THR QG2 . 16188 1 986 . 1 1 96 96 THR HG23 H 1 1.464 0.001 . 1 . . . . 96 THR QG2 . 16188 1 987 . 1 1 96 96 THR C C 13 175.531 0.001 . 1 . . . . 96 THR C . 16188 1 988 . 1 1 96 96 THR CA C 13 68.201 0.001 . 1 . . . . 96 THR CA . 16188 1 989 . 1 1 96 96 THR N N 15 116.111 0.001 . 1 . . . . 96 THR N . 16188 1 990 . 1 1 97 97 GLU H H 1 7.481 0.001 . 1 . . . . 97 GLU H . 16188 1 991 . 1 1 97 97 GLU HA H 1 4.273 0.001 . 1 . . . . 97 GLU HA . 16188 1 992 . 1 1 97 97 GLU HB2 H 1 2.509 0.001 . 2 . . . . 97 GLU HB2 . 16188 1 993 . 1 1 97 97 GLU HB3 H 1 2.277 0.001 . 2 . . . . 97 GLU HB3 . 16188 1 994 . 1 1 97 97 GLU HG2 H 1 2.635 0.001 . 2 . . . . 97 GLU HG2 . 16188 1 995 . 1 1 97 97 GLU HG3 H 1 2.509 0.001 . 2 . . . . 97 GLU HG3 . 16188 1 996 . 1 1 97 97 GLU C C 13 179.861 0.001 . 1 . . . . 97 GLU C . 16188 1 997 . 1 1 97 97 GLU CA C 13 59.571 0.001 . 1 . . . . 97 GLU CA . 16188 1 998 . 1 1 97 97 GLU N N 15 119.751 0.001 . 1 . . . . 97 GLU N . 16188 1 999 . 1 1 98 98 ILE H H 1 8.581 0.001 . 1 . . . . 98 ILE H . 16188 1 1000 . 1 1 98 98 ILE HA H 1 3.692 0.001 . 1 . . . . 98 ILE HA . 16188 1 1001 . 1 1 98 98 ILE HB H 1 2.164 0.001 . 1 . . . . 98 ILE HB . 16188 1 1002 . 1 1 98 98 ILE HD11 H 1 0.789 0.001 . 4 . . . . 98 ILE QD1 . 16188 1 1003 . 1 1 98 98 ILE HD12 H 1 0.789 0.001 . 4 . . . . 98 ILE QD1 . 16188 1 1004 . 1 1 98 98 ILE HD13 H 1 0.789 0.001 . 4 . . . . 98 ILE QD1 . 16188 1 1005 . 1 1 98 98 ILE HG12 H 1 1.168 0.001 . 2 . . . . 98 ILE HG12 . 16188 1 1006 . 1 1 98 98 ILE HG13 H 1 0.937 0.001 . 2 . . . . 98 ILE HG13 . 16188 1 1007 . 1 1 98 98 ILE HG21 H 1 0.608 0.001 . 4 . . . . 98 ILE QG2 . 16188 1 1008 . 1 1 98 98 ILE HG22 H 1 0.608 0.001 . 4 . . . . 98 ILE QG2 . 16188 1 1009 . 1 1 98 98 ILE HG23 H 1 0.608 0.001 . 4 . . . . 98 ILE QG2 . 16188 1 1010 . 1 1 98 98 ILE C C 13 177.361 0.001 . 1 . . . . 98 ILE C . 16188 1 1011 . 1 1 98 98 ILE CA C 13 66.901 0.001 . 1 . . . . 98 ILE CA . 16188 1 1012 . 1 1 98 98 ILE N N 15 121.491 0.001 . 1 . . . . 98 ILE N . 16188 1 1013 . 1 1 99 99 MET H H 1 8.564 0.001 . 1 . . . . 99 MET H . 16188 1 1014 . 1 1 99 99 MET HA H 1 4.561 0.001 . 1 . . . . 99 MET HA . 16188 1 1015 . 1 1 99 99 MET HB2 H 1 2.471 0.001 . 2 . . . . 99 MET HB2 . 16188 1 1016 . 1 1 99 99 MET HB3 H 1 2.155 0.001 . 2 . . . . 99 MET HB3 . 16188 1 1017 . 1 1 99 99 MET HE1 H 1 2.050 0.001 . 1 . . . . 99 MET QE . 16188 1 1018 . 1 1 99 99 MET HE2 H 1 2.050 0.001 . 1 . . . . 99 MET QE . 16188 1 1019 . 1 1 99 99 MET HE3 H 1 2.050 0.001 . 1 . . . . 99 MET QE . 16188 1 1020 . 1 1 99 99 MET HG2 H 1 2.824 0.001 . 2 . . . . 99 MET HG2 . 16188 1 1021 . 1 1 99 99 MET HG3 H 1 2.426 0.001 . 2 . . . . 99 MET HG3 . 16188 1 1022 . 1 1 99 99 MET C C 13 177.991 0.001 . 1 . . . . 99 MET C . 16188 1 1023 . 1 1 99 99 MET CA C 13 57.941 0.001 . 1 . . . . 99 MET CA . 16188 1 1024 . 1 1 99 99 MET CB C 13 32.451 0.001 . 1 . . . . 99 MET CB . 16188 1 1025 . 1 1 99 99 MET N N 15 117.961 0.001 . 1 . . . . 99 MET N . 16188 1 1026 . 1 1 100 100 ARG H H 1 8.494 0.001 . 1 . . . . 100 ARG H . 16188 1 1027 . 1 1 100 100 ARG HA H 1 4.090 0.001 . 1 . . . . 100 ARG HA . 16188 1 1028 . 1 1 100 100 ARG HB2 H 1 2.095 0.001 . 2 . . . . 100 ARG HB2 . 16188 1 1029 . 1 1 100 100 ARG HB3 H 1 1.957 0.001 . 2 . . . . 100 ARG HB3 . 16188 1 1030 . 1 1 100 100 ARG HD2 H 1 3.432 0.001 . 2 . . . . 100 ARG QD . 16188 1 1031 . 1 1 100 100 ARG HD3 H 1 3.432 0.001 . 2 . . . . 100 ARG QD . 16188 1 1032 . 1 1 100 100 ARG HE H 1 7.622 0.001 . 1 . . . . 100 ARG HE . 16188 1 1033 . 1 1 100 100 ARG HG2 H 1 1.957 0.001 . 2 . . . . 100 ARG HG2 . 16188 1 1034 . 1 1 100 100 ARG HG3 H 1 1.746 0.001 . 2 . . . . 100 ARG HG3 . 16188 1 1035 . 1 1 100 100 ARG C C 13 174.291 0.001 . 1 . . . . 100 ARG C . 16188 1 1036 . 1 1 100 100 ARG CB C 13 32.631 0.001 . 1 . . . . 100 ARG CB . 16188 1 1037 . 1 1 100 100 ARG N N 15 117.621 0.001 . 1 . . . . 100 ARG N . 16188 1 1038 . 1 1 100 100 ARG NE N 15 84.201 0.001 . 1 . . . . 100 ARG NE . 16188 1 1039 . 1 1 101 101 TRP H H 1 8.488 0.001 . 1 . . . . 101 TRP H . 16188 1 1040 . 1 1 101 101 TRP HA H 1 4.298 0.001 . 1 . . . . 101 TRP HA . 16188 1 1041 . 1 1 101 101 TRP HB2 H 1 3.435 0.001 . 2 . . . . 101 TRP HB2 . 16188 1 1042 . 1 1 101 101 TRP HB3 H 1 3.494 0.001 . 2 . . . . 101 TRP HB3 . 16188 1 1043 . 1 1 101 101 TRP HD1 H 1 7.416 0.001 . 1 . . . . 101 TRP HD1 . 16188 1 1044 . 1 1 101 101 TRP HE1 H 1 10.131 0.001 . 1 . . . . 101 TRP HE1 . 16188 1 1045 . 1 1 101 101 TRP HE3 H 1 6.717 0.001 . 1 . . . . 101 TRP HE3 . 16188 1 1046 . 1 1 101 101 TRP HH2 H 1 7.171 0.001 . 1 . . . . 101 TRP HH2 . 16188 1 1047 . 1 1 101 101 TRP HZ2 H 1 7.309 0.001 . 1 . . . . 101 TRP HZ2 . 16188 1 1048 . 1 1 101 101 TRP HZ3 H 1 7.336 0.001 . 1 . . . . 101 TRP HZ3 . 16188 1 1049 . 1 1 101 101 TRP C C 13 178.911 0.001 . 1 . . . . 101 TRP C . 16188 1 1050 . 1 1 101 101 TRP CA C 13 63.181 0.001 . 1 . . . . 101 TRP CA . 16188 1 1051 . 1 1 101 101 TRP CB C 13 28.031 0.001 . 1 . . . . 101 TRP CB . 16188 1 1052 . 1 1 101 101 TRP N N 15 121.931 0.001 . 1 . . . . 101 TRP N . 16188 1 1053 . 1 1 101 101 TRP NE1 N 15 131.371 0.001 . 1 . . . . 101 TRP NE1 . 16188 1 1054 . 1 1 102 102 LEU H H 1 8.868 0.001 . 1 . . . . 102 LEU H . 16188 1 1055 . 