data_17959 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 17959 _Entry.Title ; Backbone and side chain 1H, 13C, and 15N assignments of the ubiquitin-like domain of human HOIL-1L ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2011-09-26 _Entry.Accession_date 2011-09-26 _Entry.Last_release_date . _Entry.Original_release_date . _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 3.1 _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 Yoshinori Uekusa . . . 17959 2 Syunsuke Mimura . . . 17959 3 Hiroaki Sasakawa . . . 17959 4 Eiji Kurimoto . . . 17959 5 Eri Sakata . . . 17959 6 Serve Olivier . . . 17959 7 Hirokazu Yagi . . . 17959 8 Fumimori Tokunaga . . . 17959 9 Kazuhiro Iwai . . . 17959 10 Koichi Kato . . . 17959 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 17959 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 513 17959 '15N chemical shifts' 121 17959 '1H chemical shifts' 804 17959 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 2 . . 2013-01-17 2011-09-26 update BMRB 'update entry citation' 17959 1 . . 2011-12-12 2011-09-26 original author 'original release' 17959 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 17959 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 22127525 _Citation.Full_citation . _Citation.Title 'Backbone and side chain 1H, 13C, and 15N assignments of the ubiquitin-like domain of human HOIL-1L, an essential component of linear ubiquitin chain assembly complex.' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Biomol. NMR Assignments' _Citation.Journal_name_full 'Biomolecular NMR assignments' _Citation.Journal_volume 6 _Citation.Journal_issue 2 _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first 177 _Citation.Page_last 180 _Citation.Year 2012 _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 Yoshinori Uekusa . . . 17959 1 2 Syunsuke Mimura . . . 17959 1 3 Hiroaki Sasakawa . . . 17959 1 4 Eiji Kurimoto . . . 17959 1 5 Eri Sakata . . . 17959 1 6 Serve Olivier . . . 17959 1 7 Hirokazu Yagi . . . 17959 1 8 Fuminori Tokunaga . . . 17959 1 9 Kazuhiro Iwai . . . 17959 1 10 Koichi Kato . . . 17959 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID HOIL-1L 17959 1 'NMR spectroscopy' 17959 1 'Resonance assignment' 17959 1 'Ubiquitin-like domain' 17959 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 17959 _Assembly.ID 1 _Assembly.Name 'human HOIL-1L' _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds no _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic 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 'human HOIL-1L' 1 $HOIL-1L A . yes native no no . . . 17959 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_HOIL-1L _Entity.Sf_category entity _Entity.Sf_framecode HOIL-1L _Entity.Entry_ID 17959 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name HOIL-1L _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; GSHMQRVPLSVQLKPEVSPT QDIRLWVSVEDAQMHTVTIW LTVRPDMTVASLKDMVFLDY GFPPVLQQWVIGQRLARDQE TLHSHGVRQNGDSAYLYLLS ARNTSLNPQELQRERQLRML QDLGFKDLT ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details 'Residues 1-4 represent an expression vector fragment.' _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 129 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-11-25 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 BMRB 17828 . HOIL-1_Ubl . . . . . 68.99 90 100.00 100.00 2.08e-57 . . . . 17959 1 2 no PDB 2LGY . "Ubiquitin-Like Domain From Hoil-1" . . . . . 68.99 90 100.00 100.00 2.08e-57 . . . . 17959 1 3 no PDB 4DBG . "Crystal Structure Of Hoil-1l-Ubl Complexed With A Hoip-Uba Derivative" . . . . . 81.40 105 100.00 100.00 2.16e-69 . . . . 17959 1 4 no DBJ BAC75409 . "ubiquitin ligase [Homo sapiens]" . . . . . 82.17 468 99.06 100.00 9.96e-67 . . . . 17959 1 5 no DBJ BAG59927 . "unnamed protein product [Homo sapiens]" . . . . . 96.90 272 99.20 100.00 1.18e-82 . . . . 17959 1 6 no DBJ BAG64417 . "unnamed protein product [Homo sapiens]" . . . . . 96.90 259 99.20 100.00 8.00e-83 . . . . 17959 1 7 no GB AAD00162 . "HBV associated factor [Homo sapiens]" . . . . . 82.17 468 99.06 100.00 8.31e-67 . . . . 17959 1 8 no GB AAH15219 . "RanBP-type and C3HC4-type zinc finger containing 1 [Homo sapiens]" . . . . . 96.90 500 99.20 100.00 1.71e-80 . . . . 17959 1 9 no GB AIC59659 . "RBCK1, partial [synthetic construct]" . . . . . 82.17 230 99.06 100.00 7.11e-69 . . . . 17959 1 10 no GB EAX10673 . "hCG2019817, isoform CRA_a [Homo sapiens]" . . . . . 82.17 468 99.06 100.00 8.31e-67 . . . . 17959 1 11 no GB EAX10675 . "hCG2019817, isoform CRA_c [Homo sapiens]" . . . . . 96.90 510 99.20 100.00 1.39e-80 . . . . 17959 1 12 no REF NP_001253226 . "ranBP-type and C3HC4-type zinc finger-containing protein 1 [Macaca mulatta]" . . . . . 96.90 510 99.20 100.00 1.20e-80 . . . . 17959 1 13 no REF NP_006453 . "ranBP-type and C3HC4-type zinc finger-containing protein 1 isoform 1 [Homo sapiens]" . . . . . 82.17 468 99.06 100.00 8.31e-67 . . . . 17959 1 14 no REF NP_112506 . "ranBP-type and C3HC4-type zinc finger-containing protein 1 isoform 2 [Homo sapiens]" . . . . . 96.90 510 99.20 100.00 1.39e-80 . . . . 17959 1 15 no REF XP_001152050 . "PREDICTED: ranBP-type and C3HC4-type zinc finger-containing protein 1 isoform X2 [Pan troglodytes]" . . . . . 96.90 510 99.20 100.00 1.44e-80 . . . . 17959 1 16 no REF XP_002830204 . "PREDICTED: LOW QUALITY PROTEIN: ranBP-type and C3HC4-type zinc finger-containing protein 1 [Pongo abelii]" . . . . . 96.90 510 98.40 99.20 7.98e-80 . . . . 17959 1 17 no SP Q9BYM8 . "RecName: Full=RanBP-type and C3HC4-type zinc finger-containing protein 1; AltName: Full=HBV-associated factor 4; AltName: Full=" . . . . . 96.90 510 99.20 100.00 1.39e-80 . . . . 17959 1 stop_ loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 . GLY . 17959 1 2 . SER . 17959 1 3 . HIS . 17959 1 4 . MET . 17959 1 5 . GLN . 17959 1 6 . ARG . 17959 1 7 . VAL . 17959 1 8 . PRO . 17959 1 9 . LEU . 17959 1 10 . SER . 17959 1 11 . VAL . 17959 1 12 . GLN . 17959 1 13 . LEU . 17959 1 14 . LYS . 17959 1 15 . PRO . 17959 1 16 . GLU . 17959 1 17 . VAL . 17959 1 18 . SER . 17959 1 19 . PRO . 17959 1 20 . THR . 17959 1 21 . GLN . 17959 1 22 . ASP . 17959 1 23 . ILE . 17959 1 24 . ARG . 17959 1 25 . LEU . 17959 1 26 . TRP . 17959 1 27 . VAL . 17959 1 28 . SER . 17959 1 29 . VAL . 17959 1 30 . GLU . 17959 1 31 . ASP . 17959 1 32 . ALA . 17959 1 33 . GLN . 17959 1 34 . MET . 17959 1 35 . HIS . 17959 1 36 . THR . 17959 1 37 . VAL . 17959 1 38 . THR . 17959 1 39 . ILE . 17959 1 40 . TRP . 17959 1 41 . LEU . 17959 1 42 . THR . 17959 1 43 . VAL . 17959 1 44 . ARG . 17959 1 45 . PRO . 17959 1 46 . ASP . 17959 1 47 . MET . 17959 1 48 . THR . 17959 1 49 . VAL . 17959 1 50 . ALA . 17959 1 51 . SER . 17959 1 52 . LEU . 17959 1 53 . LYS . 17959 1 54 . ASP . 17959 1 55 . MET . 17959 1 56 . VAL . 17959 1 57 . PHE . 17959 1 58 . LEU . 17959 1 59 . ASP . 17959 1 60 . TYR . 17959 1 61 . GLY . 17959 1 62 . PHE . 17959 1 63 . PRO . 17959 1 64 . PRO . 17959 1 65 . VAL . 17959 1 66 . LEU . 17959 1 67 . GLN . 17959 1 68 . GLN . 17959 1 69 . TRP . 17959 1 70 . VAL . 17959 1 71 . ILE . 17959 1 72 . GLY . 17959 1 73 . GLN . 17959 1 74 . ARG . 17959 1 75 . LEU . 17959 1 76 . ALA . 17959 1 77 . ARG . 17959 1 78 . ASP . 17959 1 79 . GLN . 17959 1 80 . GLU . 17959 1 81 . THR . 17959 1 82 . LEU . 17959 1 83 . HIS . 17959 1 84 . SER . 17959 1 85 . HIS . 17959 1 86 . GLY . 17959 1 87 . VAL . 17959 1 88 . ARG . 17959 1 89 . GLN . 17959 1 90 . ASN . 17959 1 91 . GLY . 17959 1 92 . ASP . 17959 1 93 . SER . 17959 1 94 . ALA . 17959 1 95 . TYR . 17959 1 96 . LEU . 17959 1 97 . TYR . 17959 1 98 . LEU . 17959 1 99 . LEU . 17959 1 100 . SER . 17959 1 101 . ALA . 17959 1 102 . ARG . 17959 1 103 . ASN . 17959 1 104 . THR . 17959 1 105 . SER . 17959 1 106 . LEU . 17959 1 107 . ASN . 17959 1 108 . PRO . 17959 1 109 . GLN . 17959 1 110 . GLU . 17959 1 111 . LEU . 17959 1 112 . GLN . 17959 1 113 . ARG . 17959 1 114 . GLU . 17959 1 115 . ARG . 17959 1 116 . GLN . 17959 1 117 . LEU . 17959 1 118 . ARG . 17959 1 119 . MET . 17959 1 120 . LEU . 17959 1 121 . GLN . 17959 1 122 . ASP . 17959 1 123 . LEU . 17959 1 124 . GLY . 17959 1 125 . PHE . 17959 1 126 . LYS . 17959 1 127 . ASP . 17959 1 128 . LEU . 17959 1 129 . THR . 17959 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . GLY 1 1 17959 1 . SER 2 2 17959 1 . HIS 3 3 17959 1 . MET 4 4 17959 1 . GLN 5 5 17959 1 . ARG 6 6 17959 1 . VAL 7 7 17959 1 . PRO 8 8 17959 1 . LEU 9 9 17959 1 . SER 10 10 17959 1 . VAL 11 11 17959 1 . GLN 12 12 17959 1 . LEU 13 13 17959 1 . LYS 14 14 17959 1 . PRO 15 15 17959 1 . GLU 16 16 17959 1 . VAL 17 17 17959 1 . SER 18 18 17959 1 . PRO 19 19 17959 1 . THR 20 20 17959 1 . GLN 21 21 17959 1 . ASP 22 22 17959 1 . ILE 23 23 17959 1 . ARG 24 24 17959 1 . LEU 25 25 17959 1 . TRP 26 26 17959 1 . VAL 27 27 17959 1 . SER 28 28 17959 1 . VAL 29 29 17959 1 . GLU 30 30 17959 1 . ASP 31 31 17959 1 . ALA 32 32 17959 1 . GLN 33 33 17959 1 . MET 34 34 17959 1 . HIS 35 35 17959 1 . THR 36 36 17959 1 . VAL 37 37 17959 1 . THR 38 38 17959 1 . ILE 39 39 17959 1 . TRP 40 40 17959 1 . LEU 41 41 17959 1 . THR 42 42 17959 1 . VAL 43 43 17959 1 . ARG 44 44 17959 1 . PRO 45 45 17959 1 . ASP 46 46 17959 1 . MET 47 47 17959 1 . THR 48 48 17959 1 . VAL 49 49 17959 1 . ALA 50 50 17959 1 . SER 51 51 17959 1 . LEU 52 52 17959 1 . LYS 53 53 17959 1 . ASP 54 54 17959 1 . MET 55 55 17959 1 . VAL 56 56 17959 1 . PHE 57 57 17959 1 . LEU 58 58 17959 1 . ASP 59 59 17959 1 . TYR 60 60 17959 1 . GLY 61 61 17959 1 . PHE 62 62 17959 1 . PRO 63 63 17959 1 . PRO 64 64 17959 1 . VAL 65 65 17959 1 . LEU 66 66 17959 1 . GLN 67 67 17959 1 . GLN 68 68 17959 1 . TRP 69 69 17959 1 . VAL 70 70 17959 1 . ILE 71 71 17959 1 . GLY 72 72 17959 1 . GLN 73 73 17959 1 . ARG 74 74 17959 1 . LEU 75 75 17959 1 . ALA 76 76 17959 1 . ARG 77 77 17959 1 . ASP 78 78 17959 1 . GLN 79 79 17959 1 . GLU 80 80 17959 1 . THR 81 81 17959 1 . LEU 82 82 17959 1 . HIS 83 83 17959 1 . SER 84 84 17959 1 . HIS 85 85 17959 1 . GLY 86 86 17959 1 . VAL 87 87 17959 1 . ARG 88 88 17959 1 . GLN 89 89 17959 1 . ASN 90 90 17959 1 . GLY 91 91 17959 1 . ASP 92 92 17959 1 . SER 93 93 17959 1 . ALA 94 94 17959 1 . TYR 95 95 17959 1 . LEU 96 96 17959 1 . TYR 97 97 17959 1 . LEU 98 98 17959 1 . LEU 99 99 17959 1 . SER 100 100 17959 1 . ALA 101 101 17959 1 . ARG 102 102 17959 1 . ASN 103 103 17959 1 . THR 104 104 17959 1 . SER 105 105 17959 1 . LEU 106 106 17959 1 . ASN 107 107 17959 1 . PRO 108 108 17959 1 . GLN 109 109 17959 1 . GLU 110 110 17959 1 . LEU 111 111 17959 1 . GLN 112 112 17959 1 . ARG 113 113 17959 1 . GLU 114 114 17959 1 . ARG 115 115 17959 1 . GLN 116 116 17959 1 . LEU 117 117 17959 1 . ARG 118 118 17959 1 . MET 119 119 17959 1 . LEU 120 120 17959 1 . GLN 121 121 17959 1 . ASP 122 122 17959 1 . LEU 123 123 17959 1 . GLY 124 124 17959 1 . PHE 125 125 17959 1 . LYS 126 126 17959 1 . ASP 127 127 17959 1 . LEU 128 128 17959 1 . THR 129 129 17959 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 17959 _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 $HOIL-1L . 9606 organism . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . . . . . . . . . 17959 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 17959 _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 $HOIL-1L . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . . . . . . . . . . . . . . pET-28b . . . . . . 17959 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 17959 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 'acetic acid' 'natural abundance' . . . . . . 10 . . mM . . . . 17959 1 2 HOIL-1L '[U-100% 13C; U-100% 15N]' . . 1 $HOIL-1L . . 0.5 . . mM . . . . 17959 1 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID 17959 _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 . M 17959 1 pH 4.0 . pH 17959 1 pressure 1 . atm 17959 1 temperature 303 . K 17959 1 stop_ save_ ############################ # Computer software used # ############################ save_CcpNmr_Analysis _Software.Sf_category software _Software.Sf_framecode CcpNmr_Analysis _Software.Entry_ID 17959 _Software.ID 1 _Software.Name ANALYSIS _Software.Version 2.1.5 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID CCPN . . 17959 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 17959 1 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 17959 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer JEOL _NMR_spectrometer.Model ECA _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 17959 _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 JEOL ECA . 600 . . . 17959 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 17959 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17959 1 2 '2D 1H-13C HSQC aliphatic' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17959 1 3 '3D HNCO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17959 1 4 '3D HN(CA)CO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17959 1 5 '3D HNCA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17959 1 6 '3D HN(CO)CA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17959 1 7 '3D HNCACB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17959 1 8 '3D CBCA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17959 1 9 '3D HCCH-TOCSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17959 1 10 '3D HCCH-COSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17959 1 11 '3D HBHA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17959 1 12 '3D H(CCO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17959 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 17959 _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 na indirect 0.25144952 . . . . . . . . . 17959 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . . . . . 17959 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.10132905 . . . . . . . . . 17959 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 17959 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err 0.02 _Assigned_chem_shift_list.Chem_shift_13C_err 0.2 _Assigned_chem_shift_list.Chem_shift_15N_err 0.2 _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' . . . 17959 1 2 '2D 1H-13C HSQC aliphatic' . . . 17959 1 3 '3D HNCO' . . . 17959 1 4 '3D HN(CA)CO' . . . 17959 1 5 '3D HNCA' . . . 17959 1 6 '3D HN(CO)CA' . . . 17959 1 7 '3D HNCACB' . . . 17959 1 8 '3D CBCA(CO)NH' . . . 17959 1 9 '3D HCCH-TOCSY' . . . 17959 1 10 '3D HCCH-COSY' . . . 17959 1 11 '3D HBHA(CO)NH' . . . 17959 1 12 '3D H(CCO)NH' . . . 17959 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 GLY C C 13 170.38 0.2 . 1 . . . . 1 GLY C . 17959 1 2 . 1 1 1 1 GLY CA C 13 43.37 0.2 . 1 . . . . 1 GLY CA . 17959 1 3 . 1 1 2 2 SER H H 1 8.597 0.02 . 1 . . . . 2 SER H . 17959 1 4 . 1 1 2 2 SER HA H 1 4.450 0.02 . 1 . . . . 2 SER HA . 17959 1 5 . 1 1 2 2 SER HB2 H 1 3.785 0.02 . 2 . . . . 2 SER HB2 . 17959 1 6 . 1 1 2 2 SER HB3 H 1 3.785 0.02 . 2 . . . . 2 SER HB3 . 17959 1 7 . 1 1 2 2 SER C C 13 174.54 0.2 . 1 . . . . 2 SER C . 17959 1 8 . 1 1 2 2 SER CA C 13 58.50 0.2 . 1 . . . . 2 SER CA . 17959 1 9 . 1 1 2 2 SER CB C 13 64.50 0.2 . 1 . . . . 2 SER CB . 17959 1 10 . 1 1 2 2 SER N N 15 115.46 0.2 . 1 . . . . 2 SER N . 17959 1 11 . 1 1 3 3 HIS H H 1 8.679 0.02 . 1 . . . . 3 HIS H . 17959 1 12 . 1 1 3 3 HIS HA H 1 4.730 0.02 . 1 . . . . 3 HIS HA . 17959 1 13 . 1 1 3 3 HIS HB2 H 1 3.157 0.02 . 2 . . . . 3 HIS HB2 . 17959 1 14 . 1 1 3 3 HIS HB3 H 1 3.278 0.02 . 2 . . . . 3 HIS HB3 . 17959 1 15 . 1 1 3 3 HIS C C 13 174.40 0.2 . 1 . . . . 3 HIS C . 17959 1 16 . 1 1 3 3 HIS CA C 13 55.50 0.2 . 1 . . . . 3 HIS CA . 17959 1 17 . 1 1 3 3 HIS CB C 13 28.81 0.2 . 1 . . . . 3 HIS CB . 17959 1 18 . 1 1 3 3 HIS N N 15 120.58 0.2 . 1 . . . . 3 HIS N . 17959 1 19 . 1 1 4 4 MET H H 1 8.395 0.02 . 1 . . . . 4 MET H . 17959 1 20 . 1 1 4 4 MET HA H 1 4.409 0.02 . 1 . . . . 4 MET HA . 17959 1 21 . 1 1 4 4 MET HB2 H 1 1.818 0.02 . 2 . . . . 4 MET HB2 . 17959 1 22 . 1 1 4 4 MET HB3 H 1 1.911 0.02 . 2 . . . . 4 MET HB3 . 17959 1 23 . 1 1 4 4 MET HG2 H 1 2.487 0.02 . 2 . . . . 4 MET HG2 . 17959 1 24 . 1 1 4 4 MET HG3 H 1 2.535 0.02 . 2 . . . . 4 MET HG3 . 17959 1 25 . 1 1 4 4 MET C C 13 176.04 0.2 . 1 . . . . 4 MET C . 17959 1 26 . 1 1 4 4 MET CA C 13 55.71 0.2 . 1 . . . . 4 MET CA . 17959 1 27 . 1 1 4 4 MET CB C 13 33.00 0.2 . 1 . . . . 4 MET CB . 17959 1 28 . 1 1 4 4 MET CG C 13 32.27 0.2 . 1 . . . . 4 MET CG . 17959 1 29 . 1 1 4 4 MET N N 15 121.96 0.2 . 1 . . . . 4 MET N . 17959 1 30 . 1 1 5 5 GLN H H 1 8.454 0.02 . 1 . . . . 5 GLN H . 17959 1 31 . 1 1 5 5 GLN HA H 1 4.319 0.02 . 1 . . . . 5 GLN HA . 17959 1 32 . 1 1 5 5 GLN HB2 H 1 2.049 0.02 . 2 . . . . 5 GLN HB2 . 17959 1 33 . 1 1 5 5 GLN HB3 H 1 1.928 0.02 . 2 . . . . 5 GLN HB3 . 17959 1 34 . 1 1 5 5 GLN HG2 H 1 2.333 0.02 . 2 . . . . 5 GLN HG2 . 17959 1 35 . 1 1 5 5 GLN HG3 H 1 2.333 0.02 . 2 . . . . 5 GLN HG3 . 17959 1 36 . 1 1 5 5 GLN C C 13 175.77 0.2 . 1 . . . . 5 GLN C . 17959 1 37 . 1 1 5 5 GLN CA C 13 55.91 0.2 . 1 . . . . 5 GLN CA . 17959 1 38 . 1 1 5 5 GLN CB C 13 29.76 0.2 . 1 . . . . 5 GLN CB . 17959 1 39 . 1 1 5 5 GLN CG C 13 34.17 0.2 . 1 . . . . 5 GLN CG . 17959 1 40 . 1 1 5 5 GLN N N 15 122.64 0.2 . 1 . . . . 5 GLN N . 17959 1 41 . 1 1 6 6 ARG H H 1 8.396 0.02 . 1 . . . . 6 ARG H . 17959 1 42 . 1 1 6 6 ARG HA H 1 4.318 0.02 . 1 . . . . 6 ARG HA . 17959 1 43 . 1 1 6 6 ARG HB2 H 1 1.788 0.02 . 2 . . . . 6 ARG HB2 . 17959 1 44 . 1 1 6 6 ARG HB3 H 1 1.700 0.02 . 2 . . . . 6 ARG HB3 . 17959 1 45 . 1 1 6 6 ARG HG2 H 1 1.561 0.02 . 2 . . . . 6 ARG HG2 . 17959 1 46 . 1 1 6 6 ARG HG3 H 1 1.561 0.02 . 2 . . . . 6 ARG HG3 . 17959 1 47 . 1 1 6 6 ARG HD2 H 1 3.171 0.02 . 2 . . . . 6 ARG HD2 . 17959 1 48 . 1 1 6 6 ARG HD3 H 1 3.171 0.02 . 2 . . . . 6 ARG HD3 . 17959 1 49 . 1 1 6 6 ARG C C 13 176.12 0.2 . 1 . . . . 6 ARG C . 17959 1 50 . 1 1 6 6 ARG CA C 13 56.21 0.2 . 1 . . . . 6 ARG CA . 17959 1 51 . 1 1 6 6 ARG CB C 13 30.77 0.2 . 1 . . . . 6 ARG CB . 17959 1 52 . 1 1 6 6 ARG CG C 13 27.59 0.2 . 1 . . . . 6 ARG CG . 17959 1 53 . 1 1 6 6 ARG CD C 13 43.66 0.2 . 1 . . . . 6 ARG CD . 17959 1 54 . 1 1 6 6 ARG N N 15 123.22 0.2 . 1 . . . . 6 ARG N . 17959 1 55 . 1 1 7 7 VAL H H 1 8.176 0.02 . 1 . . . . 7 VAL H . 17959 1 56 . 1 1 7 7 VAL HA H 1 4.416 0.02 . 1 . . . . 7 VAL HA . 17959 1 57 . 1 1 7 7 VAL HB H 1 2.062 0.02 . 1 . . . . 7 VAL HB . 17959 1 58 . 1 1 7 7 VAL HG11 H 1 0.917 0.02 . 2 . . . . 7 VAL MG1 . 17959 1 59 . 1 1 7 7 VAL HG12 H 1 0.917 0.02 . 2 . . . . 7 VAL MG1 . 17959 1 60 . 1 1 7 7 VAL HG13 H 1 0.917 0.02 . 2 . . . . 7 VAL MG1 . 17959 1 61 . 1 1 7 7 VAL HG21 H 1 0.963 0.02 . 2 . . . . 7 VAL MG2 . 17959 1 62 . 1 1 7 7 VAL HG22 H 1 0.963 0.02 . 2 . . . . 7 VAL MG2 . 17959 1 63 . 1 1 7 7 VAL HG23 H 1 0.963 0.02 . 2 . . . . 7 VAL MG2 . 17959 1 64 . 1 1 7 7 VAL C C 13 174.55 0.2 . 1 . . . . 7 VAL C . 17959 1 65 . 1 1 7 7 VAL CA C 13 60.12 0.2 . 1 . . . . 7 VAL CA . 17959 1 66 . 1 1 7 7 VAL CB C 13 32.88 0.2 . 1 . . . . 7 VAL CB . 17959 1 67 . 1 1 7 7 VAL CG1 C 13 21.38 0.2 . 2 . . . . 7 VAL CG1 . 17959 1 68 . 1 1 7 7 VAL CG2 C 13 21.32 0.2 . 2 . . . . 7 VAL CG2 . 17959 1 69 . 1 1 7 7 VAL N N 15 123.17 0.2 . 1 . . . . 7 VAL N . 17959 1 70 . 1 1 8 8 PRO HA H 1 4.384 0.02 . 1 . . . . 8 PRO HA . 17959 1 71 . 1 1 8 8 PRO HB2 H 1 1.871 0.02 . 2 . . . . 8 PRO HB2 . 17959 1 72 . 1 1 8 8 PRO HB3 H 1 2.265 0.02 . 2 . . . . 8 PRO HB3 . 17959 1 73 . 1 1 8 8 PRO HG2 H 1 1.984 0.02 . 2 . . . . 8 PRO HG2 . 17959 1 74 . 1 1 8 8 PRO HG3 H 1 1.984 0.02 . 2 . . . . 8 PRO HG3 . 17959 1 75 . 1 1 8 8 PRO HD2 H 1 3.643 0.02 . 2 . . . . 8 PRO HD2 . 17959 1 76 . 1 1 8 8 PRO HD3 H 1 3.643 0.02 . 2 . . . . 8 PRO HD3 . 17959 1 77 . 1 1 8 8 PRO C C 13 176.88 0.2 . 1 . . . . 8 PRO C . 17959 1 78 . 1 1 8 8 PRO CA C 13 63.34 0.2 . 1 . . . . 8 PRO CA . 17959 1 79 . 1 1 8 8 PRO CB C 13 32.17 0.2 . 1 . . . . 8 PRO CB . 17959 1 80 . 1 1 8 8 PRO CG C 13 27.72 0.2 . 1 . . . . 8 PRO CG . 17959 1 81 . 1 1 8 8 PRO CD C 13 51.32 0.2 . 1 . . . . 8 PRO CD . 17959 1 82 . 1 1 9 9 LEU H H 1 8.249 0.02 . 1 . . . . 9 LEU H . 17959 1 83 . 1 1 9 9 LEU HA H 1 4.278 0.02 . 1 . . . . 9 LEU HA . 17959 1 84 . 1 1 9 9 LEU HB2 H 1 1.559 0.02 . 2 . . . . 9 LEU HB2 . 17959 1 85 . 1 1 9 9 LEU HB3 H 1 1.559 0.02 . 2 . . . . 9 LEU HB3 . 17959 1 86 . 1 1 9 9 LEU HG H 1 1.611 0.02 . 1 . . . . 9 LEU HG . 17959 1 87 . 1 1 9 9 LEU HD11 H 1 0.893 0.02 . 2 . . . . 9 LEU MD1 . 17959 1 88 . 1 1 9 9 LEU HD12 H 1 0.893 0.02 . 2 . . . . 9 LEU MD1 . 17959 1 89 . 1 1 9 9 LEU HD13 H 1 0.893 0.02 . 2 . . . . 9 LEU MD1 . 17959 1 90 . 1 1 9 9 LEU HD21 H 1 0.893 0.02 . 2 . . . . 9 LEU MD2 . 17959 1 91 . 1 1 9 9 LEU HD22 H 1 0.893 0.02 . 2 . . . . 9 LEU MD2 . 17959 1 92 . 1 1 9 9 LEU HD23 H 1 0.893 0.02 . 2 . . . . 9 LEU MD2 . 17959 1 93 . 1 1 9 9 LEU C C 13 177.75 0.2 . 1 . . . . 9 LEU C . 17959 1 94 . 1 1 9 9 LEU CA C 13 55.65 0.2 . 1 . . . . 9 LEU CA . 17959 1 95 . 1 1 9 9 LEU CB C 13 42.76 0.2 . 1 . . . . 9 LEU CB . 17959 1 96 . 1 1 9 9 LEU CG C 13 27.45 0.2 . 1 . . . . 9 LEU CG . 17959 1 97 . 1 1 9 9 LEU CD1 C 13 25.30 0.2 . 2 . . . . 9 LEU CD1 . 17959 1 98 . 1 1 9 9 LEU CD2 C 13 25.30 0.2 . 2 . . . . 9 LEU CD2 . 17959 1 99 . 1 1 9 9 LEU N N 15 122.56 0.2 . 1 . . . . 9 LEU N . 17959 1 100 . 1 1 10 10 SER H H 1 8.234 0.02 . 1 . . . . 10 SER H . 17959 1 101 . 1 1 10 10 SER HA H 1 4.417 0.02 . 1 . . . . 10 SER HA . 17959 1 102 . 1 1 10 10 SER HB2 H 1 3.806 0.02 . 2 . . . . 10 SER HB2 . 17959 1 103 . 1 1 10 10 SER HB3 H 1 3.806 0.02 . 2 . . . . 10 SER HB3 . 17959 1 104 . 1 1 10 10 SER C C 13 174.72 0.2 . 1 . . . . 10 SER C . 17959 1 105 . 1 1 10 10 SER CA C 13 58.52 0.2 . 1 . . . . 10 SER CA . 17959 1 106 . 1 1 10 10 SER CB C 13 64.11 0.2 . 1 . . . . 10 SER CB . 17959 1 107 . 1 1 10 10 SER N N 15 116.49 0.2 . 1 . . . . 10 SER N . 17959 1 108 . 1 1 11 11 VAL H H 1 8.016 0.02 . 1 . . . . 11 VAL H . 17959 1 109 . 1 1 11 11 VAL HA H 1 4.107 0.02 . 1 . . . . 11 VAL HA . 17959 1 110 . 1 1 11 11 VAL HB H 1 2.022 0.02 . 1 . . . . 11 VAL HB . 17959 1 111 . 1 1 11 11 VAL HG11 H 1 0.899 0.02 . 2 . . . . 11 VAL MG1 . 17959 1 112 . 1 1 11 11 VAL HG12 H 1 0.899 0.02 . 2 . . . . 11 VAL MG1 . 17959 1 113 . 1 1 11 11 VAL HG13 H 1 0.899 0.02 . 2 . . . . 11 VAL MG1 . 17959 1 114 . 1 1 11 11 VAL HG21 H 1 0.899 0.02 . 2 . . . . 11 VAL MG2 . 17959 1 115 . 1 1 11 11 VAL HG22 H 1 0.899 0.02 . 2 . . . . 11 VAL MG2 . 17959 1 116 . 1 1 11 11 VAL HG23 H 1 0.899 0.02 . 2 . . . . 11 VAL MG2 . 17959 1 117 . 1 1 11 11 VAL C C 13 176.05 0.2 . 1 . . . . 11 VAL C . 17959 1 118 . 1 1 11 11 VAL CA C 13 62.58 0.2 . 1 . . . . 11 VAL CA . 17959 1 119 . 1 1 11 11 VAL CB C 13 32.92 0.2 . 1 . . . . 11 VAL CB . 17959 1 120 . 1 1 11 11 VAL CG1 C 13 21.14 0.2 . 2 . . . . 11 VAL CG1 . 17959 1 121 . 1 1 11 11 VAL CG2 C 13 21.14 0.2 . 2 . . . . 11 VAL CG2 . 17959 1 122 . 1 1 11 11 VAL N N 15 121.63 0.2 . 1 . . . . 11 VAL N . 17959 1 123 . 1 1 12 12 GLN H H 1 8.312 0.02 . 1 . . . . 12 GLN H . 17959 1 124 . 1 1 12 12 GLN HA H 1 4.307 0.02 . 1 . . . . 12 GLN HA . 17959 1 125 . 1 1 12 12 GLN HB2 H 1 1.997 0.02 . 2 . . . . 12 GLN HB2 . 17959 1 126 . 1 1 12 12 GLN HB3 H 1 1.994 0.02 . 2 . . . . 12 GLN HB3 . 17959 1 127 . 1 1 12 12 GLN HG2 H 1 2.309 0.02 . 2 . . . . 12 GLN HG2 . 17959 1 128 . 1 1 12 12 GLN HG3 H 1 2.309 0.02 . 2 . . . . 12 GLN HG3 . 17959 1 129 . 1 1 12 12 GLN C C 13 175.86 0.2 . 1 . . . . 12 GLN C . 17959 1 130 . 1 1 12 12 GLN CA C 13 55.87 0.2 . 1 . . . . 12 GLN CA . 17959 1 131 . 1 1 12 12 GLN CB C 13 29.43 0.2 . 1 . . . . 12 GLN CB . 17959 1 132 . 1 1 12 12 GLN CG C 13 34.21 0.2 . 1 . . . . 12 GLN CG . 17959 1 133 . 1 1 12 12 GLN N N 15 123.91 0.2 . 1 . . . . 12 GLN N . 17959 1 134 . 1 1 13 13 LEU H H 1 8.236 0.02 . 1 . . . . 13 LEU H . 17959 1 135 . 1 1 13 13 LEU HA H 1 4.318 0.02 . 1 . . . . 13 LEU HA . 17959 1 136 . 1 1 13 13 LEU HB2 H 1 1.564 0.02 . 2 . . . . 13 LEU HB2 . 17959 1 137 . 1 1 13 13 LEU HB3 H 1 1.564 0.02 . 2 . . . . 13 LEU HB3 . 17959 1 138 . 1 1 13 13 LEU HG H 1 1.500 0.02 . 1 . . . . 13 LEU HG . 17959 1 139 . 1 1 13 13 LEU HD11 H 1 0.850 0.02 . 2 . . . . 13 LEU MD1 . 17959 1 140 . 1 1 13 13 LEU HD12 H 1 0.850 0.02 . 2 . . . . 13 LEU MD1 . 17959 1 141 . 1 1 13 13 LEU HD13 H 1 0.850 0.02 . 2 . . . . 13 LEU MD1 . 17959 1 142 . 1 1 13 13 LEU HD21 H 1 0.897 0.02 . 2 . . . . 13 LEU MD2 . 17959 1 143 . 1 1 13 13 LEU HD22 H 1 0.897 0.02 . 2 . . . . 13 LEU MD2 . 17959 1 144 . 1 1 13 13 LEU HD23 H 1 0.897 0.02 . 2 . . . . 13 LEU MD2 . 17959 1 145 . 1 1 13 13 LEU C C 13 177.12 0.2 . 1 . . . . 13 LEU C . 