1 1 102 102 LEU HA H 1 3.406 0.001 . 1 . . . . 102 LEU HA . 16188 1 1056 . 1 1 102 102 LEU HB2 H 1 2.442 0.001 . 2 . . . . 102 LEU HB2 . 16188 1 1057 . 1 1 102 102 LEU HB3 H 1 2.204 0.001 . 2 . . . . 102 LEU HB3 . 16188 1 1058 . 1 1 102 102 LEU HD11 H 1 0.967 0.001 . 2 . . . . 102 LEU QD1 . 16188 1 1059 . 1 1 102 102 LEU HD12 H 1 0.967 0.001 . 2 . . . . 102 LEU QD1 . 16188 1 1060 . 1 1 102 102 LEU HD13 H 1 0.967 0.001 . 2 . . . . 102 LEU QD1 . 16188 1 1061 . 1 1 102 102 LEU HD21 H 1 0.677 0.001 . 2 . . . . 102 LEU QD2 . 16188 1 1062 . 1 1 102 102 LEU HD22 H 1 0.677 0.001 . 2 . . . . 102 LEU QD2 . 16188 1 1063 . 1 1 102 102 LEU HD23 H 1 0.677 0.001 . 2 . . . . 102 LEU QD2 . 16188 1 1064 . 1 1 102 102 LEU HG H 1 1.099 0.001 . 1 . . . . 102 LEU HG . 16188 1 1065 . 1 1 102 102 LEU C C 13 176.891 0.001 . 1 . . . . 102 LEU C . 16188 1 1066 . 1 1 102 102 LEU CA C 13 57.671 0.001 . 1 . . . . 102 LEU CA . 16188 1 1067 . 1 1 102 102 LEU CB C 13 43.991 0.001 . 1 . . . . 102 LEU CB . 16188 1 1068 . 1 1 102 102 LEU N N 15 116.601 0.001 . 1 . . . . 102 LEU N . 16188 1 1069 . 1 1 103 103 PHE H H 1 7.547 0.001 . 1 . . . . 103 PHE H . 16188 1 1070 . 1 1 103 103 PHE HA H 1 4.216 0.001 . 1 . . . . 103 PHE HA . 16188 1 1071 . 1 1 103 103 PHE HB2 H 1 3.574 0.001 . 2 . . . . 103 PHE HB2 . 16188 1 1072 . 1 1 103 103 PHE HB3 H 1 2.909 0.001 . 2 . . . . 103 PHE HB3 . 16188 1 1073 . 1 1 103 103 PHE HD1 H 1 7.775 0.001 . 3 . . . . 103 PHE QD . 16188 1 1074 . 1 1 103 103 PHE HD2 H 1 7.775 0.001 . 3 . . . . 103 PHE QD . 16188 1 1075 . 1 1 103 103 PHE HE1 H 1 7.329 0.001 . 3 . . . . 103 PHE QE . 16188 1 1076 . 1 1 103 103 PHE HE2 H 1 7.329 0.001 . 3 . . . . 103 PHE QE . 16188 1 1077 . 1 1 103 103 PHE HZ H 1 6.604 0.001 . 1 . . . . 103 PHE HZ . 16188 1 1078 . 1 1 103 103 PHE C C 13 174.661 0.001 . 1 . . . . 103 PHE C . 16188 1 1079 . 1 1 103 103 PHE CA C 13 59.441 0.001 . 1 . . . . 103 PHE CA . 16188 1 1080 . 1 1 103 103 PHE CB C 13 38.851 0.001 . 1 . . . . 103 PHE CB . 16188 1 1081 . 1 1 103 103 PHE N N 15 111.131 0.001 . 1 . . . . 103 PHE N . 16188 1 1082 . 1 1 104 104 THR H H 1 7.383 0.001 . 1 . . . . 104 THR H . 16188 1 1083 . 1 1 104 104 THR HA H 1 4.906 0.001 . 1 . . . . 104 THR HA . 16188 1 1084 . 1 1 104 104 THR HB H 1 4.251 0.001 . 1 . . . . 104 THR HB . 16188 1 1085 . 1 1 104 104 THR HG21 H 1 1.449 0.001 . 1 . . . . 104 THR QG2 . 16188 1 1086 . 1 1 104 104 THR HG22 H 1 1.449 0.001 . 1 . . . . 104 THR QG2 . 16188 1 1087 . 1 1 104 104 THR HG23 H 1 1.449 0.001 . 1 . . . . 104 THR QG2 . 16188 1 1088 . 1 1 104 104 THR CA C 13 61.661 0.001 . 1 . . . . 104 THR CA . 16188 1 1089 . 1 1 104 104 THR N N 15 120.281 0.001 . 1 . . . . 104 THR N . 16188 1 1090 . 1 1 105 105 PRO HA H 1 3.807 0.001 . 1 . . . . 105 PRO HA . 16188 1 1091 . 1 1 105 105 PRO HB2 H 1 2.382 0.001 . 2 . . . . 105 PRO HB2 . 16188 1 1092 . 1 1 105 105 PRO HB3 H 1 1.848 0.001 . 2 . . . . 105 PRO HB3 . 16188 1 1093 . 1 1 105 105 PRO HD2 H 1 3.906 0.001 . 2 . . . . 105 PRO HD2 . 16188 1 1094 . 1 1 105 105 PRO HD3 H 1 3.831 0.001 . 2 . . . . 105 PRO HD3 . 16188 1 1095 . 1 1 105 105 PRO HG2 H 1 1.951 0.001 . 2 . . . . 105 PRO HG2 . 16188 1 1096 . 1 1 105 105 PRO HG3 H 1 1.951 0.001 . 2 . . . . 105 PRO HG3 . 16188 1 1097 . 1 1 105 105 PRO CA C 13 64.031 0.001 . 1 . . . . 105 PRO CA . 16188 1 1098 . 1 1 105 105 PRO CB C 13 32.541 0.001 . 1 . . . . 105 PRO CB . 16188 1 1099 . 1 1 106 106 ASP H H 1 8.307 0.001 . 1 . . . . 106 ASP H . 16188 1 1100 . 1 1 106 106 ASP HA H 1 5.288 0.001 . 1 . . . . 106 ASP HA . 16188 1 1101 . 1 1 106 106 ASP HB2 H 1 2.470 0.001 . 2 . . . . 106 ASP HB2 . 16188 1 1102 . 1 1 106 106 ASP HB3 H 1 3.127 0.001 . 2 . . . . 106 ASP HB3 . 16188 1 1103 . 1 1 106 106 ASP N N 15 124.541 0.001 . 1 . . . . 106 ASP N . 16188 1 1104 . 1 1 107 107 PRO HA H 1 3.992 0.001 . 1 . . . . 107 PRO HA . 16188 1 1105 . 1 1 107 107 PRO HB2 H 1 2.148 0.001 . 2 . . . . 107 PRO HB2 . 16188 1 1106 . 1 1 107 107 PRO HB3 H 1 1.972 0.001 . 2 . . . . 107 PRO HB3 . 16188 1 1107 . 1 1 107 107 PRO HD2 H 1 4.098 0.001 . 2 . . . . 107 PRO HD2 . 16188 1 1108 . 1 1 107 107 PRO HD3 H 1 3.929 0.001 . 2 . . . . 107 PRO HD3 . 16188 1 1109 . 1 1 107 107 PRO HG2 H 1 2.148 0.001 . 2 . . . . 107 PRO HG2 . 16188 1 1110 . 1 1 107 107 PRO HG3 H 1 1.972 0.001 . 2 . . . . 107 PRO HG3 . 16188 1 1111 . 1 1 107 107 PRO C C 13 177.791 0.001 . 1 . . . . 107 PRO C . 16188 1 1112 . 1 1 107 107 PRO CA C 13 64.591 0.001 . 1 . . . . 107 PRO CA . 16188 1 1113 . 1 1 107 107 PRO CB C 13 32.811 0.001 . 1 . . . . 107 PRO CB . 16188 1 1114 . 1 1 108 108 SER H H 1 8.839 0.001 . 1 . . . . 108 SER H . 16188 1 1115 . 1 1 108 108 SER HA H 1 4.591 0.001 . 1 . . . . 108 SER HA . 16188 1 1116 . 1 1 108 108 SER HB2 H 1 4.194 0.001 . 2 . . . . 108 SER HB2 . 16188 1 1117 . 1 1 108 108 SER HB3 H 1 4.094 0.001 . 2 . . . . 108 SER HB3 . 16188 1 1118 . 1 1 108 108 SER C C 13 174.231 0.001 . 1 . . . . 108 SER C . 16188 1 1119 . 1 1 108 108 SER CA C 13 59.061 0.001 . 1 . . . . 108 SER CA . 16188 1 1120 . 1 1 108 108 SER CB C 13 64.831 0.001 . 1 . . . . 108 SER CB . 16188 1 1121 . 1 1 108 108 SER N N 15 113.501 0.001 . 1 . . . . 108 SER N . 16188 1 1122 . 1 1 109 109 LEU H H 1 8.260 0.001 . 