17959 1 146 . 1 1 13 13 LEU CA C 13 55.25 0.2 . 1 . . . . 13 LEU CA . 17959 1 147 . 1 1 13 13 LEU CB C 13 42.74 0.2 . 1 . . . . 13 LEU CB . 17959 1 148 . 1 1 13 13 LEU CG C 13 27.48 0.2 . 1 . . . . 13 LEU CG . 17959 1 149 . 1 1 13 13 LEU CD1 C 13 25.72 0.2 . 2 . . . . 13 LEU CD1 . 17959 1 150 . 1 1 13 13 LEU CD2 C 13 25.23 0.2 . 2 . . . . 13 LEU CD2 . 17959 1 151 . 1 1 13 13 LEU N N 15 124.27 0.2 . 1 . . . . 13 LEU N . 17959 1 152 . 1 1 14 14 LYS H H 1 8.237 0.02 . 1 . . . . 14 LYS H . 17959 1 153 . 1 1 14 14 LYS HA H 1 4.583 0.02 . 1 . . . . 14 LYS HA . 17959 1 154 . 1 1 14 14 LYS HB2 H 1 1.812 0.02 . 2 . . . . 14 LYS HB2 . 17959 1 155 . 1 1 14 14 LYS HB3 H 1 1.812 0.02 . 2 . . . . 14 LYS HB3 . 17959 1 156 . 1 1 14 14 LYS HG2 H 1 1.444 0.02 . 2 . . . . 14 LYS HG2 . 17959 1 157 . 1 1 14 14 LYS HG3 H 1 1.407 0.02 . 2 . . . . 14 LYS HG3 . 17959 1 158 . 1 1 14 14 LYS HD2 H 1 1.693 0.02 . 2 . . . . 14 LYS HD2 . 17959 1 159 . 1 1 14 14 LYS HD3 H 1 1.693 0.02 . 2 . . . . 14 LYS HD3 . 17959 1 160 . 1 1 14 14 LYS HE2 H 1 2.984 0.02 . 2 . . . . 14 LYS HE2 . 17959 1 161 . 1 1 14 14 LYS HE3 H 1 2.984 0.02 . 2 . . . . 14 LYS HE3 . 17959 1 162 . 1 1 14 14 LYS C C 13 174.44 0.2 . 1 . . . . 14 LYS C . 17959 1 163 . 1 1 14 14 LYS CA C 13 54.27 0.2 . 1 . . . . 14 LYS CA . 17959 1 164 . 1 1 14 14 LYS CB C 13 32.66 0.2 . 1 . . . . 14 LYS CB . 17959 1 165 . 1 1 14 14 LYS CG C 13 24.89 0.2 . 1 . . . . 14 LYS CG . 17959 1 166 . 1 1 14 14 LYS CD C 13 29.59 0.2 . 1 . . . . 14 LYS CD . 17959 1 167 . 1 1 14 14 LYS CE C 13 42.52 0.2 . 1 . . . . 14 LYS CE . 17959 1 168 . 1 1 14 14 LYS N N 15 123.42 0.2 . 1 . . . . 14 LYS N . 17959 1 169 . 1 1 15 15 PRO HA H 1 4.373 0.02 . 1 . . . . 15 PRO HA . 17959 1 170 . 1 1 15 15 PRO HB2 H 1 2.047 0.02 . 2 . . . . 15 PRO HB2 . 17959 1 171 . 1 1 15 15 PRO HB3 H 1 2.575 0.02 . 2 . . . . 15 PRO HB3 . 17959 1 172 . 1 1 15 15 PRO HG2 H 1 1.983 0.02 . 2 . . . . 15 PRO HG2 . 17959 1 173 . 1 1 15 15 PRO HG3 H 1 1.983 0.02 . 2 . . . . 15 PRO HG3 . 17959 1 174 . 1 1 15 15 PRO HD2 H 1 3.772 0.02 . 2 . . . . 15 PRO HD2 . 17959 1 175 . 1 1 15 15 PRO HD3 H 1 3.630 0.02 . 2 . . . . 15 PRO HD3 . 17959 1 176 . 1 1 15 15 PRO C C 13 176.35 0.2 . 1 . . . . 15 PRO C . 17959 1 177 . 1 1 15 15 PRO CA C 13 63.38 0.2 . 1 . . . . 15 PRO CA . 17959 1 178 . 1 1 15 15 PRO CB C 13 32.23 0.2 . 1 . . . . 15 PRO CB . 17959 1 179 . 1 1 15 15 PRO CG C 13 27.64 0.2 . 1 . . . . 15 PRO CG . 17959 1 180 . 1 1 15 15 PRO CD C 13 51.04 0.2 . 1 . . . . 15 PRO CD . 17959 1 181 . 1 1 16 16 GLU H H 1 8.439 0.02 . 1 . . . . 16 GLU H . 17959 1 182 . 1 1 16 16 GLU HA H 1 4.319 0.02 . 1 . . . . 16 GLU HA . 17959 1 183 . 1 1 16 16 GLU HB2 H 1 2.019 0.02 . 2 . . . . 16 GLU HB2 . 17959 1 184 . 1 1 16 16 GLU HB3 H 1 1.909 0.02 . 2 . . . . 16 GLU HB3 . 17959 1 185 . 1 1 16 16 GLU HG2 H 1 2.357 0.02 . 2 . . . . 16 GLU HG2 . 17959 1 186 . 1 1 16 16 GLU HG3 H 1 2.357 0.02 . 2 . . . . 16 GLU HG3 . 17959 1 187 . 1 1 16 16 GLU C C 13 176.35 0.2 . 1 . . . . 16 GLU C . 17959 1 188 . 1 1 16 16 GLU CA C 13 56.30 0.2 . 1 . . . . 16 GLU CA . 17959 1 189 . 1 1 16 16 GLU CB C 13 29.57 0.2 . 1 . . . . 16 GLU CB . 17959 1 190 . 1 1 16 16 GLU CG C 13 34.65 0.2 . 1 . . . . 16 GLU CG . 17959 1 191 . 1 1 16 16 GLU N N 15 121.32 0.2 . 1 . . . . 16 GLU N . 17959 1 192 . 1 1 17 17 VAL H H 1 8.159 0.02 . 1 . . . . 17 VAL H . 17959 1 193 . 1 1 17 17 VAL HA H 1 4.129 0.02 . 1 . . . . 17 VAL HA . 17959 1 194 . 1 1 17 17 VAL HB H 1 2.025 0.02 . 1 . . . . 17 VAL HB . 17959 1 195 . 1 1 17 17 VAL HG11 H 1 0.888 0.02 . 2 . . . . 17 VAL MG1 . 17959 1 196 . 1 1 17 17 VAL HG12 H 1 0.888 0.02 . 2 . . . . 17 VAL MG1 . 17959 1 197 . 1 1 17 17 VAL HG13 H 1 0.888 0.02 . 2 . . . . 17 VAL MG1 . 17959 1 198 . 1 1 17 17 VAL HG21 H 1 0.888 0.02 . 2 . . . . 17 VAL MG2 . 17959 1 199 . 1 1 17 17 VAL HG22 H 1 0.888 0.02 . 2 . . . . 17 VAL MG2 . 17959 1 200 . 1 1 17 17 VAL HG23 H 1 0.888 0.02 . 2 . . . . 17 VAL MG2 . 17959 1 201 . 1 1 17 17 VAL C C 13 176.07 0.2 . 1 . . . . 17 VAL C . 17959 1 202 . 1 1 17 17 VAL CA C 13 62.23 0.2 . 1 . . . . 17 VAL CA . 17959 1 203 . 1 1 17 17 VAL CB C 13 32.94 0.2 . 1 . . . . 17 VAL CB . 17959 1 204 . 1 1 17 17 VAL CG1 C 13 20.73 0.2 . 2 . . . . 17 VAL CG1 . 17959 1 205 . 1 1 17 17 VAL CG2 C 13 20.73 0.2 . 2 . . . . 17 VAL CG2 . 17959 1 206 . 1 1 17 17 VAL N N 15 121.52 0.2 . 1 . . . . 17 VAL N . 17959 1 207 . 1 1 18 18 SER H H 1 8.403 0.02 . 1 . . . . 18 SER H . 17959 1 208 . 1 1 18 18 SER HA H 1 4.745 0.02 . 1 . . . . 18 SER HA . 17959 1 209 . 1 1 18 18 SER HB2 H 1 3.828 0.02 . 2 . . . . 18 SER HB2 . 17959 1 210 . 1 1 18 18 SER HB3 H 1 3.828 0.02 . 2 . . . . 18 SER HB3 . 17959 1 211 . 1 1 18 18 SER C C 13 173.29 0.2 . 1 . . . . 18 SER C . 17959 1 212 . 1 1 18 18 SER CA C 13 56.42 0.2 . 1 . . . . 18 SER CA . 17959 1 213 . 1 1 18 18 SER CB C 13 63.90 0.2 . 1 . . . . 18 SER CB . 17959 1 214 . 1 1 18 18 SER N N 15 121.02 0.2 . 1 . . . . 18 SER N . 17959 1 215 . 1 1 19 19 PRO HA H 1 4.477 0.02 . 1 . . . . 19 PRO HA . 17959 1 216 . 1 1 19 19 PRO HB2 H 1 1.887 0.02 . 2 . . . . 19 PRO HB2 . 17959 1 217 . 1 1 19 19 PRO HB3 H 1 2.278 0.02 . 2 . . . . 19 PRO HB3 . 17959 1 218 . 1 1 19 19 PRO HG2 H 1 1.981 0.02 . 2 . . . . 19 PRO HG2 . 17959 1 219 . 1 1 19 19 PRO HG3 H 1 1.981 0.02 . 2 . . . . 19 PRO HG3 . 17959 1 220 . 1 1 19 19 PRO HD2 H 1 3.635 0.02 . 2 . . . . 19 PRO HD2 . 17959 1 221 . 1 1 19 19 PRO HD3 H 1 3.765 0.02 . 2 . . . . 19 PRO HD3 . 17959 1 222 . 1 1 19 19 PRO C C 13 177.12 0.2 . 1 . . . . 19 PRO C . 17959 1 223 . 1 1 19 19 PRO CA C 13 63.86 0.2 . 1 . . . . 19 PRO CA . 17959 1 224 . 1 1 19 19 PRO CB C 13 32.20 0.2 . 1 . . . . 19 PRO CB . 17959 1 225 . 1 1 19 19 PRO CG C 13 27.69 0.2 . 1 . . . . 19 PRO CG . 17959 1 226 . 1 1 19 19 PRO CD C 13 51.06 0.2 . 1 . . . . 19 PRO CD . 17959 1 227 . 1 1 20 20 THR H H 1 8.022 0.02 . 1 . . . . 20 THR H . 17959 1 228 . 1 1 20 20 THR HA H 1 4.291 0.02 . 1 . . . . 20 THR HA . 17959 1 229 . 1 1 20 20 THR HB H 1 4.231 0.02 . 1 . . . . 20 THR HB . 17959 1 230 . 1 1 20 20 THR HG21 H 1 1.176 0.02 . 1 . . . . 20 THR MG . 17959 1 231 . 1 1 20 20 THR HG22 H 1 1.176 0.02 . 1 . . . . 20 THR MG . 17959 1 232 . 1 1 20 20 THR HG23 H 1 1.176 0.02 . 1 . . . . 20 THR MG . 17959 1 233 . 1 1 20 20 THR C C 13 174.44 0.2 . 1 . . . . 20 THR C . 17959 1 234 . 1 1 20 20 THR CA C 13 62.05 0.2 . 1 . . . . 20 THR CA . 17959 1 235 . 1 1 20 20 THR CB C 13 70.22 0.2 . 1 . . . . 20 THR CB . 17959 1 236 . 1 1 20 20 THR CG2 C 13 21.95 0.2 . 1 . . . . 20 THR CG2 . 17959 1 237 . 1 1 20 20 THR N N 15 112.75 0.2 . 1 . . . . 20 THR N . 17959 1 238 . 1 1 21 21 GLN H H 1 8.114 0.02 . 1 . . . . 21 GLN H . 17959 1 239 . 1 1 21 21 GLN HA H 1 4.313 0.02 . 1 . . . . 21 GLN HA . 17959 1 240 . 1 1 21 21 GLN HB2 H 1 2.105 0.02 . 2 . . . . 21 GLN HB2 . 17959 1 241 . 1 1 21 21 GLN HB3 H 1 1.924 0.02 . 2 . . . . 21 GLN HB3 . 17959 1 242 . 1 1 21 21 GLN HG2 H 1 2.322 0.02 . 2 . . . . 21 GLN HG2 . 17959 1 243 . 1 1 21 21 GLN HG3 H 1 2.322 0.02 . 2 . . . . 21 GLN HG3 . 17959 1 244 . 1 1 21 21 GLN C C 13 175.00 0.2 . 1 . . . . 21 GLN C . 17959 1 245 . 1 1 21 21 GLN CA C 13 55.98 0.2 . 1 . . . . 21 GLN CA . 17959 1 246 . 1 1 21 21 GLN CB C 13 30.09 0.2 . 1 . . . . 21 GLN CB . 17959 1 247 . 1 1 21 21 GLN CG C 13 34.22 0.2 . 1 . . . . 21 GLN CG . 17959 1 248 . 1 1 21 21 GLN N N 15 122.13 0.2 . 1 . . . . 21 GLN N . 17959 1 249 . 1 1 22 22 ASP H H 1 7.950 0.02 . 1 . . . . 22 ASP H . 17959 1 250 . 1 1 22 22 ASP HA H 1 4.874 0.02 . 1 . . . . 22 ASP HA . 17959 1 251 . 1 1 22 22 ASP HB2 H 1 2.475 0.02 . 2 . . . . 22 ASP HB2 . 17959 1 252 . 1 1 22 22 ASP HB3 H 1 2.554 0.02 . 2 . . . . 22 ASP HB3 . 17959 1 253 . 1 1 22 22 ASP C C 13 175.87 0.2 . 1 . . . . 22 ASP C . 17959 1 254 . 1 1 22 22 ASP CA C 13 54.01 0.2 . 1 . . . . 22 ASP CA . 17959 1 255 . 1 1 22 22 ASP CB C 13 40.66 0.2 . 1 . . . . 22 ASP CB . 17959 1 256 . 1 1 22 22 ASP N N 15 119.52 0.2 . 1 . . . . 22 ASP N . 17959 1 257 . 1 1 23 23 ILE H H 1 9.070 0.02 . 1 . . . . 23 ILE H . 17959 1 258 . 1 1 23 23 ILE HA H 1 4.654 0.02 . 1 . . . . 23 ILE HA . 17959 1 259 . 1 1 23 23 ILE HB H 1 1.472 0.02 . 1 . . . . 23 ILE HB . 17959 1 260 . 1 1 23 23 ILE HG12 H 1 1.264 0.02 . 2 . . . . 23 ILE HG12 . 17959 1 261 . 1 1 23 23 ILE HG21 H 1 0.660 0.02 . 1 . . . . 23 ILE MG . 17959 1 262 . 1 1 23 23 ILE HG22 H 1 0.660 0.02 . 1 . . . . 23 ILE MG . 17959 1 263 . 1 1 23 23 ILE HG23 H 1 0.660 0.02 . 1 . . . . 23 ILE MG . 17959 1 264 . 1 1 23 23 ILE HD11 H 1 0.510 0.02 . 1 . . . . 23 ILE MD . 17959 1 265 . 1 1 23 23 ILE HD12 H 1 0.510 0.02 . 1 . . . . 23 ILE MD . 17959 1 266 . 1 1 23 23 ILE HD13 H 1 0.510 0.02 . 1 . . . . 23 ILE MD . 17959 1 267 . 1 1 23 23 ILE C C 13 174.61 0.2 . 1 . . . . 23 ILE C . 17959 1 268 . 1 1 23 23 ILE CA C 13 59.31 0.2 . 1 . . . . 23 ILE CA . 17959 1 269 . 1 1 23 23 ILE CB C 13 42.77 0.2 . 1 . . . . 23 ILE CB . 17959 1 270 . 1 1 23 23 ILE CG1 C 13 27.38 0.2 . 1 . . . . 23 ILE CG1 . 17959 1 271 . 1 1 23 23 ILE CG2 C 13 18.97 0.2 . 1 . . . . 23 ILE CG2 . 17959 1 272 . 1 1 23 23 ILE CD1 C 13 14.85 0.2 . 1 . . . . 23 ILE CD1 . 17959 1 273 . 1 1 23 23 ILE N N 15 117.91 0.2 . 1 . . . . 23 ILE N . 17959 1 274 . 1 1 24 24 ARG H H 1 8.703 0.02 . 1 . . . . 24 ARG H . 17959 1 275 . 1 1 24 24 ARG HA H 1 4.994 0.02 . 1 . . . . 24 ARG HA . 17959 1 276 . 1 1 24 24 ARG HB2 H 1 1.802 0.02 . 2 . . . . 24 ARG HB2 . 17959 1 277 . 1 1 24 24 ARG HB3 H 1 1.939 0.02 . 2 . . . . 24 ARG HB3 . 17959 1 278 . 1 1 24 24 ARG HG2 H 1 1.517 0.02 . 2 . . . . 24 ARG HG2 . 17959 1 279 . 1 1 24 24 ARG HG3 H 1 1.642 0.02 . 2 . . . . 24 ARG HG3 . 17959 1 280 . 1 1 24 24 ARG HD2 H 1 3.166 0.02 . 2 . . . . 24 ARG HD2 . 17959 1 281 . 1 1 24 24 ARG HD3 H 1 3.265 0.02 . 2 . . . . 24 ARG HD3 . 17959 1 282 . 1 1 24 24 ARG C C 13 174.05 0.2 . 1 . . . . 24 ARG C . 17959 1 283 . 1 1 24 24 ARG CA C 13 55.29 0.2 . 1 . . . . 24 ARG CA . 17959 1 284 . 1 1 24 24 ARG CB C 13 30.23 0.2 . 1 . . . . 24 ARG CB . 17959 1 285 . 1 1 24 24 ARG CG C 13 27.54 0.2 . 1 . . . . 24 ARG CG . 17959 1 286 . 1 1 24 24 ARG CD C 13 43.69 0.2 . 1 . . . . 24 ARG CD . 17959 1 287 . 1 1 24 24 ARG N N 15 122.84 0.2 . 1 . . . . 24 ARG N . 17959 1 288 . 1 1 25 25 LEU H H 1 9.532 0.02 . 1 . . . . 25 LEU H . 17959 1 289 . 1 1 25 25 LEU HA H 1 4.724 0.02 . 1 . . . . 25 LEU HA . 17959 1 290 . 1 1 25 25 LEU HB2 H 1 1.116 0.02 . 2 . . . . 25 LEU HB2 . 17959 1 291 . 1 1 25 25 LEU HB3 H 1 1.116 0.02 . 2 . . . . 25 LEU HB3 . 17959 1 292 . 1 1 25 25 LEU HG H 1 1.407 0.02 . 1 . . . . 25 LEU HG . 17959 1 293 . 1 1 25 25 LEU HD11 H 1 0.591 0.02 . 2 . . . . 25 LEU MD1 . 17959 1 294 . 1 1 25 25 LEU HD12 H 1 0.591 0.02 . 2 . . . . 25 LEU MD1 . 17959 1 295 . 1 1 25 25 LEU HD13 H 1 0.591 0.02 . 2 . . . . 25 LEU MD1 . 17959 1 296 . 1 1 25 25 LEU HD21 H 1 0.723 0.02 . 2 . . . . 25 LEU MD2 . 17959 1 297 . 1 1 25 25 LEU HD22 H 1 0.723 0.02 . 2 . . . . 25 LEU MD2 . 17959 1 298 . 1 1 25 25 LEU HD23 H 1 0.723 0.02 . 2 . . . . 25 LEU MD2 . 17959 1 299 . 1 1 25 25 LEU C C 13 174.80 0.2 . 1 . . . . 25 LEU C . 17959 1 300 . 1 1 25 25 LEU CA C 13 53.66 0.2 . 1 . . . . 25 LEU CA . 17959 1 301 . 1 1 25 25 LEU CB C 13 47.05 0.2 . 1 . . . . 25 LEU CB . 17959 1 302 . 1 1 25 25 LEU CG C 13 26.67 0.2 . 1 . . . . 25 LEU CG . 17959 1 303 . 1 1 25 25 LEU CD1 C 13 23.98 0.2 . 2 . . . . 25 LEU CD1 . 17959 1 304 . 1 1 25 25 LEU CD2 C 13 24.24 0.2 . 2 . . . . 25 LEU CD2 . 17959 1 305 . 1 1 25 25 LEU N N 15 130.68 0.2 . 1 . . . . 25 LEU N . 17959 1 306 . 1 1 26 26 TRP H H 1 8.827 0.02 . 1 . . . . 26 TRP H . 17959 1 307 . 1 1 26 26 TRP HA H 1 4.126 0.02 . 1 . . . . 26 TRP HA . 17959 1 308 . 1 1 26 26 TRP HB2 H 1 3.158 0.02 . 2 . . . . 26 TRP HB2 . 17959 1 309 . 1 1 26 26 TRP HB3 H 1 3.272 0.02 . 2 . . . . 26 TRP HB3 . 17959 1 310 . 1 1 26 26 TRP C C 13 175.13 0.2 . 1 . . . . 26 TRP C . 17959 1 311 . 1 1 26 26 TRP CA C 13 56.71 0.2 . 1 . . . . 26 TRP CA . 17959 1 312 . 1 1 26 26 TRP CB C 13 29.38 0.2 . 1 . . . . 26 TRP CB . 17959 1 313 . 1 1 26 26 TRP N N 15 130.22 0.2 . 1 . . . . 26 TRP N . 17959 1 314 . 1 1 27 27 VAL H H 1 8.622 0.02 . 1 . . . . 27 VAL H . 17959 1 315 . 1 1 27 27 VAL HA H 1 4.539 0.02 . 1 . . . . 27 VAL HA . 17959 1 316 . 1 1 27 27 VAL HB H 1 2.046 0.02 . 1 . . . . 27 VAL HB . 17959 1 317 . 1 1 27 27 VAL HG11 H 1 0.857 0.02 . 2 . . . . 27 VAL MG1 . 17959 1 318 . 1 1 27 27 VAL HG12 H 1 0.857 0.02 . 2 . . . . 27 VAL MG1 . 17959 1 319 . 1 1 27 27 VAL HG13 H 1 0.857 0.02 . 2 . . . . 27 VAL MG1 . 17959 1 320 . 1 1 27 27 VAL HG21 H 1 0.857 0.02 . 2 . . . . 27 VAL MG2 . 17959 1 321 . 1 1 27 27 VAL HG22 H 1 0.857 0.02 . 2 . . . . 27 VAL MG2 . 17959 1 322 . 1 1 27 27 VAL HG23 H 1 0.857 0.02 . 2 . . . . 27 VAL MG2 . 17959 1 323 . 1 1 27 27 VAL C C 13 174.85 0.2 . 1 . . . . 27 VAL C . 17959 1 324 . 1 1 27 27 VAL CA C 13 60.69 0.2 . 1 . . . . 27 VAL CA . 17959 1 325 . 1 1 27 27 VAL CB C 13 34.29 0.2 . 1 . . . . 27 VAL CB . 17959 1 326 . 1 1 27 27 VAL CG1 C 13 21.24 0.2 . 2 . . . . 27 VAL CG1 . 17959 1 327 . 1 1 27 27 VAL CG2 C 13 21.24 0.2 . 2 . . . . 27 VAL CG2 . 17959 1 328 . 1 1 27 27 VAL N N 15 126.49 0.2 . 1 . . . . 27 VAL N . 17959 1 329 . 1 1 28 28 SER H H 1 7.369 0.02 . 1 . . . . 28 SER H . 17959 1 330 . 1 1 28 28 SER HA H 1 4.383 0.02 . 1 . . . . 28 SER HA . 17959 1 331 . 1 1 28 28 SER HB2 H 1 3.161 0.02 . 2 . . . . 28 SER HB2 . 17959 1 332 . 1 1 28 28 SER HB3 H 1 3.375 0.02 . 2 . . . . 28 SER HB3 . 17959 1 333 . 1 1 28 28 SER C C 13 173.38 0.2 . 1 . . . . 28 SER C . 17959 1 334 . 1 1 28 28 SER CA C 13 56.92 0.2 . 1 . . . . 28 SER CA . 17959 1 335 . 1 1 28 28 SER CB C 13 63.54 0.2 . 1 . . . . 28 SER CB . 17959 1 336 . 1 1 28 28 SER N N 15 121.08 0.2 . 1 . . . . 28 SER N . 17959 1 337 . 1 1 29 29 VAL H H 1 9.101 0.02 . 1 . . . . 29 VAL H . 17959 1 338 . 1 1 29 29 VAL HA H 1 4.506 0.02 . 1 . . . . 29 VAL HA . 17959 1 339 . 1 1 29 29 VAL HB H 1 1.984 0.02 . 1 . . . . 29 VAL HB . 17959 1 340 . 1 1 29 29 VAL HG11 H 1 0.318 0.02 . 2 . . . . 29 VAL MG1 . 17959 1 341 . 1 1 29 29 VAL HG12 H 1 0.318 0.02 . 2 . . . . 29 VAL MG1 . 17959 1 342 . 1 1 29 29 VAL HG13 H 1 0.318 0.02 . 2 . . . . 29 VAL MG1 . 17959 1 343 . 1 1 29 29 VAL HG21 H 1 0.513 0.02 . 2 . . . . 29 VAL MG2 . 17959 1 344 . 1 1 29 29 VAL HG22 H 1 0.513 0.02 . 2 . . . . 29 VAL MG2 . 17959 1 345 . 1 1 29 29 VAL HG23 H 1 0.513 0.02 . 2 . . . . 29 VAL MG2 . 17959 1 346 . 1 1 29 29 VAL C C 13 175.08 0.2 . 1 . . . . 29 VAL C . 17959 1 347 . 1 1 29 29 VAL CA C 13 60.99 0.2 . 1 . . . . 29 VAL CA . 17959 1 348 . 1 1 29 29 VAL CB C 13 32.18 0.2 . 1 . . . . 29 VAL CB . 17959 1 349 . 1 1 29 29 VAL CG1 C 13 21.12 0.2 . 2 . . . . 29 VAL CG1 . 17959 1 350 . 1 1 29 29 VAL CG2 C 13 21.61 0.2 . 2 . . . . 29 VAL CG2 . 17959 1 351 . 1 1 29 29 VAL N N 15 129.87 0.2 . 1 . . . . 29 VAL N . 17959 1 352 . 1 1 30 30 GLU H H 1 8.655 0.02 . 1 . . . . 30 GLU H . 17959 1 353 . 1 1 30 30 GLU HA H 1 5.188 0.02 . 1 . . . . 30 GLU HA . 17959 1 354 . 1 1 30 30 GLU HB2 H 1 1.940 0.02 . 2 . . . . 30 GLU HB2 . 17959 1 355 . 1 1 30 30 GLU HB3 H 1 2.074 0.02 . 2 . . . . 30 GLU HB3 . 17959 1 356 . 1 1 30 30 GLU HG2 H 1 2.546 0.02 . 2 . . . . 30 GLU HG2 . 17959 1 357 . 1 1 30 30 GLU HG3 H 1 2.546 0.02 . 2 . . . . 30 GLU HG3 . 17959 1 358 . 1 1 30 30 GLU C C 13 175.07 0.2 . 1 . . . . 30 GLU C . 17959 1 359 . 1 1 30 30 GLU CA C 13 54.11 0.2 . 1 . . . . 30 GLU CA . 17959 1 360 . 1 1 30 30 GLU CB C 13 31.58 0.2 . 1 . . . . 30 GLU CB . 17959 1 361 . 1 1 30 30 GLU N N 15 127.55 0.2 . 1 . . . . 30 GLU N . 17959 1 362 . 1 1 31 31 ASP H H 1 8.138 0.02 . 1 . . . . 31 ASP H . 17959 1 363 . 1 1 31 31 ASP C C 13 177.43 0.2 . 1 . . . . 31 ASP C . 17959 1 364 . 1 1 31 31 ASP CA C 13 52.19 0.2 . 1 . . . . 31 ASP CA . 17959 1 365 . 1 1 31 31 ASP CB C 13 42.77 0.2 . 1 . . . . 31 ASP CB . 17959 1 366 . 1 1 31 31 ASP N N 15 123.74 0.2 . 1 . . . . 31 ASP N . 17959 1 367 . 1 1 32 32 ALA H H 1 8.405 0.02 . 1 . . . . 32 ALA H . 17959 1 368 . 1 1 32 32 ALA HA H 1 4.185 0.02 . 1 . . . . 32 ALA HA . 17959 1 369 . 1 1 32 32 ALA HB1 H 1 1.379 0.02 . 1 . . . . 32 ALA MB . 17959 1 370 . 1 1 32 32 ALA HB2 H 1 1.379 0.02 . 1 . . . . 32 ALA MB . 17959 1 371 . 1 1 32 32 ALA HB3 H 1 1.379 0.02 . 1 . . . . 32 ALA MB . 17959 1 372 . 1 1 32 32 ALA C C 13 178.41 0.2 . 1 . . . . 32 ALA C . 17959 1 373 . 1 1 32 32 ALA CA C 13 54.32 0.2 . 1 . . . . 32 ALA CA . 17959 1 374 . 1 1 32 32 ALA CB C 13 18.36 0.2 . 1 . . . . 32 ALA CB . 17959 1 375 . 1 1 32 32 ALA N N 15 119.96 0.2 . 1 . . . . 32 ALA N . 17959 1 376 . 1 1 33 33 GLN H H 1 7.885 0.02 . 1 . . . . 33 GLN H . 17959 1 377 . 1 1 33 33 GLN HA H 1 4.288 0.02 . 1 . . . . 33 GLN HA . 17959 1 378 . 1 1 33 33 GLN HB2 H 1 1.895 0.02 . 2 . . . . 33 GLN HB2 . 17959 1 379 . 1 1 33 33 GLN HB3 H 1 1.739 0.02 . 2 . . . . 33 GLN HB3 . 17959 1 380 . 1 1 33 33 GLN HG2 H 1 2.333 0.02 . 2 . . . . 33 GLN HG2 . 17959 1 381 . 1 1 33 33 GLN HG3 H 1 2.280 0.02 . 2 . . . . 33 GLN HG3 . 17959 1 382 . 1 1 33 33 GLN C C 13 174.93 0.2 . 1 . . . . 33 GLN C . 17959 1 383 . 1 1 33 33 GLN CA C 13 55.70 0.2 . 1 . . . . 33 GLN CA . 17959 1 384 . 1 1 33 33 GLN CB C 13 28.62 0.2 . 1 . . . . 33 GLN CB . 17959 1 385 . 1 1 33 33 GLN CG C 13 33.88 0.2 . 1 . . . . 33 GLN CG . 17959 1 386 . 1 1 33 33 GLN N N 15 116.31 0.2 . 1 . . . . 33 GLN N . 17959 1 387 . 1 1 34 34 MET H H 1 8.107 0.02 . 1 . . . . 34 MET H . 17959 1 388 . 1 1 34 34 MET HA H 1 4.022 0.02 . 1 . . . . 34 MET HA . 17959 1 389 . 1 1 34 34 MET HB2 H 1 2.120 0.02 . 2 . . . . 34 MET HB2 . 17959 1 390 . 1 1 34 34 MET HB3 H 1 2.120 0.02 . 2 . . . . 34 MET HB3 . 17959 1 391 . 1 1 34 34 MET HG2 H 1 2.497 0.02 . 2 . . . . 34 MET HG2 . 17959 1 392 . 1 1 34 34 MET HG3 H 1 2.497 0.02 . 2 . . . . 34 MET HG3 . 17959 1 393 . 1 1 34 34 MET HE1 H 1 1.999 0.02 . 1 . . . . 34 MET ME . 17959 1 394 . 1 1 34 34 MET HE2 H 1 1.999 0.02 . 1 . . . . 34 MET ME . 17959 1 395 . 1 1 34 34 MET HE3 H 1 1.999 0.02 . 1 . . . . 34 MET ME . 17959 1 396 . 1 1 34 34 MET C C 13 176.14 0.2 . 1 . . . . 34 MET C . 17959 1 397 . 1 1 34 34 MET CA C 13 56.68 0.2 . 1 . . . . 34 MET CA . 17959 1 398 . 1 1 34 34 MET CB C 13 28.02 0.2 . 1 . . . . 34 MET CB . 17959 1 399 . 1 1 34 34 MET CG C 13 32.31 0.2 . 1 . . . . 34 MET CG . 17959 1 400 . 1 1 34 34 MET CE C 13 17.39 0.2 . 1 . . . . 34 MET CE . 17959 1 401 . 1 1 34 34 MET N N 15 112.15 0.2 . 1 . . . . 34 MET N . 17959 1 402 . 1 1 35 35 HIS H H 1 8.407 0.02 . 1 . . . . 35 HIS H . 17959 1 403 . 1 1 35 35 HIS HA H 1 4.865 0.02 . 1 . . . . 35 HIS HA . 17959 1 404 . 1 1 35 35 HIS HB2 H 1 3.210 0.02 . 2 . . . . 35 HIS HB2 . 17959 1 405 . 1 1 35 35 HIS HB3 H 1 3.210 0.02 . 2 . . . . 35 HIS HB3 . 17959 1 406 . 1 1 35 35 HIS C C 13 175.00 0.2 . 1 . . . . 35 HIS C . 17959 1 407 . 1 1 35 35 HIS CA C 13 55.59 0.2 . 1 . . . . 35 HIS CA . 17959 1 408 . 1 1 35 35 HIS CB C 13 28.65 0.2 . 1 . . . . 35 HIS CB . 17959 1 409 . 1 1 35 35 HIS N N 15 119.38 0.2 . 1 . . . . 35 HIS N . 17959 1 410 . 1 1 36 36 THR H H 1 8.346 0.02 . 1 . . . . 36 THR H . 17959 1 411 . 1 1 36 36 THR HA H 1 5.485 0.02 . 1 . . . . 36 THR HA . 17959 1 412 . 1 1 36 36 THR HB H 1 3.874 0.02 . 1 . . . . 36 THR HB . 17959 1 413 . 1 1 36 36 THR HG21 H 1 0.990 0.02 . 1 . . . . 36 THR MG . 17959 1 414 . 1 1 36 36 THR HG22 H 1 0.990 0.02 . 1 . . . . 36 THR MG . 17959 1 415 . 1 1 36 36 THR HG23 H 1 0.990 0.02 . 1 . . . . 36 THR MG . 17959 1 416 . 1 1 36 36 THR C C 13 174.48 0.2 . 1 . . . . 36 THR C . 17959 1 417 . 1 1 36 36 THR CA C 13 61.28 0.2 . 1 . . . . 36 THR CA . 17959 1 418 . 1 1 36 36 THR CB C 13 71.10 0.2 . 1 . . . . 36 THR CB . 17959 1 419 . 1 1 36 36 THR CG2 C 13 21.61 0.2 . 1 . . . . 36 THR CG2 . 17959 1 420 . 1 1 36 36 THR N N 15 118.16 0.2 . 1 . . . . 36 THR N . 17959 1 421 . 1 1 37 37 VAL H H 1 8.590 0.02 . 1 . . . . 37 VAL H . 17959 1 422 . 1 1 37 37 VAL HA H 1 4.437 0.02 . 1 . . . . 37 VAL HA . 17959 1 423 . 1 1 37 37 VAL HB H 1 1.962 0.02 . 1 . . . . 37 VAL HB . 17959 1 424 . 1 1 37 37 VAL HG11 H 1 0.781 0.02 . 2 . . . . 37 VAL MG1 . 17959 1 425 . 1 1 37 37 VAL HG12 H 1 0.781 0.02 . 2 . . . . 37 VAL MG1 . 17959 1 426 . 1 1 37 37 VAL HG13 H 1 0.781 0.02 . 2 . . . . 37 VAL MG1 . 17959 1 427 . 1 1 37 37 VAL HG21 H 1 0.781 0.02 . 2 . . . . 37 VAL MG2 . 17959 1 428 . 1 1 37 37 VAL HG22 H 1 0.781 0.02 . 2 . . . . 37 VAL MG2 . 17959 1 429 . 1 1 37 37 VAL HG23 H 1 0.781 0.02 . 2 . . . . 37 VAL MG2 . 17959 1 430 . 1 1 37 37 VAL C C 13 173.62 0.2 . 1 . . . . 37 VAL C . 17959 1 431 . 1 1 37 37 VAL CA C 13 60.76 0.2 . 1 . . . . 37 VAL CA . 17959 1 432 . 1 1 37 37 VAL CB C 13 35.72 0.2 . 1 . . . . 37 VAL CB . 17959 1 433 . 1 1 37 37 VAL CG1 C 13 20.47 0.2 . 2 . . . . 37 VAL CG1 . 17959 1 434 . 1 1 37 37 VAL CG2 C 13 20.47 0.2 . 2 . . . . 37 VAL CG2 . 17959 1 435 . 1 1 37 37 VAL N N 15 122.33 0.2 . 1 . . . . 37 VAL N . 17959 1 436 . 1 1 38 38 THR H H 1 8.086 0.02 . 1 . . . . 38 THR H . 17959 1 437 . 1 1 38 38 THR HA H 1 5.103 0.02 . 1 . . . . 38 THR HA . 17959 1 438 . 1 1 38 38 THR HB H 1 3.449 0.02 . 1 . . . . 38 THR HB . 17959 1 439 . 1 1 38 38 THR HG21 H 1 0.712 0.02 . 1 . . . . 38 THR MG . 17959 1 440 . 1 1 38 38 THR HG22 H 1 0.712 0.02 . 1 . . . . 38 THR MG . 17959 1 441 . 1 1 38 38 THR HG23 H 1 0.712 0.02 . 1 . . . . 38 THR MG . 17959 1 442 . 1 1 38 38 THR C C 13 174.45 0.2 . 1 . . . . 38 THR C . 17959 1 443 . 1 1 38 38 THR CA C 13 60.63 0.2 . 1 . . . . 38 THR CA . 17959 1 444 . 1 1 38 38 THR CB C 13 70.89 0.2 . 1 . . . . 38 THR CB . 17959 1 445 . 1 1 38 38 THR CG2 C 13 21.26 0.2 . 1 . . . . 38 THR CG2 . 17959 1 446 . 1 1 38 38 THR N N 15 117.57 0.2 . 1 . . . . 38 THR N . 17959 1 447 . 1 1 39 39 ILE H H 1 8.737 0.02 . 1 . . . . 39 ILE H . 17959 1 448 . 1 1 39 39 ILE HA H 1 4.578 0.02 . 1 . . . . 39 ILE HA . 17959 1 449 . 1 1 39 39 ILE HB H 1 1.726 0.02 . 1 . . . . 39 ILE HB . 17959 1 450 . 1 1 39 39 ILE HG12 H 1 0.907 0.02 . 2 . . . . 39 ILE HG12 . 17959 1 451 . 1 1 39 39 ILE HG13 H 1 0.971 0.02 . 2 . . . . 39 ILE HG13 . 17959 1 452 . 1 1 39 39 ILE HG21 H 1 0.489 0.02 . 1 . . . . 39 ILE MG . 17959 1 453 . 1 1 39 39 ILE HG22 H 1 0.489 0.02 . 1 . . . . 39 ILE MG . 17959 1 454 . 1 1 39 39 ILE HG23 H 1 0.489 0.02 . 1 . . . . 39 ILE MG . 17959 1 455 . 1 1 39 39 ILE HD11 H 1 0.605 0.02 . 1 . . . . 39 ILE MD . 17959 1 456 . 1 1 39 39 ILE HD12 H 1 0.605 0.02 . 1 . . . . 39 ILE MD . 17959 1 457 . 1 1 39 39 ILE HD13 H 1 0.605 0.02 . 1 . . . . 39 ILE MD . 17959 1 458 . 1 1 39 39 ILE C C 13 173.15 0.2 . 1 . . . . 39 ILE C . 17959 1 459 . 1 1 39 39 ILE CA C 13 59.87 0.2 . 1 . . . . 39 ILE CA . 17959 1 460 . 1 1 39 39 ILE CB C 13 42.77 0.2 . 1 . . . . 39 ILE CB . 17959 1 461 . 1 1 39 39 ILE CG1 C 13 27.67 0.2 . 1 . . . . 39 ILE CG1 . 17959 1 462 . 1 1 39 39 ILE CG2 C 13 17.96 0.2 . 1 . . . . 39 ILE CG2 . 17959 1 463 . 1 1 39 39 ILE CD1 C 13 13.70 0.2 . 1 . . . . 39 ILE CD1 . 17959 1 464 . 1 1 39 39 ILE N N 15 120.21 0.2 . 1 . . . . 39 ILE N . 17959 1 465 . 1 1 40 40 TRP H H 1 8.147 0.02 . 1 . . . . 40 TRP H . 17959 1 466 . 1 1 40 40 TRP HA H 1 5.560 0.02 . 1 . . . . 40 TRP HA . 17959 1 467 . 1 1 40 40 TRP HB2 H 1 2.813 0.02 . 2 . . . . 40 TRP HB2 . 17959 1 468 . 1 1 40 40 TRP HB3 H 1 2.901 0.02 . 2 . . . . 40 TRP HB3 . 17959 1 469 . 1 1 40 40 TRP C C 13 176.48 0.2 . 1 . . . . 40 TRP C . 17959 1 470 . 1 1 40 40 TRP CA C 13 55.93 0.2 . 1 . . . . 40 TRP CA . 17959 1 471 . 1 1 40 40 TRP CB C 13 31.52 0.2 . 1 . . . . 40 TRP CB . 17959 1 472 . 1 1 40 40 TRP N N 15 119.21 0.2 . 1 . . . . 40 TRP N . 17959 1 473 . 1 1 41 41 LEU H H 1 9.168 0.02 . 1 . . . . 41 LEU H . 17959 1 474 . 1 1 41 41 LEU HA H 1 4.917 0.02 . 1 . . . . 41 LEU HA . 17959 1 475 . 1 1 41 41 LEU HB2 H 1 1.464 0.02 . 2 . . . . 41 LEU HB2 . 17959 1 476 . 1 1 41 41 LEU HB3 H 1 1.464 0.02 . 2 . . . . 41 LEU HB3 . 17959 1 477 . 1 1 41 41 LEU HG H 1 1.557 0.02 . 1 . . . . 41 LEU HG . 17959 1 478 . 1 1 41 41 LEU HD11 H 1 0.916 0.02 . 2 . . . . 41 LEU MD1 . 17959 1 479 . 1 1 41 41 LEU HD12 H 1 0.916 0.02 . 2 . . . . 41 LEU MD1 . 17959 1 480 . 1 1 41 41 LEU HD13 H 1 0.916 0.02 . 2 . . . . 41 LEU MD1 . 17959 1 481 . 1 1 41 41 LEU HD21 H 1 1.053 0.02 . 2 . . . . 41 LEU MD2 . 17959 1 482 . 1 1 41 41 LEU HD22 H 1 1.053 0.02 . 2 . . . . 41 LEU MD2 . 17959 1 483 . 1 1 41 41 LEU HD23 H 1 1.053 0.02 . 2 . . . . 41 LEU MD2 . 17959 1 484 . 1 1 41 41 LEU C C 13 176.13 0.2 . 1 . . . . 41 LEU C . 17959 1 485 . 1 1 41 41 LEU CA C 13 53.17 0.2 . 1 . . . . 41 LEU CA . 17959 1 486 . 1 1 41 41 LEU CB C 13 46.99 0.2 . 1 . . . . 41 LEU CB . 17959 1 487 . 1 1 41 41 LEU CG C 13 27.42 0.2 . 1 . . . . 41 LEU CG . 17959 1 488 . 1 1 41 41 LEU CD1 C 13 24.50 0.2 . 2 . . . . 41 LEU CD1 . 17959 1 489 . 1 1 41 41 LEU CD2 C 13 24.50 0.2 . 