1 . . . . 109 LEU H . 16188 1 1123 . 1 1 109 109 LEU HA H 1 4.618 0.001 . 1 . . . . 109 LEU HA . 16188 1 1124 . 1 1 109 109 LEU HB2 H 1 1.966 0.001 . 2 . . . . 109 LEU HB2 . 16188 1 1125 . 1 1 109 109 LEU HB3 H 1 1.515 0.001 . 2 . . . . 109 LEU HB3 . 16188 1 1126 . 1 1 109 109 LEU HD11 H 1 0.787 0.001 . 2 . . . . 109 LEU QD1 . 16188 1 1127 . 1 1 109 109 LEU HD12 H 1 0.787 0.001 . 2 . . . . 109 LEU QD1 . 16188 1 1128 . 1 1 109 109 LEU HD13 H 1 0.787 0.001 . 2 . . . . 109 LEU QD1 . 16188 1 1129 . 1 1 109 109 LEU HD21 H 1 0.657 0.001 . 2 . . . . 109 LEU QD2 . 16188 1 1130 . 1 1 109 109 LEU HD22 H 1 0.657 0.001 . 2 . . . . 109 LEU QD2 . 16188 1 1131 . 1 1 109 109 LEU HD23 H 1 0.657 0.001 . 2 . . . . 109 LEU QD2 . 16188 1 1132 . 1 1 109 109 LEU HG H 1 1.411 0.001 . 1 . . . . 109 LEU HG . 16188 1 1133 . 1 1 109 109 LEU C C 13 174.771 0.001 . 1 . . . . 109 LEU C . 16188 1 1134 . 1 1 109 109 LEU CA C 13 54.631 0.001 . 1 . . . . 109 LEU CA . 16188 1 1135 . 1 1 109 109 LEU N N 15 127.841 0.001 . 1 . . . . 109 LEU N . 16188 1 1136 . 1 1 110 110 THR H H 1 8.275 0.001 . 1 . . . . 110 THR H . 16188 1 1137 . 1 1 110 110 THR HA H 1 5.147 0.001 . 1 . . . . 110 THR HA . 16188 1 1138 . 1 1 110 110 THR HB H 1 4.029 0.001 . 1 . . . . 110 THR HB . 16188 1 1139 . 1 1 110 110 THR HG21 H 1 1.142 0.001 . 1 . . . . 110 THR QG2 . 16188 1 1140 . 1 1 110 110 THR HG22 H 1 1.142 0.001 . 1 . . . . 110 THR QG2 . 16188 1 1141 . 1 1 110 110 THR HG23 H 1 1.142 0.001 . 1 . . . . 110 THR QG2 . 16188 1 1142 . 1 1 110 110 THR C C 13 174.381 0.001 . 1 . . . . 110 THR C . 16188 1 1143 . 1 1 110 110 THR CA C 13 60.761 0.001 . 1 . . . . 110 THR CA . 16188 1 1144 . 1 1 110 110 THR CB C 13 70.961 0.001 . 1 . . . . 110 THR CB . 16188 1 1145 . 1 1 110 110 THR N N 15 120.621 0.001 . 1 . . . . 110 THR N . 16188 1 1146 . 1 1 111 111 ILE H H 1 8.693 0.001 . 1 . . . . 111 ILE H . 16188 1 1147 . 1 1 111 111 ILE HA H 1 4.696 0.001 . 1 . . . . 111 ILE HA . 16188 1 1148 . 1 1 111 111 ILE HB H 1 1.881 0.001 . 1 . . . . 111 ILE HB . 16188 1 1149 . 1 1 111 111 ILE HD11 H 1 0.721 0.001 . 4 . . . . 111 ILE QD1 . 16188 1 1150 . 1 1 111 111 ILE HD12 H 1 0.721 0.001 . 4 . . . . 111 ILE QD1 . 16188 1 1151 . 1 1 111 111 ILE HD13 H 1 0.721 0.001 . 4 . . . . 111 ILE QD1 . 16188 1 1152 . 1 1 111 111 ILE HG12 H 1 1.377 0.001 . 2 . . . . 111 ILE HG12 . 16188 1 1153 . 1 1 111 111 ILE HG13 H 1 1.002 0.001 . 2 . . . . 111 ILE HG13 . 16188 1 1154 . 1 1 111 111 ILE HG21 H 1 0.808 0.001 . 4 . . . . 111 ILE QG2 . 16188 1 1155 . 1 1 111 111 ILE HG22 H 1 0.808 0.001 . 4 . . . . 111 ILE QG2 . 16188 1 1156 . 1 1 111 111 ILE HG23 H 1 0.808 0.001 . 4 . . . . 111 ILE QG2 . 16188 1 1157 . 1 1 111 111 ILE C C 13 175.221 0.001 . 1 . . . . 111 ILE C . 16188 1 1158 . 1 1 111 111 ILE CA C 13 59.481 0.001 . 1 . . . . 111 ILE CA . 16188 1 1159 . 1 1 111 111 ILE CB C 13 41.111 0.001 . 1 . . . . 111 ILE CB . 16188 1 1160 . 1 1 111 111 ILE N N 15 120.811 0.001 . 1 . . . . 111 ILE N . 16188 1 1161 . 1 1 112 112 THR H H 1 8.704 0.001 . 1 . . . . 112 THR H . 16188 1 1162 . 1 1 112 112 THR HA H 1 4.677 0.001 . 1 . . . . 112 THR HA . 16188 1 1163 . 1 1 112 112 THR HB H 1 4.279 0.001 . 1 . . . . 112 THR HB . 16188 1 1164 . 1 1 112 112 THR HG21 H 1 1.236 0.001 . 1 . . . . 112 THR QG2 . 16188 1 1165 . 1 1 112 112 THR HG22 H 1 1.236 0.001 . 1 . . . . 112 THR QG2 . 16188 1 1166 . 1 1 112 112 THR HG23 H 1 1.236 0.001 . 1 . . . . 112 THR QG2 . 16188 1 1167 . 1 1 112 112 THR C C 13 174.611 0.001 . 1 . . . . 112 THR C . 16188 1 1168 . 1 1 112 112 THR CA C 13 61.471 0.001 . 1 . . . . 112 THR CA . 16188 1 1169 . 1 1 112 112 THR CB C 13 70.331 0.001 . 1 . . . . 112 THR CB . 16188 1 1170 . 1 1 112 112 THR N N 15 117.181 0.001 . 1 . . . . 112 THR N . 16188 1 1171 . 1 1 113 113 ARG H H 1 8.856 0.001 . 1 . . . . 113 ARG H . 16188 1 1172 . 1 1 113 113 ARG HA H 1 4.471 0.001 . 1 . . . . 113 ARG HA . 16188 1 1173 . 1 1 113 113 ARG HB2 H 1 1.943 0.001 . 2 . . . . 113 ARG HB2 . 16188 1 1174 . 1 1 113 113 ARG HB3 H 1 1.845 0.001 . 2 . . . . 113 ARG HB3 . 16188 1 1175 . 1 1 113 113 ARG HD2 H 1 3.301 0.001 . 2 . . . . 113 ARG QD . 16188 1 1176 . 1 1 113 113 ARG HD3 H 1 3.301 0.001 . 2 . . . . 113 ARG QD . 16188 1 1177 . 1 1 113 113 ARG HE H 1 7.321 0.001 . 1 . . . . 113 ARG HE . 16188 1 1178 . 1 1 113 113 ARG HG2 H 1 1.845 0.001 . 2 . . . . 113 ARG HG2 . 16188 1 1179 . 1 1 113 113 ARG HG3 H 1 1.720 0.001 . 2 . . . . 113 ARG HG3 . 16188 1 1180 . 1 1 113 113 ARG C C 13 175.991 0.001 . 1 . . . . 113 ARG C . 16188 1 1181 . 1 1 113 113 ARG CA C 13 56.101 0.001 . 1 . . . . 113 ARG CA . 16188 1 1182 . 1 1 113 113 ARG CB C 13 31.911 0.001 . 1 . . . . 113 ARG CB . 16188 1 1183 . 1 1 113 113 ARG N N 15 123.671 0.001 . 1 . . . . 113 ARG N . 16188 1 1184 . 1 1 113 113 ARG NE N 15 84.911 0.001 . 1 . . . . 113 ARG NE . 16188 1 1185 . 1 1 114 114 ASP H H 1 8.628 0.001 . 1 . . . . 114 ASP H . 16188 1 1186 . 1 1 114 114 ASP HA H 1 4.643 0.001 . 1 . . . . 114 ASP HA . 16188 1 1187 . 1 1 114 114 ASP HB2 H 1 2.805 0.001 . 2 . . . . 114 ASP HB2 . 16188 1 1188 . 1 1 114 114 ASP HB3 H 1 2.805 0.001 . 2 . . . . 114 ASP HB3 . 16188 1 1189 . 1 1 114 114 ASP C C 13 177.081 0.001 . 1 . . . . 114 ASP C . 16188 1 1190 . 