2 . . . . 41 LEU CD2 . 17959 1 490 . 1 1 41 41 LEU N N 15 121.79 0.2 . 1 . . . . 41 LEU N . 17959 1 491 . 1 1 42 42 THR H H 1 8.709 0.02 . 1 . . . . 42 THR H . 17959 1 492 . 1 1 42 42 THR HA H 1 5.055 0.02 . 1 . . . . 42 THR HA . 17959 1 493 . 1 1 42 42 THR HB H 1 4.021 0.02 . 1 . . . . 42 THR HB . 17959 1 494 . 1 1 42 42 THR HG21 H 1 1.101 0.02 . 1 . . . . 42 THR MG . 17959 1 495 . 1 1 42 42 THR HG22 H 1 1.101 0.02 . 1 . . . . 42 THR MG . 17959 1 496 . 1 1 42 42 THR HG23 H 1 1.101 0.02 . 1 . . . . 42 THR MG . 17959 1 497 . 1 1 42 42 THR C C 13 174.68 0.2 . 1 . . . . 42 THR C . 17959 1 498 . 1 1 42 42 THR CA C 13 63.06 0.2 . 1 . . . . 42 THR CA . 17959 1 499 . 1 1 42 42 THR CB C 13 68.80 0.2 . 1 . . . . 42 THR CB . 17959 1 500 . 1 1 42 42 THR CG2 C 13 22.57 0.2 . 1 . . . . 42 THR CG2 . 17959 1 501 . 1 1 42 42 THR N N 15 120.39 0.2 . 1 . . . . 42 THR N . 17959 1 502 . 1 1 43 43 VAL H H 1 9.091 0.02 . 1 . . . . 43 VAL H . 17959 1 503 . 1 1 43 43 VAL HA H 1 4.736 0.02 . 1 . . . . 43 VAL HA . 17959 1 504 . 1 1 43 43 VAL HB H 1 2.197 0.02 . 1 . . . . 43 VAL HB . 17959 1 505 . 1 1 43 43 VAL HG11 H 1 0.657 0.02 . 2 . . . . 43 VAL MG1 . 17959 1 506 . 1 1 43 43 VAL HG12 H 1 0.657 0.02 . 2 . . . . 43 VAL MG1 . 17959 1 507 . 1 1 43 43 VAL HG13 H 1 0.657 0.02 . 2 . . . . 43 VAL MG1 . 17959 1 508 . 1 1 43 43 VAL HG21 H 1 0.518 0.02 . 2 . . . . 43 VAL MG2 . 17959 1 509 . 1 1 43 43 VAL HG22 H 1 0.518 0.02 . 2 . . . . 43 VAL MG2 . 17959 1 510 . 1 1 43 43 VAL HG23 H 1 0.518 0.02 . 2 . . . . 43 VAL MG2 . 17959 1 511 . 1 1 43 43 VAL C C 13 173.70 0.2 . 1 . . . . 43 VAL C . 17959 1 512 . 1 1 43 43 VAL CA C 13 58.39 0.2 . 1 . . . . 43 VAL CA . 17959 1 513 . 1 1 43 43 VAL CB C 13 35.89 0.2 . 1 . . . . 43 VAL CB . 17959 1 514 . 1 1 43 43 VAL CG1 C 13 22.74 0.2 . 2 . . . . 43 VAL CG1 . 17959 1 515 . 1 1 43 43 VAL CG2 C 13 21.60 0.2 . 2 . . . . 43 VAL CG2 . 17959 1 516 . 1 1 43 43 VAL N N 15 118.02 0.2 . 1 . . . . 43 VAL N . 17959 1 517 . 1 1 44 44 ARG H H 1 7.220 0.02 . 1 . . . . 44 ARG H . 17959 1 518 . 1 1 44 44 ARG HA H 1 5.143 0.02 . 1 . . . . 44 ARG HA . 17959 1 519 . 1 1 44 44 ARG HB2 H 1 2.068 0.02 . 2 . . . . 44 ARG HB2 . 17959 1 520 . 1 1 44 44 ARG HB3 H 1 2.068 0.02 . 2 . . . . 44 ARG HB3 . 17959 1 521 . 1 1 44 44 ARG HG2 H 1 1.599 0.02 . 2 . . . . 44 ARG HG2 . 17959 1 522 . 1 1 44 44 ARG HG3 H 1 1.670 0.02 . 2 . . . . 44 ARG HG3 . 17959 1 523 . 1 1 44 44 ARG HD2 H 1 3.195 0.02 . 2 . . . . 44 ARG HD2 . 17959 1 524 . 1 1 44 44 ARG HD3 H 1 3.195 0.02 . 2 . . . . 44 ARG HD3 . 17959 1 525 . 1 1 44 44 ARG C C 13 176.08 0.2 . 1 . . . . 44 ARG C . 17959 1 526 . 1 1 44 44 ARG CA C 13 53.24 0.2 . 1 . . . . 44 ARG CA . 17959 1 527 . 1 1 44 44 ARG CB C 13 32.92 0.2 . 1 . . . . 44 ARG CB . 17959 1 528 . 1 1 44 44 ARG CG C 13 27.56 0.2 . 1 . . . . 44 ARG CG . 17959 1 529 . 1 1 44 44 ARG CD C 13 43.76 0.2 . 1 . . . . 44 ARG CD . 17959 1 530 . 1 1 44 44 ARG N N 15 117.02 0.2 . 1 . . . . 44 ARG N . 17959 1 531 . 1 1 45 45 PRO HA H 1 4.069 0.02 . 1 . . . . 45 PRO HA . 17959 1 532 . 1 1 45 45 PRO HB2 H 1 2.063 0.02 . 2 . . . . 45 PRO HB2 . 17959 1 533 . 1 1 45 45 PRO HB3 H 1 2.459 0.02 . 2 . . . . 45 PRO HB3 . 17959 1 534 . 1 1 45 45 PRO HG2 H 1 2.097 0.02 . 2 . . . . 45 PRO HG2 . 17959 1 535 . 1 1 45 45 PRO HG3 H 1 2.187 0.02 . 2 . . . . 45 PRO HG3 . 17959 1 536 . 1 1 45 45 PRO HD2 H 1 3.874 0.02 . 2 . . . . 45 PRO HD2 . 17959 1 537 . 1 1 45 45 PRO HD3 H 1 3.874 0.02 . 2 . . . . 45 PRO HD3 . 17959 1 538 . 1 1 45 45 PRO C C 13 175.67 0.2 . 1 . . . . 45 PRO C . 17959 1 539 . 1 1 45 45 PRO CA C 13 65.58 0.2 . 1 . . . . 45 PRO CA . 17959 1 540 . 1 1 45 45 PRO CB C 13 31.81 0.2 . 1 . . . . 45 PRO CB . 17959 1 541 . 1 1 45 45 PRO CG C 13 28.68 0.2 . 1 . . . . 45 PRO CG . 17959 1 542 . 1 1 45 45 PRO CD C 13 51.35 0.2 . 1 . . . . 45 PRO CD . 17959 1 543 . 1 1 46 46 ASP H H 1 8.106 0.02 . 1 . . . . 46 ASP H . 17959 1 544 . 1 1 46 46 ASP HA H 1 4.590 0.02 . 1 . . . . 46 ASP HA . 17959 1 545 . 1 1 46 46 ASP HB2 H 1 2.650 0.02 . 2 . . . . 46 ASP HB2 . 17959 1 546 . 1 1 46 46 ASP HB3 H 1 2.846 0.02 . 2 . . . . 46 ASP HB3 . 17959 1 547 . 1 1 46 46 ASP C C 13 175.69 0.2 . 1 . . . . 46 ASP C . 17959 1 548 . 1 1 46 46 ASP CA C 13 53.71 0.2 . 1 . . . . 46 ASP CA . 17959 1 549 . 1 1 46 46 ASP CB C 13 39.21 0.2 . 1 . . . . 46 ASP CB . 17959 1 550 . 1 1 46 46 ASP N N 15 111.94 0.2 . 1 . . . . 46 ASP N . 17959 1 551 . 1 1 47 47 MET H H 1 7.619 0.02 . 1 . . . . 47 MET H . 17959 1 552 . 1 1 47 47 MET HA H 1 4.343 0.02 . 1 . . . . 47 MET HA . 17959 1 553 . 1 1 47 47 MET HB2 H 1 1.946 0.02 . 2 . . . . 47 MET HB2 . 17959 1 554 . 1 1 47 47 MET HB3 H 1 2.042 0.02 . 2 . . . . 47 MET HB3 . 17959 1 555 . 1 1 47 47 MET HG2 H 1 2.340 0.02 . 2 . . . . 47 MET HG2 . 17959 1 556 . 1 1 47 47 MET HG3 H 1 2.340 0.02 . 2 . . . . 47 MET HG3 . 17959 1 557 . 1 1 47 47 MET HE1 H 1 1.641 0.02 . 1 . . . . 47 MET ME . 17959 1 558 . 1 1 47 47 MET HE2 H 1 1.641 0.02 . 1 . . . . 47 MET ME . 17959 1 559 . 1 1 47 47 MET HE3 H 1 1.641 0.02 . 1 . . . . 47 MET ME . 17959 1 560 . 1 1 47 47 MET C C 13 175.78 0.2 . 1 . . . . 47 MET C . 17959 1 561 . 1 1 47 47 MET CA C 13 56.65 0.2 . 1 . . . . 47 MET CA . 17959 1 562 . 1 1 47 47 MET CB C 13 34.78 0.2 . 1 . . . . 47 MET CB . 17959 1 563 . 1 1 47 47 MET CG C 13 31.20 0.2 . 1 . . . . 47 MET CG . 17959 1 564 . 1 1 47 47 MET CE C 13 17.43 0.2 . 1 . . . . 47 MET CE . 17959 1 565 . 1 1 47 47 MET N N 15 119.94 0.2 . 1 . . . . 47 MET N . 17959 1 566 . 1 1 48 48 THR H H 1 8.186 0.02 . 1 . . . . 48 THR H . 17959 1 567 . 1 1 48 48 THR HA H 1 4.828 0.02 . 1 . . . . 48 THR HA . 17959 1 568 . 1 1 48 48 THR HB H 1 3.881 0.02 . 1 . . . . 48 THR HB . 17959 1 569 . 1 1 48 48 THR HG21 H 1 0.990 0.02 . 1 . . . . 48 THR MG . 17959 1 570 . 1 1 48 48 THR HG22 H 1 0.990 0.02 . 1 . . . . 48 THR MG . 17959 1 571 . 1 1 48 48 THR HG23 H 1 0.990 0.02 . 1 . . . . 48 THR MG . 17959 1 572 . 1 1 48 48 THR C C 13 176.78 0.2 . 1 . . . . 48 THR C . 17959 1 573 . 1 1 48 48 THR CA C 13 60.26 0.2 . 1 . . . . 48 THR CA . 17959 1 574 . 1 1 48 48 THR CB C 13 71.55 0.2 . 1 . . . . 48 THR CB . 17959 1 575 . 1 1 48 48 THR CG2 C 13 21.71 0.2 . 1 . . . . 48 THR CG2 . 17959 1 576 . 1 1 48 48 THR N N 15 110.87 0.2 . 1 . . . . 48 THR N . 17959 1 577 . 1 1 49 49 VAL H H 1 8.405 0.02 . 1 . . . . 49 VAL H . 17959 1 578 . 1 1 49 49 VAL HA H 1 3.210 0.02 . 1 . . . . 49 VAL HA . 17959 1 579 . 1 1 49 49 VAL HB H 1 2.335 0.02 . 1 . . . . 49 VAL HB . 17959 1 580 . 1 1 49 49 VAL HG11 H 1 0.597 0.02 . 2 . . . . 49 VAL MG1 . 17959 1 581 . 1 1 49 49 VAL HG12 H 1 0.597 0.02 . 2 . . . . 49 VAL MG1 . 17959 1 582 . 1 1 49 49 VAL HG13 H 1 0.597 0.02 . 2 . . . . 49 VAL MG1 . 17959 1 583 . 1 1 49 49 VAL HG21 H 1 0.597 0.02 . 2 . . . . 49 VAL MG2 . 17959 1 584 . 1 1 49 49 VAL HG22 H 1 0.597 0.02 . 2 . . . . 49 VAL MG2 . 17959 1 585 . 1 1 49 49 VAL HG23 H 1 0.597 0.02 . 2 . . . . 49 VAL MG2 . 17959 1 586 . 1 1 49 49 VAL C C 13 178.13 0.2 . 1 . . . . 49 VAL C . 17959 1 587 . 1 1 49 49 VAL CA C 13 66.50 0.2 . 1 . . . . 49 VAL CA . 17959 1 588 . 1 1 49 49 VAL CB C 13 30.79 0.2 . 1 . . . . 49 VAL CB . 17959 1 589 . 1 1 49 49 VAL CG1 C 13 20.69 0.2 . 2 . . . . 49 VAL CG1 . 17959 1 590 . 1 1 49 49 VAL CG2 C 13 20.69 0.2 . 2 . . . . 49 VAL CG2 . 17959 1 591 . 1 1 49 49 VAL N N 15 123.32 0.2 . 1 . . . . 49 VAL N . 17959 1 592 . 1 1 50 50 ALA H H 1 9.042 0.02 . 1 . . . . 50 ALA H . 17959 1 593 . 1 1 50 50 ALA HA H 1 3.871 0.02 . 1 . . . . 50 ALA HA . 17959 1 594 . 1 1 50 50 ALA HB1 H 1 1.392 0.02 . 1 . . . . 50 ALA MB . 17959 1 595 . 1 1 50 50 ALA HB2 H 1 1.392 0.02 . 1 . . . . 50 ALA MB . 17959 1 596 . 1 1 50 50 ALA HB3 H 1 1.392 0.02 . 1 . . . . 50 ALA MB . 17959 1 597 . 1 1 50 50 ALA C C 13 180.30 0.2 . 1 . . . . 50 ALA C . 17959 1 598 . 1 1 50 50 ALA CA C 13 56.18 0.2 . 1 . . . . 50 ALA CA . 17959 1 599 . 1 1 50 50 ALA CB C 13 18.18 0.2 . 1 . . . . 50 ALA CB . 17959 1 600 . 1 1 50 50 ALA N N 15 123.10 0.2 . 1 . . . . 50 ALA N . 17959 1 601 . 1 1 51 51 SER H H 1 7.808 0.02 . 1 . . . . 51 SER H . 17959 1 602 . 1 1 51 51 SER HA H 1 4.304 0.02 . 1 . . . . 51 SER HA . 17959 1 603 . 1 1 51 51 SER HB2 H 1 3.943 0.02 . 2 . . . . 51 SER HB2 . 17959 1 604 . 1 1 51 51 SER HB3 H 1 3.943 0.02 . 2 . . . . 51 SER HB3 . 17959 1 605 . 1 1 51 51 SER C C 13 177.32 0.2 . 1 . . . . 51 SER C . 17959 1 606 . 1 1 51 51 SER CA C 13 62.40 0.2 . 1 . . . . 51 SER CA . 17959 1 607 . 1 1 51 51 SER CB C 13 63.18 0.2 . 1 . . . . 51 SER CB . 17959 1 608 . 1 1 51 51 SER N N 15 115.07 0.2 . 1 . . . . 51 SER N . 17959 1 609 . 1 1 52 52 LEU H H 1 8.155 0.02 . 1 . . . . 52 LEU H . 17959 1 610 . 1 1 52 52 LEU HA H 1 3.939 0.02 . 1 . . . . 52 LEU HA . 17959 1 611 . 1 1 52 52 LEU HB2 H 1 1.765 0.02 . 2 . . . . 52 LEU HB2 . 17959 1 612 . 1 1 52 52 LEU HB3 H 1 1.765 0.02 . 2 . . . . 52 LEU HB3 . 17959 1 613 . 1 1 52 52 LEU HG H 1 1.009 0.02 . 1 . . . . 52 LEU HG . 17959 1 614 . 1 1 52 52 LEU HD11 H 1 -0.719 0.02 . 2 . . . . 52 LEU MD1 . 17959 1 615 . 1 1 52 52 LEU HD12 H 1 -0.719 0.02 . 2 . . . . 52 LEU MD1 . 17959 1 616 . 1 1 52 52 LEU HD13 H 1 -0.719 0.02 . 2 . . . . 52 LEU MD1 . 17959 1 617 . 1 1 52 52 LEU HD21 H 1 0.499 0.02 . 2 . . . . 52 LEU MD2 . 17959 1 618 . 1 1 52 52 LEU HD22 H 1 0.499 0.02 . 2 . . . . 52 LEU MD2 . 17959 1 619 . 1 1 52 52 LEU HD23 H 1 0.499 0.02 . 2 . . . . 52 LEU MD2 . 17959 1 620 . 1 1 52 52 LEU C C 13 178.02 0.2 . 1 . . . . 52 LEU C . 17959 1 621 . 1 1 52 52 LEU CA C 13 58.72 0.2 . 1 . . . . 52 LEU CA . 17959 1 622 . 1 1 52 52 LEU CB C 13 42.05 0.2 . 1 . . . . 52 LEU CB . 17959 1 623 . 1 1 52 52 LEU CG C 13 26.45 0.2 . 1 . . . . 52 LEU CG . 17959 1 624 . 1 1 52 52 LEU CD1 C 13 24.50 0.2 . 2 . . . . 52 LEU CD1 . 17959 1 625 . 1 1 52 52 LEU CD2 C 13 23.86 0.2 . 2 . . . . 52 LEU CD2 . 17959 1 626 . 1 1 52 52 LEU N N 15 127.78 0.2 . 1 . . . . 52 LEU N . 17959 1 627 . 1 1 53 53 LYS H H 1 8.783 0.02 . 1 . . . . 53 LYS H . 17959 1 628 . 1 1 53 53 LYS HA H 1 5.047 0.02 . 1 . . . . 53 LYS HA . 17959 1 629 . 1 1 53 53 LYS HB2 H 1 1.783 0.02 . 2 . . . . 53 LYS HB2 . 17959 1 630 . 1 1 53 53 LYS HB3 H 1 1.783 0.02 . 2 . . . . 53 LYS HB3 . 17959 1 631 . 1 1 53 53 LYS HG2 H 1 1.298 0.02 . 2 . . . . 53 LYS HG2 . 17959 1 632 . 1 1 53 53 LYS HG3 H 1 1.298 0.02 . 2 . . . . 53 LYS HG3 . 17959 1 633 . 1 1 53 53 LYS HD2 H 1 1.553 0.02 . 2 . . . . 53 LYS HD2 . 17959 1 634 . 1 1 53 53 LYS HD3 H 1 1.553 0.02 . 2 . . . . 53 LYS HD3 . 17959 1 635 . 1 1 53 53 LYS HE2 H 1 2.970 0.02 . 2 . . . . 53 LYS HE2 . 17959 1 636 . 1 1 53 53 LYS HE3 H 1 2.970 0.02 . 2 . . . . 53 LYS HE3 . 17959 1 637 . 1 1 53 53 LYS C C 13 181.40 0.2 . 1 . . . . 53 LYS C . 17959 1 638 . 1 1 53 53 LYS CA C 13 59.18 0.2 . 1 . . . . 53 LYS CA . 17959 1 639 . 1 1 53 53 LYS CB C 13 34.33 0.2 . 1 . . . . 53 LYS CB . 17959 1 640 . 1 1 53 53 LYS CG C 13 24.89 0.2 . 1 . . . . 53 LYS CG . 17959 1 641 . 1 1 53 53 LYS CE C 13 42.57 0.2 . 1 . . . . 53 LYS CE . 17959 1 642 . 1 1 53 53 LYS N N 15 117.96 0.2 . 1 . . . . 53 LYS N . 17959 1 643 . 1 1 54 54 ASP H H 1 7.810 0.02 . 1 . . . . 54 ASP H . 17959 1 644 . 1 1 54 54 ASP HA H 1 4.626 0.02 . 1 . . . . 54 ASP HA . 17959 1 645 . 1 1 54 54 ASP HB2 H 1 2.908 0.02 . 2 . . . . 54 ASP HB2 . 17959 1 646 . 1 1 54 54 ASP HB3 H 1 2.908 0.02 . 2 . . . . 54 ASP HB3 . 17959 1 647 . 1 1 54 54 ASP C C 13 177.65 0.2 . 1 . . . . 54 ASP C . 17959 1 648 . 1 1 54 54 ASP CA C 13 57.39 0.2 . 1 . . . . 54 ASP CA . 17959 1 649 . 1 1 54 54 ASP CB C 13 39.63 0.2 . 1 . . . . 54 ASP CB . 17959 1 650 . 1 1 54 54 ASP N N 15 119.20 0.2 . 1 . . . . 54 ASP N . 17959 1 651 . 1 1 55 55 MET H H 1 8.205 0.02 . 1 . . . . 55 MET H . 17959 1 652 . 1 1 55 55 MET HA H 1 4.093 0.02 . 1 . . . . 55 MET HA . 17959 1 653 . 1 1 55 55 MET HB2 H 1 2.116 0.02 . 2 . . . . 55 MET HB2 . 17959 1 654 . 1 1 55 55 MET HB3 H 1 2.116 0.02 . 2 . . . . 55 MET HB3 . 17959 1 655 . 1 1 55 55 MET HG2 H 1 2.343 0.02 . 2 . . . . 55 MET HG2 . 17959 1 656 . 1 1 55 55 MET HG3 H 1 2.411 0.02 . 2 . . . . 55 MET HG3 . 17959 1 657 . 1 1 55 55 MET HE1 H 1 1.892 0.02 . 1 . . . . 55 MET ME . 17959 1 658 . 1 1 55 55 MET HE2 H 1 1.892 0.02 . 1 . . . . 55 MET ME . 17959 1 659 . 1 1 55 55 MET HE3 H 1 1.892 0.02 . 1 . . . . 55 MET ME . 17959 1 660 . 1 1 55 55 MET C C 13 178.43 0.2 . 1 . . . . 55 MET C . 17959 1 661 . 