1 1 114 114 ASP CA C 13 55.161 0.001 . 1 . . . . 114 ASP CA . 16188 1 1191 . 1 1 114 114 ASP CB C 13 41.111 0.001 . 1 . . . . 114 ASP CB . 16188 1 1192 . 1 1 114 114 ASP N N 15 122.651 0.001 . 1 . . . . 114 ASP N . 16188 1 1193 . 1 1 115 115 GLY H H 1 8.786 0.001 . 1 . . . . 115 GLY H . 16188 1 1194 . 1 1 115 115 GLY HA2 H 1 3.894 0.001 . 2 . . . . 115 GLY HA2 . 16188 1 1195 . 1 1 115 115 GLY HA3 H 1 4.248 0.001 . 2 . . . . 115 GLY HA3 . 16188 1 1196 . 1 1 115 115 GLY C C 13 174.421 0.001 . 1 . . . . 115 GLY C . 16188 1 1197 . 1 1 115 115 GLY CA C 13 46.141 0.001 . 1 . . . . 115 GLY CA . 16188 1 1198 . 1 1 115 115 GLY N N 15 111.221 0.001 . 1 . . . . 115 GLY N . 16188 1 1199 . 1 1 116 116 SER H H 1 8.196 0.001 . 1 . . . . 116 SER H . 16188 1 1200 . 1 1 116 116 SER HA H 1 4.717 0.001 . 1 . . . . 116 SER HA . 16188 1 1201 . 1 1 116 116 SER HB2 H 1 4.025 0.001 . 2 . . . . 116 SER HB2 . 16188 1 1202 . 1 1 116 116 SER HB3 H 1 3.959 0.001 . 2 . . . . 116 SER HB3 . 16188 1 1203 . 1 1 116 116 SER C C 13 174.321 0.001 . 1 . . . . 116 SER C . 16188 1 1204 . 1 1 116 116 SER CA C 13 57.941 0.001 . 1 . . . . 116 SER CA . 16188 1 1205 . 1 1 116 116 SER CB C 13 64.651 0.001 . 1 . . . . 116 SER CB . 16188 1 1206 . 1 1 116 116 SER N N 15 115.781 0.001 . 1 . . . . 116 SER N . 16188 1 1207 . 1 1 117 117 ARG H H 1 8.523 0.001 . 1 . . . . 117 ARG H . 16188 1 1208 . 1 1 117 117 ARG HA H 1 4.498 0.001 . 1 . . . . 117 ARG HA . 16188 1 1209 . 1 1 117 117 ARG HB2 H 1 2.068 0.001 . 2 . . . . 117 ARG HB2 . 16188 1 1210 . 1 1 117 117 ARG HB3 H 1 1.912 0.001 . 2 . . . . 117 ARG HB3 . 16188 1 1211 . 1 1 117 117 ARG HD2 H 1 3.334 0.001 . 2 . . . . 117 ARG QD . 16188 1 1212 . 1 1 117 117 ARG HD3 H 1 3.334 0.001 . 2 . . . . 117 ARG QD . 16188 1 1213 . 1 1 117 117 ARG HG2 H 1 1.912 0.001 . 2 . . . . 117 ARG HG2 . 16188 1 1214 . 1 1 117 117 ARG HG3 H 1 1.777 0.001 . 2 . . . . 117 ARG HG3 . 16188 1 1215 . 1 1 117 117 ARG C C 13 175.991 0.001 . 1 . . . . 117 ARG C . 16188 1 1216 . 1 1 117 117 ARG CA C 13 56.461 0.001 . 1 . . . . 117 ARG CA . 16188 1 1217 . 1 1 117 117 ARG CB C 13 30.831 0.001 . 1 . . . . 117 ARG CB . 16188 1 1218 . 1 1 117 117 ARG N N 15 122.221 0.001 . 1 . . . . 117 ARG N . 16188 1 1219 . 1 1 118 118 ASP H H 1 8.266 0.001 . 1 . . . . 118 ASP H . 16188 1 1220 . 1 1 118 118 ASP HA H 1 4.736 0.001 . 1 . . . . 118 ASP HA . 16188 1 1221 . 1 1 118 118 ASP HB2 H 1 2.635 0.001 . 2 . . . . 118 ASP HB2 . 16188 1 1222 . 1 1 118 118 ASP HB3 H 1 2.789 0.001 . 2 . . . . 118 ASP HB3 . 16188 1 1223 . 1 1 118 118 ASP C C 13 175.191 0.001 . 1 . . . . 118 ASP C . 16188 1 1224 . 1 1 118 118 ASP CA C 13 54.031 0.001 . 1 . . . . 118 ASP CA . 16188 1 1225 . 1 1 118 118 ASP CB C 13 41.561 0.001 . 1 . . . . 118 ASP CB . 16188 1 1226 . 1 1 118 118 ASP N N 15 120.281 0.001 . 1 . . . . 118 ASP N . 16188 1 1227 . 1 1 119 119 ALA H H 1 8.441 0.001 . 1 . . . . 119 ALA H . 16188 1 1228 . 1 1 119 119 ALA HA H 1 4.653 0.001 . 1 . . . . 119 ALA HA . 16188 1 1229 . 1 1 119 119 ALA HB1 H 1 1.375 0.001 . 1 . . . . 119 ALA QB . 16188 1 1230 . 1 1 119 119 ALA HB2 H 1 1.375 0.001 . 1 . . . . 119 ALA QB . 16188 1 1231 . 1 1 119 119 ALA HB3 H 1 1.375 0.001 . 1 . . . . 119 ALA QB . 16188 1 1232 . 1 1 119 119 ALA C C 13 177.601 0.001 . 1 . . . . 119 ALA C . 16188 1 1233 . 1 1 119 119 ALA CA C 13 52.191 0.001 . 1 . . . . 119 ALA CA . 16188 1 1234 . 1 1 119 119 ALA CB C 13 20.001 0.001 . 1 . . . . 119 ALA CB . 16188 1 1235 . 1 1 119 119 ALA N N 15 125.081 0.001 . 1 . . . . 119 ALA N . 16188 1 1236 . 1 1 120 120 VAL H H 1 8.769 0.001 . 1 . . . . 120 VAL H . 16188 1 1237 . 1 1 120 120 VAL HA H 1 4.349 0.001 . 1 . . . . 120 VAL HA . 16188 1 1238 . 1 1 120 120 VAL HB H 1 2.090 0.001 . 1 . . . . 120 VAL HB . 16188 1 1239 . 1 1 120 120 VAL HG11 H 1 1.016 0.001 . 2 . . . . 120 VAL QG1 . 16188 1 1240 . 1 1 120 120 VAL HG12 H 1 1.016 0.001 . 2 . . . . 120 VAL QG1 . 16188 1 1241 . 1 1 120 120 VAL HG13 H 1 1.016 0.001 . 2 . . . . 120 VAL QG1 . 16188 1 1242 . 1 1 120 120 VAL HG21 H 1 1.016 0.001 . 2 . . . . 120 VAL QG2 . 16188 1 1243 . 1 1 120 120 VAL HG22 H 1 1.016 0.001 . 2 . . . . 120 VAL QG2 . 16188 1 1244 . 1 1 120 120 VAL HG23 H 1 1.016 0.001 . 2 . . . . 120 VAL QG2 . 16188 1 1245 . 1 1 120 120 VAL C C 13 175.431 0.001 . 1 . . . . 120 VAL C . 16188 1 1246 . 1 1 120 120 VAL CA C 13 62.031 0.001 . 1 . . . . 120 VAL CA . 16188 1 1247 . 1 1 120 120 VAL CB C 13 33.891 0.001 . 1 . . . . 120 VAL CB . 16188 1 1248 . 1 1 120 120 VAL N N 15 122.021 0.001 . 1 . . . . 120 VAL N . 16188 1 1249 . 1 1 121 121 SER H H 1 8.424 0.001 . 1 . . . . 121 SER H . 16188 1 1250 . 1 1 121 121 SER HA H 1 4.938 0.001 . 1 . . . . 121 SER HA . 16188 1 1251 . 1 1 121 121 SER HB2 H 1 3.951 0.001 . 2 . . . . 121 SER HB2 . 16188 1 1252 . 1 1 121 121 SER HB3 H 1 3.951 0.001 . 2 . . . . 121 SER HB3 . 16188 1 1253 . 1 1 121 121 SER C C 13 173.911 0.001 . 1 . . . . 121 SER C . 16188 1 1254 . 1 1 121 121 SER CA C 13 57.861 0.001 . 1 . . . . 121 SER CA . 16188 1 1255 . 1 1 121 121 SER CB C 13 64.741 0.001 . 1 . . . . 121 SER CB . 16188 1 1256 . 1 1 121 121 SER N N 15 120.861 0.001 . 1 . . . . 121 SER N . 16188 1 1257 . 1 1 122 122 ASN H H 1 8.360 0.001 . 1 . . . . 122 ASN H . 