1 1 55 55 MET CA C 13 59.82 0.2 . 1 . . . . 55 MET CA . 17959 1 662 . 1 1 55 55 MET CB C 13 33.61 0.2 . 1 . . . . 55 MET CB . 17959 1 663 . 1 1 55 55 MET CG C 13 32.45 0.2 . 1 . . . . 55 MET CG . 17959 1 664 . 1 1 55 55 MET CE C 13 17.32 0.2 . 1 . . . . 55 MET CE . 17959 1 665 . 1 1 55 55 MET N N 15 121.94 0.2 . 1 . . . . 55 MET N . 17959 1 666 . 1 1 56 56 VAL H H 1 8.604 0.02 . 1 . . . . 56 VAL H . 17959 1 667 . 1 1 56 56 VAL HA H 1 3.908 0.02 . 1 . . . . 56 VAL HA . 17959 1 668 . 1 1 56 56 VAL HB H 1 2.677 0.02 . 1 . . . . 56 VAL HB . 17959 1 669 . 1 1 56 56 VAL HG11 H 1 1.250 0.02 . 2 . . . . 56 VAL MG1 . 17959 1 670 . 1 1 56 56 VAL HG12 H 1 1.250 0.02 . 2 . . . . 56 VAL MG1 . 17959 1 671 . 1 1 56 56 VAL HG13 H 1 1.250 0.02 . 2 . . . . 56 VAL MG1 . 17959 1 672 . 1 1 56 56 VAL HG21 H 1 1.425 0.02 . 2 . . . . 56 VAL MG2 . 17959 1 673 . 1 1 56 56 VAL HG22 H 1 1.425 0.02 . 2 . . . . 56 VAL MG2 . 17959 1 674 . 1 1 56 56 VAL HG23 H 1 1.425 0.02 . 2 . . . . 56 VAL MG2 . 17959 1 675 . 1 1 56 56 VAL C C 13 178.63 0.2 . 1 . . . . 56 VAL C . 17959 1 676 . 1 1 56 56 VAL CA C 13 67.72 0.2 . 1 . . . . 56 VAL CA . 17959 1 677 . 1 1 56 56 VAL CB C 13 31.51 0.2 . 1 . . . . 56 VAL CB . 17959 1 678 . 1 1 56 56 VAL CG1 C 13 22.17 0.2 . 2 . . . . 56 VAL CG1 . 17959 1 679 . 1 1 56 56 VAL CG2 C 13 22.16 0.2 . 2 . . . . 56 VAL CG2 . 17959 1 680 . 1 1 56 56 VAL N N 15 118.39 0.2 . 1 . . . . 56 VAL N . 17959 1 681 . 1 1 57 57 PHE H H 1 8.686 0.02 . 1 . . . . 57 PHE H . 17959 1 682 . 1 1 57 57 PHE HA H 1 4.536 0.02 . 1 . . . . 57 PHE HA . 17959 1 683 . 1 1 57 57 PHE HB2 H 1 3.411 0.02 . 2 . . . . 57 PHE HB2 . 17959 1 684 . 1 1 57 57 PHE HB3 H 1 3.411 0.02 . 2 . . . . 57 PHE HB3 . 17959 1 685 . 1 1 57 57 PHE C C 13 178.54 0.2 . 1 . . . . 57 PHE C . 17959 1 686 . 1 1 57 57 PHE CA C 13 60.48 0.2 . 1 . . . . 57 PHE CA . 17959 1 687 . 1 1 57 57 PHE CB C 13 38.84 0.2 . 1 . . . . 57 PHE CB . 17959 1 688 . 1 1 57 57 PHE N N 15 124.12 0.2 . 1 . . . . 57 PHE N . 17959 1 689 . 1 1 58 58 LEU H H 1 8.289 0.02 . 1 . . . . 58 LEU H . 17959 1 690 . 1 1 58 58 LEU HA H 1 3.587 0.02 . 1 . . . . 58 LEU HA . 17959 1 691 . 1 1 58 58 LEU HB2 H 1 1.504 0.02 . 2 . . . . 58 LEU HB2 . 17959 1 692 . 1 1 58 58 LEU HB3 H 1 1.752 0.02 . 2 . . . . 58 LEU HB3 . 17959 1 693 . 1 1 58 58 LEU HG H 1 1.489 0.02 . 1 . . . . 58 LEU HG . 17959 1 694 . 1 1 58 58 LEU HD11 H 1 0.838 0.02 . 2 . . . . 58 LEU MD1 . 17959 1 695 . 1 1 58 58 LEU HD12 H 1 0.838 0.02 . 2 . . . . 58 LEU MD1 . 17959 1 696 . 1 1 58 58 LEU HD13 H 1 0.838 0.02 . 2 . . . . 58 LEU MD1 . 17959 1 697 . 1 1 58 58 LEU HD21 H 1 0.788 0.02 . 2 . . . . 58 LEU MD2 . 17959 1 698 . 1 1 58 58 LEU HD22 H 1 0.788 0.02 . 2 . . . . 58 LEU MD2 . 17959 1 699 . 1 1 58 58 LEU HD23 H 1 0.788 0.02 . 2 . . . . 58 LEU MD2 . 17959 1 700 . 1 1 58 58 LEU C C 13 179.16 0.2 . 1 . . . . 58 LEU C . 17959 1 701 . 1 1 58 58 LEU CA C 13 58.02 0.2 . 1 . . . . 58 LEU CA . 17959 1 702 . 1 1 58 58 LEU CB C 13 42.00 0.2 . 1 . . . . 58 LEU CB . 17959 1 703 . 1 1 58 58 LEU CG C 13 27.44 0.2 . 1 . . . . 58 LEU CG . 17959 1 704 . 1 1 58 58 LEU CD1 C 13 23.84 0.2 . 2 . . . . 58 LEU CD1 . 17959 1 705 . 1 1 58 58 LEU CD2 C 13 23.91 0.2 . 2 . . . . 58 LEU CD2 . 17959 1 706 . 1 1 58 58 LEU N N 15 121.31 0.2 . 1 . . . . 58 LEU N . 17959 1 707 . 1 1 59 59 ASP H H 1 8.185 0.02 . 1 . . . . 59 ASP H . 17959 1 708 . 1 1 59 59 ASP HA H 1 4.613 0.02 . 1 . . . . 59 ASP HA . 17959 1 709 . 1 1 59 59 ASP HB2 H 1 2.702 0.02 . 2 . . . . 59 ASP HB2 . 17959 1 710 . 1 1 59 59 ASP HB3 H 1 2.842 0.02 . 2 . . . . 59 ASP HB3 . 17959 1 711 . 1 1 59 59 ASP C C 13 176.35 0.2 . 1 . . . . 59 ASP C . 17959 1 712 . 1 1 59 59 ASP CA C 13 55.31 0.2 . 1 . . . . 59 ASP CA . 17959 1 713 . 1 1 59 59 ASP CB C 13 39.01 0.2 . 1 . . . . 59 ASP CB . 17959 1 714 . 1 1 59 59 ASP N N 15 114.86 0.2 . 1 . . . . 59 ASP N . 17959 1 715 . 1 1 60 60 TYR H H 1 8.241 0.02 . 1 . . . . 60 TYR H . 17959 1 716 . 1 1 60 60 TYR HA H 1 4.310 0.02 . 1 . . . . 60 TYR HA . 17959 1 717 . 1 1 60 60 TYR HB2 H 1 3.143 0.02 . 2 . . . . 60 TYR HB2 . 17959 1 718 . 1 1 60 60 TYR HB3 H 1 3.209 0.02 . 2 . . . . 60 TYR HB3 . 17959 1 719 . 1 1 60 60 TYR C C 13 176.03 0.2 . 1 . . . . 60 TYR C . 17959 1 720 . 1 1 60 60 TYR CA C 13 58.97 0.2 . 1 . . . . 60 TYR CA . 17959 1 721 . 1 1 60 60 TYR CB C 13 40.64 0.2 . 1 . . . . 60 TYR CB . 17959 1 722 . 1 1 60 60 TYR N N 15 114.36 0.2 . 1 . . . . 60 TYR N . 17959 1 723 . 1 1 61 61 GLY H H 1 7.844 0.02 . 1 . . . . 61 GLY H . 17959 1 724 . 1 1 61 61 GLY HA2 H 1 3.619 0.02 . 2 . . . . 61 GLY HA2 . 17959 1 725 . 1 1 61 61 GLY HA3 H 1 4.002 0.02 . 2 . . . . 61 GLY HA3 . 17959 1 726 . 1 1 61 61 GLY C C 13 174.55 0.2 . 1 . . . . 61 GLY C . 17959 1 727 . 1 1 61 61 GLY CA C 13 45.78 0.2 . 1 . . . . 61 GLY CA . 17959 1 728 . 1 1 61 61 GLY N N 15 107.24 0.2 . 1 . . . . 61 GLY N . 17959 1 729 . 1 1 62 62 PHE H H 1 6.198 0.02 . 1 . . . . 62 PHE H . 17959 1 730 . 1 1 62 62 PHE C C 13 176.99 0.2 . 1 . . . . 62 PHE C . 17959 1 731 . 1 1 62 62 PHE CA C 13 52.66 0.2 . 1 . . . . 62 PHE CA . 17959 1 732 . 1 1 62 62 PHE N N 15 118.73 0.2 . 1 . . . . 62 PHE N . 17959 1 733 . 1 1 64 64 PRO HA H 1 4.129 0.02 . 1 . . . . 64 PRO HA . 17959 1 734 . 1 1 64 64 PRO HB2 H 1 2.328 0.02 . 2 . . . . 64 PRO HB2 . 17959 1 735 . 1 1 64 64 PRO HB3 H 1 2.328 0.02 . 2 . . . . 64 PRO HB3 . 17959 1 736 . 1 1 64 64 PRO HG2 H 1 1.982 0.02 . 2 . . . . 64 PRO HG2 . 17959 1 737 . 1 1 64 64 PRO HG3 H 1 1.982 0.02 . 2 . . . . 64 PRO HG3 . 17959 1 738 . 1 1 64 64 PRO HD2 H 1 3.326 0.02 . 2 . . . . 64 PRO HD2 . 17959 1 739 . 1 1 64 64 PRO HD3 H 1 3.326 0.02 . 2 . . . . 64 PRO HD3 . 17959 1 740 . 1 1 64 64 PRO C C 13 178.77 0.2 . 1 . . . . 64 PRO C . 17959 1 741 . 1 1 64 64 PRO CA C 13 67.22 0.2 . 1 . . . . 64 PRO CA . 17959 1 742 . 1 1 64 64 PRO CB C 13 32.85 0.2 . 1 . . . . 64 PRO CB . 17959 1 743 . 1 1 64 64 PRO CG C 13 27.72 0.2 . 1 . . . . 64 PRO CG . 17959 1 744 . 1 1 64 64 PRO CD C 13 50.76 0.2 . 1 . . . . 64 PRO CD . 17959 1 745 . 1 1 65 65 VAL H H 1 7.784 0.02 . 1 . . . . 65 VAL H . 17959 1 746 . 1 1 65 65 VAL HA H 1 4.065 0.02 . 1 . . . . 65 VAL HA . 17959 1 747 . 1 1 65 65 VAL HB H 1 2.214 0.02 . 1 . . . . 65 VAL HB . 17959 1 748 . 1 1 65 65 VAL HG11 H 1 0.907 0.02 . 2 . . . . 65 VAL MG1 . 17959 1 749 . 1 1 65 65 VAL HG12 H 1 0.907 0.02 . 2 . . . . 65 VAL MG1 . 17959 1 750 . 1 1 65 65 VAL HG13 H 1 0.907 0.02 . 2 . . . . 65 VAL MG1 . 17959 1 751 . 1 1 65 65 VAL HG21 H 1 0.979 0.02 . 2 . . . . 65 VAL MG2 . 17959 1 752 . 1 1 65 65 VAL HG22 H 1 0.979 0.02 . 2 . . . . 65 VAL MG2 . 17959 1 753 . 1 1 65 65 VAL HG23 H 1 0.979 0.02 . 2 . . . . 65 VAL MG2 . 17959 1 754 . 1 1 65 65 VAL C C 13 176.06 0.2 . 1 . . . . 65 VAL C . 17959 1 755 . 1 1 65 65 VAL CA C 13 64.10 0.2 . 1 . . . . 65 VAL CA . 17959 1 756 . 1 1 65 65 VAL CB C 13 31.56 0.2 . 1 . . . . 65 VAL CB . 17959 1 757 . 1 1 65 65 VAL CG1 C 13 20.70 0.2 . 2 . . . . 65 VAL CG1 . 17959 1 758 . 1 1 65 65 VAL CG2 C 13 21.49 0.2 . 2 . . . . 65 VAL CG2 . 17959 1 759 . 1 1 65 65 VAL N N 15 111.33 0.2 . 1 . . . . 65 VAL N . 17959 1 760 . 1 1 66 66 LEU H H 1 7.584 0.02 . 1 . . . . 66 LEU H . 17959 1 761 . 1 1 66 66 LEU HA H 1 4.509 0.02 . 1 . . . . 66 LEU HA . 17959 1 762 . 1 1 66 66 LEU HB2 H 1 1.648 0.02 . 2 . . . . 66 LEU HB2 . 17959 1 763 . 1 1 66 66 LEU HB3 H 1 1.648 0.02 . 2 . . . . 66 LEU HB3 . 17959 1 764 . 1 1 66 66 LEU HG H 1 1.578 0.02 . 1 . . . . 66 LEU HG . 17959 1 765 . 1 1 66 66 LEU HD11 H 1 0.688 0.02 . 2 . . . . 66 LEU MD1 . 17959 1 766 . 1 1 66 66 LEU HD12 H 1 0.688 0.02 . 2 . . . . 66 LEU MD1 . 17959 1 767 . 1 1 66 66 LEU HD13 H 1 0.688 0.02 . 2 . . . . 66 LEU MD1 . 17959 1 768 . 1 1 66 66 LEU HD21 H 1 0.946 0.02 . 2 . . . . 66 LEU MD2 . 17959 1 769 . 1 1 66 66 LEU HD22 H 1 0.946 0.02 . 2 . . . . 66 LEU MD2 . 17959 1 770 . 1 1 66 66 LEU HD23 H 1 0.946 0.02 . 2 . . . . 66 LEU MD2 . 17959 1 771 . 1 1 66 66 LEU C C 13 175.66 0.2 . 1 . . . . 66 LEU C . 17959 1 772 . 1 1 66 66 LEU CA C 13 54.00 0.2 . 1 . . . . 66 LEU CA . 17959 1 773 . 1 1 66 66 LEU CB C 13 41.39 0.2 . 1 . . . . 66 LEU CB . 17959 1 774 . 1 1 66 66 LEU CG C 13 27.50 0.2 . 1 . . . . 66 LEU CG . 17959 1 775 . 1 1 66 66 LEU CD1 C 13 23.68 0.2 . 2 . . . . 66 LEU CD1 . 17959 1 776 . 1 1 66 66 LEU CD2 C 13 25.71 0.2 . 2 . . . . 66 LEU CD2 . 17959 1 777 . 1 1 66 66 LEU N N 15 117.72 0.2 . 1 . . . . 66 LEU N . 17959 1 778 . 1 1 67 67 GLN H H 1 7.346 0.02 . 1 . . . . 67 GLN H . 17959 1 779 . 1 1 67 67 GLN HA H 1 4.137 0.02 . 1 . . . . 67 GLN HA . 17959 1 780 . 1 1 67 67 GLN HB2 H 1 1.682 0.02 . 2 . . . . 67 GLN HB2 . 17959 1 781 . 1 1 67 67 GLN HB3 H 1 1.934 0.02 . 2 . . . . 67 GLN HB3 . 17959 1 782 . 1 1 67 67 GLN HG2 H 1 2.337 0.02 . 2 . . . . 67 GLN HG2 . 17959 1 783 . 1 1 67 67 GLN HG3 H 1 2.337 0.02 . 2 . . . . 67 GLN HG3 . 17959 1 784 . 1 1 67 67 GLN C C 13 175.53 0.2 . 1 . . . . 67 GLN C . 17959 1 785 . 1 1 67 67 GLN CA C 13 56.22 0.2 . 1 . . . . 67 GLN CA . 17959 1 786 . 1 1 67 67 GLN CB C 13 31.43 0.2 . 1 . . . . 67 GLN CB . 17959 1 787 . 1 1 67 67 GLN CG C 13 34.32 0.2 . 1 . . . . 67 GLN CG . 17959 1 788 . 1 1 67 67 GLN N N 15 116.86 0.2 . 1 . . . . 67 GLN N . 17959 1 789 . 1 1 68 68 GLN H H 1 8.594 0.02 . 1 . . . . 68 GLN H . 17959 1 790 . 1 1 68 68 GLN HA H 1 4.685 0.02 . 1 . . . . 68 GLN HA . 17959 1 791 . 1 1 68 68 GLN HB2 H 1 2.105 0.02 . 2 . . . . 68 GLN HB2 . 17959 1 792 . 1 1 68 68 GLN HB3 H 1 2.105 0.02 . 2 . . . . 68 GLN HB3 . 17959 1 793 . 1 1 68 68 GLN HG2 H 1 2.336 0.02 . 2 . . . . 68 GLN HG2 . 17959 1 794 . 1 1 68 68 GLN HG3 H 1 2.336 0.02 . 2 . . . . 68 GLN HG3 . 17959 1 795 . 1 1 68 68 GLN C C 13 173.79 0.2 . 1 . . . . 68 GLN C . 17959 1 796 . 1 1 68 68 GLN CA C 13 55.10 0.2 . 1 . . . . 68 GLN CA . 17959 1 797 . 1 1 68 68 GLN CB C 13 31.29 0.2 . 1 . . . . 68 GLN CB . 17959 1 798 . 1 1 68 68 GLN CG C 13 34.10 0.2 . 1 . . . . 68 GLN CG . 17959 1 799 . 1 1 68 68 GLN N N 15 124.05 0.2 . 1 . . . . 68 GLN N . 17959 1 800 . 1 1 69 69 TRP H H 1 9.356 0.02 . 1 . . . . 69 TRP H . 17959 1 801 . 1 1 69 69 TRP HA H 1 5.157 0.02 . 1 . . . . 69 TRP HA . 17959 1 802 . 1 1 69 69 TRP HB2 H 1 2.857 0.02 . 2 . . . . 69 TRP HB2 . 17959 1 803 . 1 1 69 69 TRP HB3 H 1 2.992 0.02 . 2 . . . . 69 TRP HB3 . 17959 1 804 . 1 1 69 69 TRP C C 13 175.90 0.2 . 1 . . . . 69 TRP C . 17959 1 805 . 1 1 69 69 TRP CA C 13 57.29 0.2 . 1 . . . . 69 TRP CA . 17959 1 806 . 1 1 69 69 TRP CB C 13 31.04 0.2 . 1 . . . . 69 TRP CB . 17959 1 807 . 1 1 69 69 TRP N N 15 127.07 0.2 . 1 . . . . 69 TRP N . 17959 1 808 . 1 1 70 70 VAL H H 1 9.645 0.02 . 1 . . . . 70 VAL H . 17959 1 809 . 1 1 70 70 VAL HA H 1 4.596 0.02 . 1 . . . . 70 VAL HA . 17959 1 810 . 1 1 70 70 VAL HB H 1 2.008 0.02 . 1 . . . . 70 VAL HB . 17959 1 811 . 1 1 70 70 VAL HG11 H 1 0.773 0.02 . 2 . . . . 70 VAL MG1 . 17959 1 812 . 1 1 70 70 VAL HG12 H 1 0.773 0.02 . 2 . . . . 70 VAL MG1 . 17959 1 813 . 1 1 70 70 VAL HG13 H 1 0.773 0.02 . 2 . . . . 70 VAL MG1 . 17959 1 814 . 1 1 70 70 VAL HG21 H 1 0.906 0.02 . 2 . . . . 70 VAL MG2 . 17959 1 815 . 1 1 70 70 VAL HG22 H 1 0.906 0.02 . 2 . . . . 70 VAL MG2 . 17959 1 816 . 1 1 70 70 VAL HG23 H 1 0.906 0.02 . 2 . . . . 70 VAL MG2 . 17959 1 817 . 1 1 70 70 VAL C C 13 175.91 0.2 . 1 . . . . 70 VAL C . 17959 1 818 . 1 1 70 70 VAL CA C 13 62.81 0.2 . 1 . . . . 70 VAL CA . 17959 1 819 . 1 1 70 70 VAL CB C 13 33.71 0.2 . 1 . . . . 70 VAL CB . 17959 1 820 . 1 1 70 70 VAL CG1 C 13 20.63 0.2 . 2 . . . . 70 VAL CG1 . 17959 1 821 . 1 1 70 70 VAL CG2 C 13 20.89 0.2 . 2 . . . . 70 VAL CG2 . 17959 1 822 . 1 1 70 70 VAL N N 15 124.88 0.2 . 1 . . . . 70 VAL N . 17959 1 823 . 1 1 71 71 ILE H H 1 8.351 0.02 . 1 . . . . 71 ILE H . 17959 1 824 . 1 1 71 71 ILE HA H 1 4.735 0.02 . 1 . . . . 71 ILE HA . 17959 1 825 . 1 1 71 71 ILE HB H 1 1.656 0.02 . 1 . . . . 71 ILE HB . 17959 1 826 . 1 1 71 71 ILE HG12 H 1 1.221 0.02 . 2 . . . . 71 ILE HG12 . 17959 1 827 . 1 1 71 71 ILE HG13 H 1 1.294 0.02 . 2 . . . . 71 ILE HG13 . 17959 1 828 . 1 1 71 71 ILE HG21 H 1 0.841 0.02 . 1 . . . . 71 ILE MG . 17959 1 829 . 1 1 71 71 ILE HG22 H 1 0.841 0.02 . 1 . . . . 71 ILE MG . 17959 1 830 . 1 1 71 71 ILE HG23 H 1 0.841 0.02 . 1 . . . . 71 ILE MG . 17959 1 831 . 1 1 71 71 ILE HD11 H 1 0.922 0.02 . 1 . . . . 71 ILE MD . 17959 1 832 . 1 1 71 71 ILE HD12 H 1 0.922 0.02 . 1 . . . . 71 ILE MD . 17959 1 833 . 1 1 71 71 ILE HD13 H 1 0.922 0.02 . 1 . . . . 71 ILE MD . 17959 1 834 . 1 1 71 71 ILE C C 13 177.22 0.2 . 1 . . . . 71 ILE C . 17959 1 835 . 1 1 71 71 ILE CA C 13 60.86 0.2 . 1 . . . . 71 ILE CA . 17959 1 836 . 1 1 71 71 ILE CB C 13 41.64 0.2 . 1 . . . . 71 ILE CB . 17959 1 837 . 1 1 71 71 ILE CG1 C 13 27.43 0.2 . 1 . . . . 71 ILE CG1 . 17959 1 838 . 1 1 71 71 ILE CG2 C 13 18.85 0.2 . 1 . . . . 71 ILE CG2 . 17959 1 839 . 1 1 71 71 ILE CD1 C 13 13.49 0.2 . 1 . . . . 71 ILE CD1 . 17959 1 840 . 1 1 71 71 ILE N N 15 123.98 0.2 . 1 . . . . 71 ILE N . 17959 1 841 . 1 1 72 72 GLY H H 1 10.214 0.02 . 1 . . . . 72 GLY H . 17959 1 842 . 1 1 72 72 GLY HA2 H 1 4.049 0.02 . 2 . . . . 72 GLY HA2 . 17959 1 843 . 1 1 72 72 GLY HA3 H 1 4.164 0.02 . 2 . . . . 72 GLY HA3 . 17959 1 844 . 1 1 72 72 GLY C C 13 175.92 0.2 . 1 . . . . 72 GLY C . 17959 1 845 . 1 1 72 72 GLY CA C 13 48.41 0.2 . 1 . . . . 72 GLY CA . 17959 1 846 . 1 1 72 72 GLY N N 15 124.21 0.2 . 1 . . . . 72 GLY N . 17959 1 847 . 1 1 73 73 GLN H H 1 9.095 0.02 . 1 . . . . 73 GLN H . 17959 1 848 . 1 1 73 73 GLN HA H 1 3.654 0.02 . 1 . . . . 73 GLN HA . 17959 1 849 . 1 1 73 73 GLN HB2 H 1 1.582 0.02 . 2 . . . . 73 GLN HB2 . 17959 1 850 . 1 1 73 73 GLN HB3 H 1 2.306 0.02 . 2 . . . . 73 GLN HB3 . 17959 1 851 . 1 1 73 73 GLN HG2 H 1 2.347 0.02 . 2 . . . . 73 GLN HG2 . 17959 1 852 . 1 1 73 73 GLN HG3 H 1 2.347 0.02 . 2 . . . . 73 GLN HG3 . 17959 1 853 . 1 1 73 73 GLN C C 13 174.52 0.2 . 1 . . . . 73 GLN C . 17959 1 854 . 1 1 73 73 GLN CA C 13 57.52 0.2 . 1 . . . . 73 GLN CA . 17959 1 855 . 1 1 73 73 GLN CB C 13 27.32 0.2 . 1 . . . . 73 GLN CB . 17959 1 856 . 1 1 73 73 GLN CG C 13 34.14 0.2 . 1 . . . . 73 GLN CG . 17959 1 857 . 1 1 73 73 GLN N N 15 110.17 0.2 . 1 . . . . 73 GLN N . 17959 1 858 . 1 1 74 74 ARG H H 1 7.315 0.02 . 1 . . . . 74 ARG H . 17959 1 859 . 1 1 74 74 ARG HA H 1 4.794 0.02 . 1 . . . . 74 ARG HA . 17959 1 860 . 1 1 74 74 ARG HB2 H 1 1.723 0.02 . 2 . . . . 74 ARG HB2 . 17959 1 861 . 1 1 74 74 ARG HB3 H 1 1.723 0.02 . 2 . . . . 74 ARG HB3 . 17959 1 862 . 1 1 74 74 ARG HG2 H 1 1.595 0.02 . 2 . . . . 74 ARG HG2 . 17959 1 863 . 1 1 74 74 ARG HG3 H 1 1.595 0.02 . 2 . . . . 74 ARG HG3 . 17959 1 864 . 1 1 74 74 ARG HD2 H 1 3.286 0.02 . 2 . . . . 74 ARG HD2 . 17959 1 865 . 1 1 74 74 ARG HD3 H 1 3.286 0.02 . 2 . . . . 74 ARG HD3 . 17959 1 866 . 1 1 74 74 ARG C C 13 175.45 0.2 . 1 . . . . 74 ARG C . 17959 1 867 . 1 1 74 74 ARG CA C 13 54.77 0.2 . 1 . . . . 74 ARG CA . 17959 1 868 . 1 1 74 74 ARG CB C 13 34.40 0.2 . 1 . . . . 74 ARG CB . 17959 1 869 . 1 1 74 74 ARG CG C 13 27.49 0.2 . 1 . . . . 74 ARG CG . 17959 1 870 . 1 1 74 74 ARG CD C 13 43.69 0.2 . 1 . . . . 74 ARG CD . 17959 1 871 . 1 1 74 74 ARG N N 15 116.81 0.2 . 1 . . . . 74 ARG N . 17959 1 872 . 1 1 75 75 LEU H H 1 8.638 0.02 . 1 . . . . 75 LEU H . 17959 1 873 . 1 1 75 75 LEU HA H 1 4.529 0.02 . 1 . . . . 75 LEU HA . 17959 1 874 . 1 1 75 75 LEU HB2 H 1 1.552 0.02 . 2 . . . . 75 LEU HB2 . 17959 1 875 . 1 1 75 75 LEU HB3 H 1 1.552 0.02 . 2 . . . . 75 LEU HB3 . 17959 1 876 . 1 1 75 75 LEU HG H 1 1.644 0.02 . 1 . . . . 75 LEU HG . 17959 1 877 . 1 1 75 75 LEU HD11 H 1 0.782 0.02 . 2 . . . . 75 LEU MD1 . 17959 1 878 . 1 1 75 75 LEU HD12 H 1 0.782 0.02 . 2 . . . . 75 LEU MD1 . 17959 1 879 . 1 1 75 75 LEU HD13 H 1 0.782 0.02 . 2 . . . . 75 LEU MD1 . 17959 1 880 . 1 1 75 75 LEU HD21 H 1 0.841 0.02 . 2 . . . . 75 LEU MD2 . 17959 1 881 . 1 1 75 75 LEU HD22 H 1 0.841 0.02 . 2 . . . . 75 LEU MD2 . 17959 1 882 . 1 1 75 75 LEU HD23 H 1 0.841 0.02 . 2 . . . . 75 LEU MD2 . 17959 1 883 . 1 1 75 75 LEU C C 13 176.44 0.2 . 1 . . . . 75 LEU C . 17959 1 884 . 1 1 75 75 LEU CA C 13 56.46 0.2 . 1 . . . . 75 LEU CA . 17959 1 885 . 1 1 75 75 LEU CB C 13 42.29 0.2 . 1 . . . . 75 LEU CB . 17959 1 886 . 1 1 75 75 LEU CG C 13 27.49 0.2 . 1 . . . . 75 LEU CG . 17959 1 887 . 1 1 75 75 LEU CD1 C 13 24.00 0.2 . 2 . . . . 75 LEU CD1 . 17959 1 888 . 1 1 75 75 LEU CD2 C 13 25.55 0.2 . 2 . . . . 75 LEU CD2 . 17959 1 889 . 1 1 75 75 LEU N N 15 125.67 0.2 . 1 . . . . 75 LEU N . 17959 1 890 . 1 1 76 76 ALA H H 1 8.852 0.02 . 1 . . . . 76 ALA H . 17959 1 891 . 1 1 76 76 ALA HA H 1 4.717 0.02 . 1 . . . . 76 ALA HA . 17959 1 892 . 1 1 76 76 ALA HB1 H 1 0.926 0.02 . 1 . . . . 76 ALA MB . 17959 1 893 . 1 1 76 76 ALA HB2 H 1 0.926 0.02 . 1 . . . . 76 ALA MB . 17959 1 894 . 1 1 76 76 ALA HB3 H 1 0.926 0.02 . 1 . . . . 76 ALA MB . 17959 1 895 . 1 1 76 76 ALA C C 13 175.81 0.2 . 1 . . . . 76 ALA C . 17959 1 896 . 1 1 76 76 ALA CA C 13 50.73 0.2 . 1 . . . . 76 ALA CA . 17959 1 897 . 1 1 76 76 ALA CB C 13 21.00 0.2 . 1 . . . . 76 ALA CB . 17959 1 898 . 1 1 76 76 ALA N N 15 130.06 0.2 . 1 . . . . 76 ALA N . 17959 1 899 . 1 1 77 77 ARG H H 1 8.518 0.02 . 1 . . . . 77 ARG H . 17959 1 900 . 1 1 77 77 ARG HA H 1 4.570 0.02 . 1 . . . . 77 ARG HA . 17959 1 901 . 1 1 77 77 ARG HB2 H 1 1.811 0.02 . 2 . . . . 77 ARG HB2 . 17959 1 902 . 1 1 77 77 ARG HB3 H 1 1.684 0.02 . 2 . . . . 77 ARG HB3 . 17959 1 903 . 1 1 77 77 ARG HG2 H 1 1.567 0.02 . 2 . . . . 77 ARG HG2 . 17959 1 904 . 1 1 77 77 ARG HG3 H 1 1.455 0.02 . 2 . . . . 77 ARG HG3 . 17959 1 905 . 1 1 77 77 ARG HD2 H 1 3.154 0.02 . 2 . . . . 77 ARG HD2 . 17959 1 906 . 1 1 77 77 ARG HD3 H 1 3.154 0.02 . 2 . . . . 77 ARG HD3 . 17959 1 907 . 1 1 77 77 ARG C C 13 177.31 0.2 . 1 . . . . 77 ARG C . 17959 1 908 . 1 1 77 77 ARG CA C 13 55.22 0.2 . 1 . . . . 77 ARG CA . 17959 1 909 . 1 1 77 77 ARG CB C 13 32.29 0.2 . 1 . . . . 77 ARG CB . 17959 1 910 . 1 1 77 77 ARG CG C 13 27.46 0.2 . 1 . . . . 77 ARG CG . 17959 1 911 . 1 1 77 77 ARG CD C 13 43.55 0.2 . 1 . . . . 77 ARG CD . 17959 1 912 . 1 1 77 77 ARG N N 15 123.14 0.2 . 1 . . . . 77 ARG N . 17959 1 913 . 1 1 78 78 ASP H H 1 8.320 0.02 . 1 . . . . 78 ASP H . 17959 1 914 . 1 1 78 78 ASP HA H 1 4.159 0.02 . 1 . . . . 78 ASP HA . 17959 1 915 . 1 1 78 78 ASP HB2 H 1 2.619 0.02 . 2 . . . . 78 ASP HB2 . 17959 1 916 . 1 1 78 78 ASP HB3 H 1 2.619 0.02 . 2 . . . . 78 ASP HB3 . 17959 1 917 . 1 1 78 78 ASP C C 13 176.94 0.2 . 1 . . . . 78 ASP C . 17959 1 918 . 1 1 78 78 ASP CA C 13 58.26 0.2 . 1 . . . . 78 ASP CA . 17959 1 919 . 1 1 78 78 ASP CB C 13 41.38 0.2 . 1 . . . . 78 ASP CB . 17959 1 920 . 1 1 78 78 ASP N N 15 118.63 0.2 . 1 . . . . 78 ASP N . 17959 1 921 . 1 1 79 79 GLN H H 1 8.537 0.02 . 1 . . . . 79 GLN H . 17959 1 922 . 1 1 79 79 GLN HA H 1 4.412 0.02 . 1 . . . . 79 GLN HA . 17959 1 923 . 1 1 79 79 GLN HB2 H 1 2.043 0.02 . 2 . . . . 79 GLN HB2 . 17959 1 924 . 1 1 79 79 GLN HB3 H 1 2.043 0.02 . 2 . . . . 79 GLN HB3 . 17959 1 925 . 1 1 79 79 GLN HG2 H 1 2.346 0.02 . 2 . . . . 79 GLN HG2 . 17959 1 926 . 1 1 79 79 GLN HG3 H 1 2.346 0.02 . 2 . . . . 79 GLN HG3 . 17959 1 927 . 1 1 79 79 GLN C C 13 174.52 0.2 . 1 . . . . 79 GLN C . 17959 1 928 . 1 1 79 79 GLN CA C 13 56.61 0.2 . 1 . . . . 79 GLN CA . 17959 1 929 . 1 1 79 79 GLN CB C 13 28.09 0.2 . 1 . . . . 79 GLN CB . 17959 1 930 . 1 1 79 79 GLN CG C 13 34.25 0.2 . 1 . . . . 79 GLN CG . 17959 1 931 . 1 1 79 79 GLN N N 15 113.43 0.2 . 1 . . . . 79 GLN N . 17959 1 932 . 1 1 80 80 GLU H H 1 7.870 0.02 . 1 . . . . 80 GLU H . 17959 1 933 . 1 1 80 80 GLU HA H 1 4.459 0.02 . 1 . . . . 80 GLU HA . 17959 1 934 . 1 1 80 80 GLU HB2 H 1 1.959 0.02 . 2 . . . . 80 GLU HB2 . 17959 1 935 . 1 1 80 80 GLU HB3 H 1 2.041 0.02 . 2 . . . . 80 GLU HB3 . 17959 1 936 . 1 1 80 80 GLU HG2 H 1 2.490 0.02 . 2 . . . . 80 GLU HG2 . 17959 1 937 . 1 1 80 80 GLU HG3 H 1 2.490 0.02 . 2 . . . . 80 GLU HG3 . 17959 1 938 . 1 1 80 80 GLU C C 13 176.63 0.2 . 1 . . . . 80 GLU C . 17959 1 939 . 1 1 80 80 GLU CA C 13 55.65 0.2 . 1 . . . . 80 GLU CA . 17959 1 940 . 1 1 80 80 GLU CB C 13 30.50 0.2 . 1 . . . . 80 GLU CB . 17959 1 941 . 1 1 80 80 GLU N N 15 119.48 0.2 . 1 . . . . 80 GLU N . 17959 1 942 . 1 1 81 81 THR H H 1 8.297 0.02 . 1 . . . . 81 THR H . 17959 1 943 . 1 1 81 81 THR HA H 1 5.036 0.02 . 1 . . . . 81 THR HA . 17959 1 944 . 1 1 81 81 THR HB H 1 4.740 0.02 . 1 . . . . 81 THR HB . 17959 1 945 . 1 1 81 81 THR HG21 H 1 1.291 0.02 . 1 . . . . 81 THR MG . 17959 1 946 . 1 1 81 81 THR HG22 H 1 1.291 0.02 . 1 . . . . 81 THR MG . 17959 1 947 . 1 1 81 81 THR HG23 H 1 1.291 0.02 . 1 . . . . 81 THR MG . 17959 1 948 . 1 1 81 81 THR C C 13 178.83 0.2 . 1 . . . . 81 THR C . 17959 1 949 . 1 1 81 81 THR CA C 13 60.14 0.2 . 1 . . . . 81 THR CA . 17959 1 950 . 1 1 81 81 THR CB C 13 72.37 0.2 . 1 . . . . 81 THR CB . 17959 1 951 . 1 1 81 81 THR CG2 C 13 22.11 0.2 . 1 . . . . 81 THR CG2 . 17959 1 952 . 1 1 81 81 THR N N 15 107.70 0.2 . 1 . . . . 81 THR N . 17959 1 953 . 1 1 82 82 LEU H H 1 8.637 0.02 . 1 . . . . 82 LEU H . 17959 1 954 . 1 1 82 82 LEU HA H 1 3.881 0.02 . 1 . . . . 82 LEU HA . 17959 1 955 . 1 1 82 82 LEU HB2 H 1 1.210 0.02 . 2 . . . . 82 LEU HB2 . 17959 1 956 . 1 1 82 82 LEU HB3 H 1 2.079 0.02 . 2 . . . . 82 LEU HB3 . 17959 1 957 . 1 1 82 82 LEU HG H 1 1.754 0.02 . 1 . . . . 82 LEU HG . 17959 1 958 . 1 1 82 82 LEU HD11 H 1 0.494 0.02 . 2 . . . . 82 LEU MD1 . 17959 1 959 . 1 1 82 82 LEU HD12 H 1 0.494 0.02 . 2 . . . . 82 LEU MD1 . 17959 1 960 . 1 1 82 82 LEU HD13 H 1 0.494 0.02 . 2 . . . . 82 LEU MD1 . 17959 1 961 . 1 1 82 82 LEU HD21 H 1 0.742 0.02 . 2 . . . . 82 LEU MD2 . 17959 1 962 . 1 1 82 82 LEU HD22 H 1 0.742 0.02 . 2 . . . . 82 LEU MD2 . 17959 1 963 . 1 1 82 82 LEU HD23 H 1 0.742 0.02 . 2 . . . . 82 LEU MD2 . 17959 1 964 . 1 1 82 82 LEU C C 13 181.40 0.2 . 1 . . . . 82 LEU C . 17959 1 965 . 1 1 82 82 LEU CA C 13 59.35 0.2 . 1 . . . . 82 LEU CA . 17959 1 966 . 1 1 82 82 LEU CB C 13 39.26 0.2 . 1 . . . . 82 LEU CB . 17959 1 967 . 1 1 82 82 LEU CG C 13 27.30 0.2 . 1 . . . . 82 LEU CG . 17959 1 968 . 1 1 82 82 LEU CD1 C 13 23.22 0.2 . 2 . . . . 82 LEU CD1 . 17959 1 969 . 1 1 82 82 LEU CD2 C 13 25.86 0.2 . 2 . . . . 82 LEU CD2 . 17959 1 970 . 1 1 82 82 LEU N N 15 122.12 0.2 . 1 . . . . 82 LEU N . 17959 1 971 . 1 1 83 83 HIS H H 1 9.369 0.02 . 1 . . . . 83 HIS H . 17959 1 972 . 1 1 83 83 HIS HA H 1 4.587 0.02 . 1 . . . . 83 HIS HA . 17959 1 973 . 1 1 83 83 HIS HB2 H 1 3.103 0.02 . 2 . . . . 83 HIS HB2 . 17959 1 974 . 1 1 83 83 HIS HB3 H 1 3.244 0.02 . 2 . . . . 83 HIS HB3 . 17959 1 975 . 1 1 83 83 HIS C C 13 178.63 0.2 . 1 . . . . 83 HIS C . 17959 1 976 . 1 1 83 83 HIS CA C 13 59.25 0.2 . 1 . . . . 83 HIS CA . 17959 1 977 . 1 1 83 83 HIS CB C 13 28.64 0.2 . 1 . . . . 83 HIS CB . 17959 1 978 . 1 1 83 83 HIS N N 15 120.06 0.2 . 1 . . . . 83 HIS N . 17959 1 979 . 1 1 84 84 SER H H 1 8.228 0.02 . 1 . . . . 84 SER H . 17959 1 980 . 1 1 84 84 SER HA H 1 4.203 0.02 . 1 . . . . 84 SER HA . 17959 1 981 . 1 1 84 84 SER HB2 H 1 3.954 0.02 . 2 . . . . 84 SER HB2 . 17959 1 982 . 1 1 84 84 SER HB3 H 1 3.954 0.02 . 2 . . . . 84 SER HB3 . 17959 1 983 . 1 1 84 84 SER C C 13 175.10 0.2 . 1 . . . . 84 SER C . 17959 1 984 . 1 1 84 84 SER CA C 13 61.70 0.2 . 1 . . . . 84 SER CA . 17959 1 985 . 1 1 84 84 SER CB C 13 63.91 0.2 . 1 . . . . 84 SER CB . 17959 1 986 . 1 1 84 84 SER N N 15 117.35 0.2 . 1 . . . . 84 SER N . 17959 1 987 . 1 1 85 85 HIS H H 1 7.584 0.02 . 1 . . . . 85 HIS H . 17959 1 988 . 1 1 85 85 HIS HA H 1 4.762 0.02 . 1 . . . . 85 HIS HA . 17959 1 989 . 1 1 85 85 HIS HB2 H 1 3.160 0.02 . 2 . . . . 85 HIS HB2 . 17959 1 990 . 1 1 85 85 HIS HB3 H 1 3.280 0.02 . 2 . . . . 85 HIS HB3 . 17959 1 991 . 1 1 85 85 HIS C C 13 173.72 0.2 . 1 . . . . 85 HIS C . 17959 1 992 . 1 1 85 85 HIS CA C 13 55.92 0.2 . 1 . . . . 85 HIS CA . 17959 1 993 . 1 1 85 85 HIS CB C 13 29.39 0.2 . 1 . . . . 85 HIS CB . 17959 1 994 . 1 1 85 85 HIS N N 15 118.34 0.2 . 1 . . . . 85 HIS N . 17959 1 995 . 1 1 86 86 GLY H H 1 7.777 0.02 . 1 . . . . 86 GLY H . 17959 1 996 . 1 1 86 86 GLY HA2 H 1 3.611 0.02 . 2 . . . . 86 GLY HA2 . 17959 1 997 . 1 1 86 86 GLY HA3 H 1 4.166 0.02 . 2 . . . . 86 GLY HA3 . 17959 1 998 . 1 1 86 86 GLY C C 13 173.95 0.2 . 1 . . . . 86 GLY C . 17959 1 999 . 1 1 86 86 GLY CA C 13 45.98 0.2 . 1 . . . . 86 GLY CA . 17959 1 1000 . 1 1 86 86 GLY N N 15 106.08 0.2 . 1 . . . . 86 GLY N . 17959 1 1001 . 1 1 87 87 VAL H H 1 7.137 0.02 . 1 . . . . 87 VAL H . 17959 1 1002 . 1 1 87 87 VAL HA H 1 3.950 0.02 . 1 . . . . 87 VAL HA . 17959 1 1003 . 1 1 87 87 VAL HB H 1 1.617 0.02 . 1 . . . . 87 VAL HB . 17959 1 1004 . 1 1 87 87 VAL HG11 H 1 0.797 0.02 . 2 . . . . 87 VAL MG1 . 