16188 1 1258 . 1 1 122 122 ASN HA H 1 4.632 0.001 . 1 . . . . 122 ASN HA . 16188 1 1259 . 1 1 122 122 ASN HB2 H 1 3.015 0.001 . 2 . . . . 122 ASN HB2 . 16188 1 1260 . 1 1 122 122 ASN HB3 H 1 2.718 0.001 . 2 . . . . 122 ASN HB3 . 16188 1 1261 . 1 1 122 122 ASN HD21 H 1 7.401 0.001 . 2 . . . . 122 ASN HD21 . 16188 1 1262 . 1 1 122 122 ASN HD22 H 1 6.615 0.001 . 2 . . . . 122 ASN HD22 . 16188 1 1263 . 1 1 122 122 ASN C C 13 174.631 0.001 . 1 . . . . 122 ASN C . 16188 1 1264 . 1 1 122 122 ASN CA C 13 53.691 0.001 . 1 . . . . 122 ASN CA . 16188 1 1265 . 1 1 122 122 ASN CB C 13 38.311 0.001 . 1 . . . . 122 ASN CB . 16188 1 1266 . 1 1 122 122 ASN N N 15 118.591 0.001 . 1 . . . . 122 ASN N . 16188 1 1267 . 1 1 122 122 ASN ND2 N 15 110.591 0.001 . 1 . . . . 122 ASN ND2 . 16188 1 1268 . 1 1 123 123 ALA H H 1 7.909 0.001 . 1 . . . . 123 ALA H . 16188 1 1269 . 1 1 123 123 ALA HA H 1 4.283 0.001 . 1 . . . . 123 ALA HA . 16188 1 1270 . 1 1 123 123 ALA HB1 H 1 1.224 0.001 . 1 . . . . 123 ALA QB . 16188 1 1271 . 1 1 123 123 ALA HB2 H 1 1.224 0.001 . 1 . . . . 123 ALA QB . 16188 1 1272 . 1 1 123 123 ALA HB3 H 1 1.224 0.001 . 1 . . . . 123 ALA QB . 16188 1 1273 . 1 1 123 123 ALA C C 13 177.131 0.001 . 1 . . . . 123 ALA C . 16188 1 1274 . 1 1 123 123 ALA CA C 13 51.961 0.001 . 1 . . . . 123 ALA CA . 16188 1 1275 . 1 1 123 123 ALA CB C 13 19.641 0.001 . 1 . . . . 123 ALA CB . 16188 1 1276 . 1 1 123 123 ALA N N 15 119.601 0.001 . 1 . . . . 123 ALA N . 16188 1 1277 . 1 1 124 124 ARG H H 1 8.552 0.001 . 1 . . . . 124 ARG H . 16188 1 1278 . 1 1 124 124 ARG HA H 1 4.697 0.001 . 1 . . . . 124 ARG HA . 16188 1 1279 . 1 1 124 124 ARG HB2 H 1 1.951 0.001 . 2 . . . . 124 ARG HB2 . 16188 1 1280 . 1 1 124 124 ARG HB3 H 1 1.758 0.001 . 2 . . . . 124 ARG HB3 . 16188 1 1281 . 1 1 124 124 ARG HD2 H 1 2.930 0.001 . 2 . . . . 124 ARG QD . 16188 1 1282 . 1 1 124 124 ARG HD3 H 1 2.930 0.001 . 2 . . . . 124 ARG QD . 16188 1 1283 . 1 1 124 124 ARG HE H 1 7.933 0.001 . 1 . . . . 124 ARG HE . 16188 1 1284 . 1 1 124 124 ARG HG2 H 1 1.758 0.001 . 2 . . . . 124 ARG HG2 . 16188 1 1285 . 1 1 124 124 ARG HG3 H 1 1.621 0.001 . 2 . . . . 124 ARG HG3 . 16188 1 1286 . 1 1 124 124 ARG CA C 13 53.281 0.001 . 1 . . . . 124 ARG CA . 16188 1 1287 . 1 1 124 124 ARG N N 15 118.441 0.001 . 1 . . . . 124 ARG N . 16188 1 1288 . 1 1 124 124 ARG NE N 15 82.121 0.001 . 1 . . . . 124 ARG NE . 16188 1 1289 . 1 1 125 125 PRO C C 13 178.221 0.001 . 1 . . . . 125 PRO C . 16188 1 1290 . 1 1 125 125 PRO CA C 13 66.691 0.001 . 1 . . . . 125 PRO CA . 16188 1 1291 . 1 1 125 125 PRO CB C 13 32.181 0.001 . 1 . . . . 125 PRO CB . 16188 1 1292 . 1 1 126 126 VAL H H 1 7.623 0.001 . 1 . . . . 126 VAL H . 16188 1 1293 . 1 1 126 126 VAL HA H 1 3.698 0.001 . 1 . . . . 126 VAL HA . 16188 1 1294 . 1 1 126 126 VAL HB H 1 1.632 0.001 . 1 . . . . 126 VAL HB . 16188 1 1295 . 1 1 126 126 VAL HG11 H 1 0.748 0.001 . 2 . . . . 126 VAL QG1 . 16188 1 1296 . 1 1 126 126 VAL HG12 H 1 0.748 0.001 . 2 . . . . 126 VAL QG1 . 16188 1 1297 . 1 1 126 126 VAL HG13 H 1 0.748 0.001 . 2 . . . . 126 VAL QG1 . 16188 1 1298 . 1 1 126 126 VAL HG21 H 1 0.247 0.001 . 2 . . . . 126 VAL QG2 . 16188 1 1299 . 1 1 126 126 VAL HG22 H 1 0.247 0.001 . 2 . . . . 126 VAL QG2 . 16188 1 1300 . 1 1 126 126 VAL HG23 H 1 0.247 0.001 . 2 . . . . 126 VAL QG2 . 16188 1 1301 . 1 1 126 126 VAL C C 13 176.611 0.001 . 1 . . . . 126 VAL C . 16188 1 1302 . 1 1 126 126 VAL CA C 13 65.151 0.001 . 1 . . . . 126 VAL CA . 16188 1 1303 . 1 1 126 126 VAL N N 15 108.361 0.001 . 1 . . . . 126 VAL N . 16188 1 1304 . 1 1 127 127 ASP H H 1 7.442 0.001 . 1 . . . . 127 ASP H . 16188 1 1305 . 1 1 127 127 ASP HA H 1 4.567 0.001 . 1 . . . . 127 ASP HA . 16188 1 1306 . 1 1 127 127 ASP HB2 H 1 2.730 0.001 . 2 . . . . 127 ASP HB2 . 16188 1 1307 . 1 1 127 127 ASP HB3 H 1 2.924 0.001 . 2 . . . . 127 ASP HB3 . 16188 1 1308 . 1 1 127 127 ASP C C 13 179.361 0.001 . 1 . . . . 127 ASP C . 16188 1 1309 . 1 1 127 127 ASP CA C 13 57.151 0.001 . 1 . . . . 127 ASP CA . 16188 1 1310 . 1 1 127 127 ASP CB C 13 41.201 0.001 . 1 . . . . 127 ASP CB . 16188 1 1311 . 1 1 127 127 ASP N N 15 120.721 0.001 . 1 . . . . 127 ASP N . 16188 1 1312 . 1 1 128 128 ALA H H 1 7.430 0.001 . 1 . . . . 128 ALA H . 16188 1 1313 . 1 1 128 128 ALA HA H 1 4.021 0.001 . 1 . . . . 128 ALA HA . 16188 1 1314 . 1 1 128 128 ALA HB1 H 1 1.458 0.001 . 1 . . . . 128 ALA QB . 16188 1 1315 . 1 1 128 128 ALA HB2 H 1 1.458 0.001 . 1 . . . . 128 ALA QB . 16188 1 1316 . 1 1 128 128 ALA HB3 H 1 1.458 0.001 . 1 . . . . 128 ALA QB . 16188 1 1317 . 1 1 128 128 ALA C C 13 179.171 0.001 . 1 . . . . 128 ALA C . 16188 1 1318 . 1 1 128 128 ALA CA C 13 55.121 0.001 . 1 . . . . 128 ALA CA . 16188 1 1319 . 1 1 128 128 ALA CB C 13 18.291 0.001 . 1 . . . . 128 ALA CB . 16188 1 1320 . 1 1 128 128 ALA N N 15 122.901 0.001 . 1 . . . . 128 ALA N . 16188 1 1321 . 1 1 129 129 LEU H H 1 7.705 0.001 . 1 . . . . 129 LEU H . 16188 1 1322 . 1 1 129 129 LEU HA H 1 3.984 0.001 . 1 . . . . 129 LEU HA . 16188 1 1323 . 1 1 129 129 LEU HB2 H 1 1.951 0.001 . 2 . . . . 129 LEU HB2 . 16188 1 1324 . 1 1 129 129 LEU HB3 H 1 1.454 0.001 . 2 . . . . 129 LEU HB3 . 16188 1 1325 . 1 1 129 129 LEU HD11 H 1 0.772 0.001 . 2 . . . . 129 LEU QD1 . 16188 1 1326 . 1 1 129 129 LEU HD12 H 1 0.772 0.001 . 2 . . . . 129 LEU QD1 . 16188 1 1327 . 1 1 129 129 LEU HD13 H 1 0.772 0.001 . 2 . . . . 129 LEU QD1 . 16188 1 1328 . 1 1 129 129 LEU HD21 H 1 0.772 0.001 . 2 . . . . 129 LEU QD2 . 16188 1 1329 . 1 1 129 129 LEU HD22 H 1 0.772 0.001 . 2 . . . . 129 LEU QD2 . 16188 1 1330 . 1 1 129 129 LEU HD23 H 1 0.772 0.001 . 2 . . . . 129 LEU QD2 . 16188 1 1331 . 1 1 129 129 LEU HG H 1 1.111 0.001 . 1 . . . . 129 LEU HG . 16188 1 1332 . 1 1 129 129 LEU C C 13 179.471 0.001 . 1 . . . . 129 LEU C . 16188 1 1333 . 1 1 129 129 LEU CA C 13 57.411 0.001 . 1 . . . . 129 LEU CA . 16188 1 1334 . 1 1 129 129 LEU CB C 13 41.201 0.001 . 1 . . . . 129 LEU CB . 16188 1 1335 . 1 1 129 129 LEU N N 15 115.191 0.001 . 1 . . . . 129 LEU N . 16188 1 1336 . 1 1 130 130 HIS H H 1 7.804 0.001 . 1 . . . . 130 HIS H . 16188 1 1337 . 1 1 130 130 HIS HA H 1 4.423 0.001 . 1 . . . . 130 HIS HA . 16188 1 1338 . 1 1 130 130 HIS HB2 H 1 3.579 0.001 . 2 . . . . 130 HIS HB2 . 16188 1 1339 . 1 1 130 130 HIS HB3 H 1 3.381 0.001 . 2 . . . . 130 HIS HB3 . 16188 1 1340 . 1 1 130 130 HIS C C 13 174.101 0.001 . 1 . . . . 130 HIS C . 16188 1 1341 . 1 1 130 130 HIS CA C 13 57.971 0.001 . 1 . . . . 130 HIS CA . 16188 1 1342 . 1 1 130 130 HIS CB C 13 28.931 0.001 . 1 . . . . 130 HIS CB . 16188 1 1343 . 1 1 130 130 HIS N N 15 116.791 0.001 . 1 . . . . 130 HIS N . 16188 1 1344 . 1 1 131 131 ALA H H 1 7.570 0.001 . 1 . . . . 131 ALA H . 16188 1 1345 . 1 1 131 131 ALA HA H 1 4.760 0.001 . 1 . . . . 131 ALA HA . 16188 1 1346 . 1 1 131 131 ALA HB1 H 1 1.626 0.001 . 1 . . . . 131 ALA QB . 16188 1 1347 . 1 1 131 131 ALA HB2 H 1 1.626 0.001 . 1 . . . . 131 ALA QB . 16188 1 1348 . 1 1 131 131 ALA HB3 H 1 1.626 0.001 . 1 . . . . 131 ALA QB . 16188 1 1349 . 1 1 131 131 ALA C C 13 176.351 0.001 . 1 . . . . 131 ALA C . 16188 1 1350 . 1 1 131 131 ALA CA C 13 51.471 0.001 . 1 . . . . 131 ALA CA . 16188 1 1351 . 1 1 131 131 ALA CB C 13 19.911 0.001 . 1 . . . . 131 ALA CB . 16188 1 1352 . 1 1 131 131 ALA N N 15 121.591 0.001 . 1 . . . . 131 ALA N . 16188 1 1353 . 1 1 132 132 HIS H H 1 8.243 0.001 . 1 . . . . 132 HIS H . 16188 1 1354 . 1 1 132 132 HIS HA H 1 4.605 0.001 . 1 . . . . 132 HIS HA . 16188 1 1355 . 1 1 132 132 HIS HB2 H 1 3.610 0.001 . 2 . . . . 132 HIS HB2 . 16188 1 1356 . 1 1 132 132 HIS HB3 H 1 3.610 0.001 . 2 . . . . 132 HIS HB3 . 16188 1 1357 . 1 1 132 132 HIS C C 13 174.911 0.001 . 1 . . . . 132 HIS C . 16188 1 1358 . 1 1 132 132 HIS CA C 13 57.191 0.001 . 1 . . . . 132 HIS CA . 16188 1 1359 . 1 1 132 132 HIS CB C 13 26.861 0.001 . 1 . . . . 132 HIS CB . 16188 1 1360 . 1 1 132 132 HIS N N 15 114.231 0.001 . 1 . . . . 132 HIS N . 16188 1 1361 . 1 1 133 133 GLN H H 1 8.026 0.001 . 1 . . . . 133 GLN H . 16188 1 1362 . 1 1 133 133 GLN HA H 1 4.909 0.001 . 1 . . . . 133 GLN HA . 16188 1 1363 . 1 1 133 133 GLN HB2 H 1 2.530 0.001 . 2 . . . . 133 GLN HB2 . 16188 1 1364 . 1 1 133 133 GLN HB3 H 1 1.853 0.001 . 2 . . . . 133 GLN HB3 . 16188 1 1365 . 1 1 133 133 GLN HE21 H 1 7.540 0.001 . 2 . . . . 133 GLN HE21 . 16188 1 1366 . 1 1 133 133 GLN HE22 H 1 7.317 0.001 . 2 . . . . 133 GLN HE22 . 16188 1 1367 . 1 1 133 133 GLN HG2 H 1 2.622 0.001 . 2 . . . . 133 GLN HG2 . 16188 1 1368 . 1 1 133 133 GLN HG3 H 1 2.530 0.001 . 2 . . . . 133 GLN HG3 . 16188 1 1369 . 1 1 133 133 GLN C C 13 175.661 0.001 . 1 . . . . 133 GLN C . 16188 1 1370 . 1 1 133 133 GLN CA C 13 55.231 0.001 . 1 . . . . 133 GLN CA . 16188 1 1371 . 1 1 133 133 GLN CB C 13 29.291 0.001 . 1 . . . . 133 GLN CB . 16188 1 1372 . 1 1 133 133 GLN N N 15 118.251 0.001 . 1 . . . . 133 GLN N . 16188 1 1373 . 1 1 133 133 GLN NE2 N 15 112.141 0.001 . 1 . . . . 133 GLN NE2 . 16188 1 1374 . 1 1 134 134 ALA H H 1 8.132 0.001 . 1 . . . . 134 ALA H . 16188 1 1375 . 1 1 134 134 ALA HA H 1 3.986 0.001 . 1 . . . . 134 ALA HA . 16188 1 1376 . 1 1 134 134 ALA HB1 H 1 1.571 0.001 . 1 . . . . 134 ALA QB . 16188 1 1377 . 1 1 134 134 ALA HB2 H 1 1.571 0.001 . 1 . . . . 134 ALA QB . 16188 1 1378 . 1 1 134 134 ALA HB3 H 1 1.571 0.001 . 1 . . . . 134 ALA QB . 16188 1 1379 . 1 1 134 134 ALA C C 13 179.121 0.001 . 1 . . . . 134 ALA C . 16188 1 1380 . 1 1 134 134 ALA CA C 13 55.161 0.001 . 1 . . . . 134 ALA CA . 16188 1 1381 . 1 1 134 134 ALA CB C 13 19.911 0.001 . 1 . . . . 134 ALA CB . 16188 1 1382 . 1 1 134 134 ALA N N 15 122.651 0.001 . 1 . . . . 134 ALA N . 16188 1 1383 . 1 1 135 135 ARG H H 1 8.471 0.001 . 1 . . . . 135 ARG H . 16188 1 1384 . 1 1 135 135 ARG HA H 1 4.052 0.001 . 1 . . . . 135 ARG HA . 16188 1 1385 . 1 1 135 135 ARG HB2 H 1 2.059 0.001 . 2 . . . . 135 ARG HB2 . 16188 1 1386 . 1 1 135 135 ARG HB3 H 1 1.967 0.001 . 2 . . . . 135 ARG HB3 . 16188 1 1387 . 1 1 135 135 ARG HD2 H 1 3.334 0.001 . 2 . . . . 135 ARG QD . 16188 1 1388 . 1 1 135 135 ARG HD3 H 1 3.334 0.001 . 2 . . . . 135 ARG QD . 16188 1 1389 . 1 1 135 135 ARG HG2 H 1 1.967 0.001 . 2 . . . . 135 ARG HG2 . 16188 1 1390 . 1 1 135 135 ARG HG3 H 1 1.735 0.001 . 2 . . . . 135 ARG HG3 . 16188 1 1391 . 1 1 135 135 ARG C C 13 178.931 0.001 . 1 . . . . 135 ARG C . 16188 1 1392 . 1 1 135 135 ARG CA C 13 60.381 0.001 . 1 . . . . 135 ARG CA . 16188 1 1393 . 1 1 135 135 ARG CB C 13 30.101 0.001 . 1 . . . . 135 ARG CB . 16188 1 1394 . 1 1 135 135 ARG N N 15 116.741 0.001 . 1 . . . . 135 ARG N . 16188 1 1395 . 1 1 136 136 GLU H H 1 8.243 0.001 . 1 . . . . 136 GLU H . 16188 1 1396 . 1 1 136 136 GLU HA H 1 4.333 0.001 . 1 . . . . 136 GLU HA . 16188 1 1397 . 1 1 136 136 GLU HB2 H 1 2.232 0.001 . 2 . . . . 136 GLU HB2 . 16188 1 1398 . 1 1 136 136 GLU HB3 H 1 2.118 0.001 . 2 . . . . 136 GLU HB3 . 16188 1 1399 . 1 1 136 136 GLU HG2 H 1 2.566 0.001 . 2 . . . . 136 GLU HG2 . 16188 1 1400 . 1 1 136 136 GLU HG3 H 1 2.383 0.001 . 2 . . . . 136 GLU HG3 . 16188 1 1401 . 1 1 136 136 GLU C C 13 178.821 0.001 . 1 . . . . 136 GLU C . 16188 1 1402 . 1 1 136 136 GLU CA C 13 58.611 0.001 . 1 . . . . 136 GLU CA . 16188 1 1403 . 1 1 136 136 GLU CB C 13 28.841 0.001 . 1 . . . . 136 GLU CB . 16188 1 1404 . 1 1 136 136 GLU N N 15 118.441 0.001 . 1 . . . . 136 GLU N . 16188 1 1405 . 1 1 137 137 VAL H H 1 7.635 0.001 . 1 . . . . 137 VAL H . 16188 1 1406 . 1 1 137 137 VAL HA H 1 3.810 0.001 . 1 . . . . 137 VAL HA . 16188 1 1407 . 1 1 137 137 VAL HB H 1 2.314 0.001 . 1 . . . . 137 VAL HB . 16188 1 1408 . 1 1 137 137 VAL HG11 H 1 1.113 0.001 . 2 . . . . 137 VAL QG1 . 16188 1 1409 . 1 1 137 137 VAL HG12 H 1 1.113 0.001 . 2 . . . . 137 VAL QG1 . 16188 1 1410 . 1 1 137 137 VAL HG13 H 1 1.113 0.001 . 2 . . . . 137 VAL QG1 . 16188 1 1411 . 1 1 137 137 VAL HG21 H 1 1.113 0.001 . 2 . . . . 137 VAL QG2 . 16188 1 1412 . 1 1 137 137 VAL HG22 H 1 1.113 0.001 . 2 . . . . 137 VAL QG2 . 16188 1 1413 . 1 1 137 137 VAL HG23 H 1 1.113 0.001 . 2 . . . . 137 VAL QG2 . 16188 1 1414 . 1 1 137 137 VAL C C 13 173.691 0.001 . 1 . . . . 137 VAL C . 16188 1 1415 . 1 1 137 137 VAL CA C 13 66.881 0.001 . 1 . . . . 137 VAL CA . 16188 1 1416 . 1 1 137 137 VAL N N 15 119.891 0.001 . 1 . . . . 137 VAL N . 16188 1 1417 . 1 1 138 138 VAL H H 1 8.311 0.001 . 1 . . . . 138 VAL H . 16188 1 1418 . 1 1 138 138 VAL HA H 1 3.623 0.001 . 1 . . . . 138 VAL HA . 16188 1 1419 . 1 1 138 138 VAL HB H 1 2.206 0.001 . 1 . . . . 138 VAL HB . 16188 1 1420 . 1 1 138 138 VAL HG11 H 1 1.092 0.001 . 2 . . . . 138 VAL QG1 . 16188 1 1421 . 1 1 138 138 VAL HG12 H 1 1.092 0.001 . 2 . . . . 138 VAL QG1 . 16188 1 1422 . 1 1 138 138 VAL HG13 H 1 1.092 0.001 . 2 . . . . 138 VAL QG1 . 16188 1 1423 . 1 1 138 138 VAL HG21 H 1 0.959 0.001 . 2 . . . . 138 VAL QG2 . 16188 1 1424 . 1 1 138 138 VAL HG22 H 1 0.959 0.001 . 2 . . . . 138 VAL QG2 . 16188 1 1425 . 1 1 138 138 VAL HG23 H 1 0.959 0.001 . 2 . . . . 138 VAL QG2 . 16188 1 1426 . 1 1 138 138 VAL C C 13 177.721 0.001 . 1 . . . . 138 VAL C . 16188 1 1427 . 1 1 138 138 VAL CA C 13 67.481 0.001 . 1 . . . . 138 VAL CA . 16188 1 1428 . 1 1 138 138 VAL CB C 13 39.481 0.001 . 1 . . . . 138 VAL CB . 16188 1 1429 . 1 1 138 138 VAL N N 15 120.611 0.001 . 1 . . . . 138 VAL N . 16188 1 1430 . 1 1 139 139 ARG H H 1 7.980 0.001 . 1 . . . . 139 ARG H . 16188 1 1431 . 1 1 139 139 ARG HA H 1 4.257 0.001 . 1 . . . . 139 ARG HA . 16188 1 1432 . 1 1 139 139 ARG HB2 H 1 2.053 0.001 . 2 . . . . 139 ARG HB2 . 16188 1 1433 . 1 1 139 139 ARG HB3 H 1 1.898 0.001 . 2 . . . . 139 ARG HB3 . 16188 1 1434 . 1 1 139 139 ARG HD2 H 1 3.377 0.001 . 2 . . . . 139 ARG HD2 . 16188 1 1435 . 1 1 139 139 ARG HD3 H 1 3.293 0.001 . 2 . . . . 139 ARG HD3 . 16188 1 1436 . 1 1 139 139 ARG HE H 1 7.673 0.001 . 1 . . . . 139 ARG HE . 16188 1 1437 . 1 1 139 139 ARG HG2 H 1 1.898 0.001 . 2 . . . . 139 ARG HG2 . 16188 1 1438 . 1 1 139 139 ARG HG3 H 1 1.748 0.001 . 2 . . . . 139 ARG HG3 . 16188 1 1439 . 1 1 139 139 ARG C C 13 180.051 0.001 . 1 . . . . 139 ARG C . 16188 1 1440 . 1 1 139 139 ARG CA C 13 59.781 0.001 . 1 . . . . 139 ARG CA . 16188 1 1441 . 1 1 139 139 ARG N N 15 118.881 0.001 . 1 . . . . 139 ARG N . 16188 1 1442 . 1 1 139 139 ARG NE N 15 84.111 0.001 . 1 . . . . 139 ARG NE . 16188 1 1443 . 1 1 140 140 ARG H H 1 7.956 0.001 . 1 . . . . 140 ARG H . 16188 1 1444 . 1 1 140 140 ARG HA H 1 4.169 0.001 . 1 . . . . 140 ARG HA . 16188 1 1445 . 1 1 140 140 ARG HB2 H 1 2.288 0.001 . 2 . . . . 140 ARG HB2 . 16188 1 1446 . 1 1 140 140 ARG HB3 H 1 2.107 0.001 . 2 . . . . 140 ARG HB3 . 16188 1 1447 . 1 1 140 140 ARG HD2 H 1 3.465 0.001 . 2 . . . . 140 ARG HD2 . 16188 1 1448 . 1 1 140 140 ARG HD3 H 1 3.232 0.001 . 2 . . . . 140 ARG HD3 . 16188 1 1449 . 1 1 140 140 ARG HE H 1 8.118 0.001 . 1 . . . . 140 ARG HE . 16188 1 1450 . 1 1 140 140 ARG HG2 H 1 2.107 0.001 . 2 . . . . 140 ARG HG2 . 16188 1 1451 . 1 1 140 140 ARG HG3 H 1 1.988 0.001 . 2 . . . . 140 ARG HG3 . 16188 1 1452 . 1 1 140 140 ARG C C 13 178.741 0.001 . 1 . . . . 140 ARG C . 16188 1 1453 . 1 1 140 140 ARG CA C 13 59.031 0.001 . 1 . . . . 140 ARG CA . 16188 1 1454 . 1 1 140 140 ARG CB C 13 30.011 0.001 . 1 . . . . 140 ARG CB . 16188 1 1455 . 1 1 140 140 ARG N N 15 119.411 0.001 . 1 . . . . 140 ARG N . 16188 1 1456 . 1 1 140 140 ARG NE N 15 85.931 0.001 . 1 . . . . 140 ARG NE . 16188 1 1457 . 1 1 141 141 ALA H H 1 8.435 0.001 . 1 . . . . 141 ALA H . 16188 1 1458 . 1 1 141 141 ALA HA H 1 3.799 0.001 . 1 . . . . 141 ALA HA . 16188 1 1459 . 1 1 141 141 ALA HB1 H 1 1.333 0.001 . 1 . . . . 141 ALA QB . 16188 1 1460 . 1 1 141 141 ALA HB2 H 1 1.333 0.001 . 1 . . . . 141 ALA QB . 16188 1 1461 . 1 1 141 141 ALA HB3 H 1 1.333 0.001 . 1 . . . . 141 ALA QB . 16188 1 1462 . 1 1 141 141 ALA C C 13 179.321 0.001 . 1 . . . . 141 ALA C . 16188 1 1463 . 1 1 141 141 ALA CA C 13 54.861 0.001 . 1 . . . . 141 ALA CA . 16188 1 1464 . 1 1 141 141 ALA CB C 13 18.651 0.001 . 1 . . . . 141 ALA CB . 16188 1 1465 . 1 1 141 141 ALA N N 15 122.941 0.001 . 1 . . . . 141 ALA N . 16188 1 1466 . 1 1 142 142 GLN H H 1 8.465 0.001 . 1 . . . . 142 GLN H . 16188 1 1467 . 1 1 142 142 GLN HA H 1 3.889 0.001 . 1 . . . . 142 GLN HA . 16188 1 1468 . 1 1 142 142 GLN HB2 H 1 2.399 0.001 . 2 . . . . 142 GLN HB2 . 16188 1 1469 . 1 1 142 142 GLN HB3 H 1 2.128 0.001 . 2 . . . . 142 GLN HB3 . 16188 1 1470 . 1 1 142 142 GLN HE21 H 1 7.256 0.001 . 2 . . . . 142 GLN HE21 . 16188 1 1471 . 1 1 142 142 GLN HE22 H 1 6.814 0.001 . 2 . . . . 142 GLN HE22 . 16188 1 1472 . 1 1 142 142 GLN HG2 H 1 2.731 0.001 . 2 . . . . 142 GLN HG2 . 16188 1 1473 . 1 1 142 142 GLN HG3 H 1 2.399 0.001 . 2 . . . . 142 GLN HG3 . 16188 1 1474 . 1 1 142 142 GLN C C 13 178.311 0.001 . 1 . . . . 142 GLN C . 16188 1 1475 . 1 1 142 142 GLN CA C 13 58.951 0.001 . 1 . . . . 142 GLN CA . 16188 1 1476 . 1 1 142 142 GLN CB C 13 28.841 0.001 . 1 . . . . 142 GLN CB . 16188 1 1477 . 1 1 142 142 GLN N N 15 116.161 0.001 . 1 . . . . 142 GLN N . 16188 1 1478 . 1 1 142 142 GLN NE2 N 15 110.981 0.001 . 1 . . . . 142 GLN NE2 . 16188 1 1479 . 1 1 143 143 ALA H H 1 7.670 0.001 . 1 . . . . 143 ALA H . 16188 1 1480 . 1 1 143 143 ALA HA H 1 4.312 0.001 . 1 . . . . 143 ALA HA . 16188 1 1481 . 1 1 143 143 ALA HB1 H 1 1.599 0.001 . 1 . . . . 143 ALA QB . 16188 1 1482 . 1 1 143 143 ALA HB2 H 1 1.599 0.001 . 1 . . . . 143 ALA QB . 16188 1 1483 . 1 1 143 143 ALA HB3 H 1 1.599 0.001 . 1 . . . . 143 ALA QB . 16188 1 1484 . 1 1 143 143 ALA C C 13 179.171 0.001 . 1 . . . . 143 ALA C . 16188 1 1485 . 1 1 143 143 ALA CA C 13 53.881 0.001 . 1 . . . . 143 ALA CA . 16188 1 1486 . 1 1 143 143 ALA CB C 13 18.471 0.001 . 1 . . . . 143 ALA CB . 16188 1 1487 . 1 1 143 143 ALA N N 15 120.141 0.001 . 1 . . . . 143 ALA N . 16188 1 1488 . 1 1 144 144 MET H H 1 7.541 0.001 . 1 . . . . 144 MET H . 16188 1 1489 . 1 1 144 144 MET HA H 1 4.312 0.001 . 1 . . . . 144 MET HA . 16188 1 1490 . 1 1 144 144 MET HB2 H 1 2.010 0.001 . 2 . . . . 144 MET HB2 . 16188 1 1491 . 1 1 144 144 MET HB3 H 1 2.284 0.001 . 2 . . . . 144 MET HB3 . 16188 1 1492 . 1 1 144 144 MET HE1 H 1 2.284 0.001 . 1 . . . . 144 MET QE . 16188 1 1493 . 1 1 144 144 MET HE2 H 1 2.284 0.001 . 1 . . . . 144 MET QE . 16188 1 1494 . 1 1 144 144 MET HE3 H 1 2.284 0.001 . 1 . . . . 144 MET QE . 16188 1 1495 . 1 1 144 144 MET HG2 H 1 2.468 0.001 . 2 . . . . 144 MET HG2 . 16188 1 1496 . 1 1 144 144 MET HG3 H 1 2.284 0.001 . 2 . . . . 144 MET HG3 . 16188 1 1497 . 1 1 144 144 MET C C 13 176.531 0.001 . 1 . . . . 144 MET C . 16188 1 1498 . 1 1 144 144 MET CA C 13 57.151 0.001 . 1 . . . . 144 MET CA . 16188 1 1499 . 1 1 144 144 MET CB C 13 33.441 0.001 . 1 . . . . 144 MET CB . 16188 1 1500 . 1 1 144 144 MET N N 15 116.551 0.001 . 1 . . . . 144 MET N . 16188 1 1501 . 1 1 145 145 ALA H H 1 7.646 0.001 . 1 . . . . 145 ALA H . 16188 1 1502 . 1 1 145 145 ALA HA H 1 4.507 0.001 . 1 . . . . 145 ALA HA . 16188 1 1503 . 1 1 145 145 ALA HB1 H 1 1.352 0.001 . 1 . . . . 145 ALA QB . 16188 1 1504 . 1 1 145 145 ALA HB2 H 1 1.352 0.001 . 1 . . . . 145 ALA QB . 16188 1 1505 . 1 1 145 145 ALA HB3 H 1 1.352 0.001 . 1 . . . . 145 ALA QB . 16188 1 1506 . 1 1 145 145 ALA C C 13 176.221 0.001 . 1 . . . . 145 ALA C . 16188 1 1507 . 1 1 145 145 ALA CA C 13 53.091 0.001 . 1 . . . . 145 ALA CA . 16188 1 1508 . 1 1 145 145 ALA CB C 13 20.451 0.001 . 1 . . . . 145 ALA CB . 16188 1 1509 . 1 1 145 145 ALA N N 15 123.091 0.001 . 1 . . . . 145 ALA N . 16188 1 1510 . 1 1 146 146 TYR H H 1 7.699 0.001 . 1 . . . . 146 TYR H . 16188 1 1511 . 1 1 146 146 TYR HA H 1 4.559 0.001 . 1 . . . . 146 TYR HA . 16188 1 1512 . 1 1 146 146 TYR HB2 H 1 3.196 0.001 . 2 . . . . 146 TYR HB2 . 16188 1 1513 . 1 1 146 146 TYR HB3 H 1 3.038 0.001 . 2 . . . . 146 TYR HB3 . 16188 1 1514 . 1 1 146 146 TYR HD1 H 1 6.978 0.001 . 3 . . . . 146 TYR QD . 16188 1 1515 . 1 1 146 146 TYR HD2 H 1 6.978 0.001 . 3 . . . . 146 TYR QD . 16188 1 1516 . 1 1 146 146 TYR HE1 H 1 7.222 0.001 . 3 . . . . 146 TYR QE . 16188 1 1517 . 1 1 146 146 TYR HE2 H 1 7.222 0.001 . 3 . . . . 146 TYR QE . 16188 1 1518 . 1 1 146 146 TYR CA C 13 59.141 0.001 . 1 . . . . 146 TYR CA . 16188 1 1519 . 1 1 146 146 TYR N N 15 124.011 0.001 . 1 . . . . 146 TYR N . 16188 1 stop_ loop_ _Ambiguous_atom_chem_shift.Ambiguous_shift_set_ID _Ambiguous_atom_chem_shift.Atom_chem_shift_ID _Ambiguous_atom_chem_shift.Entry_ID _Ambiguous_atom_chem_shift.Assigned_chem_shift_list_ID 1 142 16188 1 1 143 16188 1 1 144 16188 1 1 147 16188 1 1 148 16188 1 1 149 16188 1 2 664 16188 1 2 665 16188 1 2 666 16188 1 2 669 16188 1 2 670 16188 1 2 671 16188 1 3 893 16188 1 3 894 16188 1 3 895 16188 1 3 898 16188 1 3 899 16188 1 3 900 16188 1 4 1002 16188 1 4 1003 16188 1 4 1004 16188 1 4 1007 16188 1 4 1008 16188 1 4 1009 16188 1 5 1149 16188 1 5 1150 16188 1 5 1151 16188 1 5 1154 16188 1 5 1155 16188 1 5 1156 16188 1 stop_ save_