17959 1 1005 . 1 1 87 87 VAL HG12 H 1 0.797 0.02 . 2 . . . . 87 VAL MG1 . 17959 1 1006 . 1 1 87 87 VAL HG13 H 1 0.797 0.02 . 2 . . . . 87 VAL MG1 . 17959 1 1007 . 1 1 87 87 VAL HG21 H 1 0.797 0.02 . 2 . . . . 87 VAL MG2 . 17959 1 1008 . 1 1 87 87 VAL HG22 H 1 0.797 0.02 . 2 . . . . 87 VAL MG2 . 17959 1 1009 . 1 1 87 87 VAL HG23 H 1 0.797 0.02 . 2 . . . . 87 VAL MG2 . 17959 1 1010 . 1 1 87 87 VAL C C 13 175.33 0.2 . 1 . . . . 87 VAL C . 17959 1 1011 . 1 1 87 87 VAL CA C 13 64.06 0.2 . 1 . . . . 87 VAL CA . 17959 1 1012 . 1 1 87 87 VAL CB C 13 30.78 0.2 . 1 . . . . 87 VAL CB . 17959 1 1013 . 1 1 87 87 VAL CG1 C 13 21.16 0.2 . 2 . . . . 87 VAL CG1 . 17959 1 1014 . 1 1 87 87 VAL CG2 C 13 21.16 0.2 . 2 . . . . 87 VAL CG2 . 17959 1 1015 . 1 1 87 87 VAL N N 15 120.46 0.2 . 1 . . . . 87 VAL N . 17959 1 1016 . 1 1 88 88 ARG H H 1 9.520 0.02 . 1 . . . . 88 ARG H . 17959 1 1017 . 1 1 88 88 ARG HA H 1 4.524 0.02 . 1 . . . . 88 ARG HA . 17959 1 1018 . 1 1 88 88 ARG HB2 H 1 1.669 0.02 . 2 . . . . 88 ARG HB2 . 17959 1 1019 . 1 1 88 88 ARG HB3 H 1 1.751 0.02 . 2 . . . . 88 ARG HB3 . 17959 1 1020 . 1 1 88 88 ARG HG2 H 1 1.407 0.02 . 2 . . . . 88 ARG HG2 . 17959 1 1021 . 1 1 88 88 ARG HG3 H 1 1.594 0.02 . 2 . . . . 88 ARG HG3 . 17959 1 1022 . 1 1 88 88 ARG HD2 H 1 3.153 0.02 . 2 . . . . 88 ARG HD2 . 17959 1 1023 . 1 1 88 88 ARG HD3 H 1 3.153 0.02 . 2 . . . . 88 ARG HD3 . 17959 1 1024 . 1 1 88 88 ARG C C 13 174.79 0.2 . 1 . . . . 88 ARG C . 17959 1 1025 . 1 1 88 88 ARG CA C 13 56.68 0.2 . 1 . . . . 88 ARG CA . 17959 1 1026 . 1 1 88 88 ARG CB C 13 34.38 0.2 . 1 . . . . 88 ARG CB . 17959 1 1027 . 1 1 88 88 ARG CG C 13 27.63 0.2 . 1 . . . . 88 ARG CG . 17959 1 1028 . 1 1 88 88 ARG N N 15 124.69 0.2 . 1 . . . . 88 ARG N . 17959 1 1029 . 1 1 89 89 GLN H H 1 8.820 0.02 . 1 . . . . 89 GLN H . 17959 1 1030 . 1 1 89 89 GLN HA H 1 4.794 0.02 . 1 . . . . 89 GLN HA . 17959 1 1031 . 1 1 89 89 GLN HB2 H 1 1.954 0.02 . 2 . . . . 89 GLN HB2 . 17959 1 1032 . 1 1 89 89 GLN HB3 H 1 2.057 0.02 . 2 . . . . 89 GLN HB3 . 17959 1 1033 . 1 1 89 89 GLN HG2 H 1 2.482 0.02 . 2 . . . . 89 GLN HG2 . 17959 1 1034 . 1 1 89 89 GLN HG3 H 1 2.482 0.02 . 2 . . . . 89 GLN HG3 . 17959 1 1035 . 1 1 89 89 GLN C C 13 173.74 0.2 . 1 . . . . 89 GLN C . 17959 1 1036 . 1 1 89 89 GLN CA C 13 54.61 0.2 . 1 . . . . 89 GLN CA . 17959 1 1037 . 1 1 89 89 GLN CB C 13 32.25 0.2 . 1 . . . . 89 GLN CB . 17959 1 1038 . 1 1 89 89 GLN CG C 13 34.31 0.2 . 1 . . . . 89 GLN CG . 17959 1 1039 . 1 1 89 89 GLN N N 15 120.04 0.2 . 1 . . . . 89 GLN N . 17959 1 1040 . 1 1 90 90 ASN H H 1 8.741 0.02 . 1 . . . . 90 ASN H . 17959 1 1041 . 1 1 90 90 ASN HA H 1 4.817 0.02 . 1 . . . . 90 ASN HA . 17959 1 1042 . 1 1 90 90 ASN HB2 H 1 2.829 0.02 . 2 . . . . 90 ASN HB2 . 17959 1 1043 . 1 1 90 90 ASN HB3 H 1 2.829 0.02 . 2 . . . . 90 ASN HB3 . 17959 1 1044 . 1 1 90 90 ASN C C 13 177.44 0.2 . 1 . . . . 90 ASN C . 17959 1 1045 . 1 1 90 90 ASN CA C 13 54.75 0.2 . 1 . . . . 90 ASN CA . 17959 1 1046 . 1 1 90 90 ASN CB C 13 38.67 0.2 . 1 . . . . 90 ASN CB . 17959 1 1047 . 1 1 90 90 ASN N N 15 118.26 0.2 . 1 . . . . 90 ASN N . 17959 1 1048 . 1 1 91 91 GLY H H 1 9.633 0.02 . 1 . . . . 91 GLY H . 17959 1 1049 . 1 1 91 91 GLY HA2 H 1 3.573 0.02 . 2 . . . . 91 GLY HA2 . 17959 1 1050 . 1 1 91 91 GLY HA3 H 1 3.751 0.02 . 2 . . . . 91 GLY HA3 . 17959 1 1051 . 1 1 91 91 GLY C C 13 174.83 0.2 . 1 . . . . 91 GLY C . 17959 1 1052 . 1 1 91 91 GLY CA C 13 45.50 0.2 . 1 . . . . 91 GLY CA . 17959 1 1053 . 1 1 91 91 GLY N N 15 111.12 0.2 . 1 . . . . 91 GLY N . 17959 1 1054 . 1 1 92 92 ASP H H 1 7.937 0.02 . 1 . . . . 92 ASP H . 17959 1 1055 . 1 1 92 92 ASP HA H 1 4.877 0.02 . 1 . . . . 92 ASP HA . 17959 1 1056 . 1 1 92 92 ASP HB2 H 1 2.761 0.02 . 2 . . . . 92 ASP HB2 . 17959 1 1057 . 1 1 92 92 ASP HB3 H 1 2.965 0.02 . 2 . . . . 92 ASP HB3 . 17959 1 1058 . 1 1 92 92 ASP C C 13 174.25 0.2 . 1 . . . . 92 ASP C . 17959 1 1059 . 1 1 92 92 ASP CA C 13 56.02 0.2 . 1 . . . . 92 ASP CA . 17959 1 1060 . 1 1 92 92 ASP CB C 13 41.38 0.2 . 1 . . . . 92 ASP CB . 17959 1 1061 . 1 1 92 92 ASP N N 15 121.72 0.2 . 1 . . . . 92 ASP N . 17959 1 1062 . 1 1 93 93 SER H H 1 8.245 0.02 . 1 . . . . 93 SER H . 17959 1 1063 . 1 1 93 93 SER HA H 1 5.854 0.02 . 1 . . . . 93 SER HA . 17959 1 1064 . 1 1 93 93 SER HB2 H 1 3.751 0.02 . 2 . . . . 93 SER HB2 . 17959 1 1065 . 1 1 93 93 SER HB3 H 1 3.751 0.02 . 2 . . . . 93 SER HB3 . 17959 1 1066 . 1 1 93 93 SER C C 13 174.45 0.2 . 1 . . . . 93 SER C . 17959 1 1067 . 1 1 93 93 SER CA C 13 57.75 0.2 . 1 . . . . 93 SER CA . 17959 1 1068 . 1 1 93 93 SER CB C 13 67.97 0.2 . 1 . . . . 93 SER CB . 17959 1 1069 . 1 1 93 93 SER N N 15 112.59 0.2 . 1 . . . . 93 SER N . 17959 1 1070 . 1 1 94 94 ALA H H 1 8.634 0.02 . 1 . . . . 94 ALA H . 17959 1 1071 . 1 1 94 94 ALA HA H 1 4.786 0.02 . 1 . . . . 94 ALA HA . 17959 1 1072 . 1 1 94 94 ALA HB1 H 1 1.589 0.02 . 1 . . . . 94 ALA MB . 17959 1 1073 . 1 1 94 94 ALA HB2 H 1 1.589 0.02 . 1 . . . . 94 ALA MB . 17959 1 1074 . 1 1 94 94 ALA HB3 H 1 1.589 0.02 . 1 . . . . 94 ALA MB . 17959 1 1075 . 1 1 94 94 ALA C C 13 173.97 0.2 . 1 . . . . 94 ALA C . 17959 1 1076 . 1 1 94 94 ALA CA C 13 51.39 0.2 . 1 . . . . 94 ALA CA . 17959 1 1077 . 1 1 94 94 ALA CB C 13 24.44 0.2 . 1 . . . . 94 ALA CB . 17959 1 1078 . 1 1 94 94 ALA N N 15 121.54 0.2 . 1 . . . . 94 ALA N . 17959 1 1079 . 1 1 95 95 TYR H H 1 8.554 0.02 . 1 . . . . 95 TYR H . 17959 1 1080 . 1 1 95 95 TYR HA H 1 4.325 0.02 . 1 . . . . 95 TYR HA . 17959 1 1081 . 1 1 95 95 TYR HB2 H 1 3.170 0.02 . 2 . . . . 95 TYR HB2 . 17959 1 1082 . 1 1 95 95 TYR HB3 H 1 3.170 0.02 . 2 . . . . 95 TYR HB3 . 17959 1 1083 . 1 1 95 95 TYR C C 13 172.56 0.2 . 1 . . . . 95 TYR C . 17959 1 1084 . 1 1 95 95 TYR CA C 13 57.78 0.2 . 1 . . . . 95 TYR CA . 17959 1 1085 . 1 1 95 95 TYR CB C 13 41.09 0.2 . 1 . . . . 95 TYR CB . 17959 1 1086 . 1 1 95 95 TYR N N 15 118.94 0.2 . 1 . . . . 95 TYR N . 17959 1 1087 . 1 1 96 96 LEU H H 1 8.203 0.02 . 1 . . . . 96 LEU H . 17959 1 1088 . 1 1 96 96 LEU HA H 1 4.031 0.02 . 1 . . . . 96 LEU HA . 17959 1 1089 . 1 1 96 96 LEU HB2 H 1 0.732 0.02 . 2 . . . . 96 LEU HB2 . 17959 1 1090 . 1 1 96 96 LEU HB3 H 1 -0.723 0.02 . 2 . . . . 96 LEU HB3 . 17959 1 1091 . 1 1 96 96 LEU HG H 1 0.566 0.02 . 1 . . . . 96 LEU HG . 17959 1 1092 . 1 1 96 96 LEU HD11 H 1 -0.389 0.02 . 2 . . . . 96 LEU MD1 . 17959 1 1093 . 1 1 96 96 LEU HD12 H 1 -0.389 0.02 . 2 . . . . 96 LEU MD1 . 17959 1 1094 . 1 1 96 96 LEU HD13 H 1 -0.389 0.02 . 2 . . . . 96 LEU MD1 . 17959 1 1095 . 1 1 96 96 LEU HD21 H 1 0.292 0.02 . 2 . . . . 96 LEU MD2 . 17959 1 1096 . 1 1 96 96 LEU HD22 H 1 0.292 0.02 . 2 . . . . 96 LEU MD2 . 17959 1 1097 . 1 1 96 96 LEU HD23 H 1 0.292 0.02 . 2 . . . . 96 LEU MD2 . 17959 1 1098 . 1 1 96 96 LEU C C 13 173.39 0.2 . 1 . . . . 96 LEU C . 17959 1 1099 . 1 1 96 96 LEU CA C 13 52.67 0.2 . 1 . . . . 96 LEU CA . 17959 1 1100 . 1 1 96 96 LEU CB C 13 42.73 0.2 . 1 . . . . 96 LEU CB . 17959 1 1101 . 1 1 96 96 LEU CG C 13 26.78 0.2 . 1 . . . . 96 LEU CG . 17959 1 1102 . 1 1 96 96 LEU CD1 C 13 21.44 0.2 . 2 . . . . 96 LEU CD1 . 17959 1 1103 . 1 1 96 96 LEU CD2 C 13 25.52 0.2 . 2 . . . . 96 LEU CD2 . 17959 1 1104 . 1 1 96 96 LEU N N 15 124.88 0.2 . 1 . . . . 96 LEU N . 17959 1 1105 . 1 1 97 97 TYR H H 1 9.026 0.02 . 1 . . . . 97 TYR H . 17959 1 1106 . 1 1 97 97 TYR HA H 1 4.510 0.02 . 1 . . . . 97 TYR HA . 17959 1 1107 . 1 1 97 97 TYR HB2 H 1 2.483 0.02 . 2 . . . . 97 TYR HB2 . 17959 1 1108 . 1 1 97 97 TYR HB3 H 1 2.544 0.02 . 2 . . . . 97 TYR HB3 . 17959 1 1109 . 1 1 97 97 TYR C C 13 174.62 0.2 . 1 . . . . 97 TYR C . 17959 1 1110 . 1 1 97 97 TYR CA C 13 56.62 0.2 . 1 . . . . 97 TYR CA . 17959 1 1111 . 1 1 97 97 TYR CB C 13 39.29 0.2 . 1 . . . . 97 TYR CB . 17959 1 1112 . 1 1 97 97 TYR N N 15 126.69 0.2 . 1 . . . . 97 TYR N . 17959 1 1113 . 1 1 98 98 LEU H H 1 8.056 0.02 . 1 . . . . 98 LEU H . 17959 1 1114 . 1 1 98 98 LEU HA H 1 4.905 0.02 . 1 . . . . 98 LEU HA . 17959 1 1115 . 1 1 98 98 LEU HB2 H 1 1.524 0.02 . 2 . . . . 98 LEU HB2 . 17959 1 1116 . 1 1 98 98 LEU HB3 H 1 1.524 0.02 . 2 . . . . 98 LEU HB3 . 17959 1 1117 . 1 1 98 98 LEU HG H 1 1.390 0.02 . 1 . . . . 98 LEU HG . 17959 1 1118 . 1 1 98 98 LEU HD11 H 1 -0.080 0.02 . 2 . . . . 98 LEU MD1 . 17959 1 1119 . 1 1 98 98 LEU HD12 H 1 -0.080 0.02 . 2 . . . . 98 LEU MD1 . 17959 1 1120 . 1 1 98 98 LEU HD13 H 1 -0.080 0.02 . 2 . . . . 98 LEU MD1 . 17959 1 1121 . 1 1 98 98 LEU HD21 H 1 0.916 0.02 . 2 . . . . 98 LEU MD2 . 17959 1 1122 . 1 1 98 98 LEU HD22 H 1 0.916 0.02 . 2 . . . . 98 LEU MD2 . 17959 1 1123 . 1 1 98 98 LEU HD23 H 1 0.916 0.02 . 2 . . . . 98 LEU MD2 . 17959 1 1124 . 1 1 98 98 LEU C C 13 177.366 0.2 . 1 . . . . 98 LEU C . 17959 1 1125 . 1 1 98 98 LEU CA C 13 52.64 0.2 . 1 . . . . 98 LEU CA . 17959 1 1126 . 1 1 98 98 LEU CB C 13 42.20 0.2 . 1 . . . . 98 LEU CB . 17959 1 1127 . 1 1 98 98 LEU CG C 13 26.73 0.2 . 1 . . . . 98 LEU CG . 17959 1 1128 . 1 1 98 98 LEU CD1 C 13 24.93 0.2 . 2 . . . . 98 LEU CD1 . 17959 1 1129 . 1 1 98 98 LEU CD2 C 13 24.63 0.2 . 2 . . . . 98 LEU CD2 . 17959 1 1130 . 1 1 98 98 LEU N N 15 122.20 0.2 . 1 . . . . 98 LEU N . 17959 1 1131 . 1 1 99 99 LEU H H 1 8.825 0.02 . 1 . . . . 99 LEU H . 17959 1 1132 . 1 1 99 99 LEU HA H 1 4.297 0.02 . 1 . . . . 99 LEU HA . 17959 1 1133 . 1 1 99 99 LEU HB2 H 1 1.482 0.02 . 2 . . . . 99 LEU HB2 . 17959 1 1134 . 1 1 99 99 LEU HB3 H 1 1.382 0.02 . 2 . . . . 99 LEU HB3 . 17959 1 1135 . 1 1 99 99 LEU HG H 1 1.595 0.02 . 1 . . . . 99 LEU HG . 17959 1 1136 . 1 1 99 99 LEU HD11 H 1 0.900 0.02 . 2 . . . . 99 LEU MD1 . 17959 1 1137 . 1 1 99 99 LEU HD12 H 1 0.900 0.02 . 2 . . . . 99 LEU MD1 . 17959 1 1138 . 1 1 99 99 LEU HD13 H 1 0.900 0.02 . 2 . . . . 99 LEU MD1 . 17959 1 1139 . 1 1 99 99 LEU HD21 H 1 0.843 0.02 . 2 . . . . 99 LEU MD2 . 17959 1 1140 . 1 1 99 99 LEU HD22 H 1 0.843 0.02 . 2 . . . . 99 LEU MD2 . 17959 1 1141 . 1 1 99 99 LEU HD23 H 1 0.843 0.02 . 2 . . . . 99 LEU MD2 . 17959 1 1142 . 1 1 99 99 LEU C C 13 176.51 0.2 . 1 . . . . 99 LEU C . 17959 1 1143 . 1 1 99 99 LEU CA C 13 54.29 0.2 . 1 . . . . 99 LEU CA . 17959 1 1144 . 1 1 99 99 LEU CB C 13 42.78 0.2 . 1 . . . . 99 LEU CB . 17959 1 1145 . 1 1 99 99 LEU CG C 13 27.56 0.2 . 1 . . . . 99 LEU CG . 17959 1 1146 . 1 1 99 99 LEU CD1 C 13 25.30 0.2 . 2 . . . . 99 LEU CD1 . 17959 1 1147 . 1 1 99 99 LEU CD2 C 13 25.10 0.2 . 2 . . . . 99 LEU CD2 . 17959 1 1148 . 1 1 99 99 LEU N N 15 125.14 0.2 . 1 . . . . 99 LEU N . 17959 1 1149 . 1 1 100 100 SER H H 1 8.192 0.02 . 1 . . . . 100 SER H . 17959 1 1150 . 1 1 100 100 SER HA H 1 4.372 0.02 . 1 . . . . 100 SER HA . 17959 1 1151 . 1 1 100 100 SER HB2 H 1 3.802 0.02 . 2 . . . . 100 SER HB2 . 17959 1 1152 . 1 1 100 100 SER HB3 H 1 3.802 0.02 . 2 . . . . 100 SER HB3 . 17959 1 1153 . 1 1 100 100 SER C C 13 175.02 0.2 . 1 . . . . 100 SER C . 17959 1 1154 . 1 1 100 100 SER CA C 13 58.23 0.2 . 1 . . . . 100 SER CA . 17959 1 1155 . 1 1 100 100 SER CB C 13 64.55 0.2 . 1 . . . . 100 SER CB . 17959 1 1156 . 1 1 100 100 SER N N 15 113.17 0.2 . 1 . . . . 100 SER N . 17959 1 1157 . 1 1 101 101 ALA H H 1 8.479 0.02 . 1 . . . . 101 ALA H . 17959 1 1158 . 1 1 101 101 ALA HA H 1 4.258 0.02 . 1 . . . . 101 ALA HA . 17959 1 1159 . 1 1 101 101 ALA HB1 H 1 1.388 0.02 . 1 . . . . 101 ALA MB . 17959 1 1160 . 1 1 101 101 ALA HB2 H 1 1.388 0.02 . 1 . . . . 101 ALA MB . 17959 1 1161 . 1 1 101 101 ALA HB3 H 1 1.388 0.02 . 1 . . . . 101 ALA MB . 17959 1 1162 . 1 1 101 101 ALA C C 13 177.83 0.2 . 1 . . . . 101 ALA C . 17959 1 1163 . 1 1 101 101 ALA CA C 13 52.80 0.2 . 1 . . . . 101 ALA CA . 17959 1 1164 . 1 1 101 101 ALA CB C 13 19.55 0.2 . 1 . . . . 101 ALA CB . 17959 1 1165 . 1 1 101 101 ALA N N 15 126.39 0.2 . 1 . . . . 101 ALA N . 17959 1 1166 . 1 1 102 102 ARG H H 1 8.229 0.02 . 1 . . . . 102 ARG H . 17959 1 1167 . 1 1 102 102 ARG HA H 1 4.214 0.02 . 1 . . . . 102 ARG HA . 17959 1 1168 . 1 1 102 102 ARG HB2 H 1 1.731 0.02 . 2 . . . . 102 ARG HB2 . 17959 1 1169 . 1 1 102 102 ARG HB3 H 1 1.812 0.02 . 2 . . . . 102 ARG HB3 . 17959 1 1170 . 1 1 102 102 ARG HG2 H 1 1.600 0.02 . 2 . . . . 102 ARG HG2 . 17959 1 1171 . 1 1 102 102 ARG HG3 H 1 1.600 0.02 . 2 . . . . 102 ARG HG3 . 17959 1 1172 . 1 1 102 102 ARG HD2 H 1 3.167 0.02 . 2 . . . . 102 ARG HD2 . 17959 1 1173 . 1 1 102 102 ARG HD3 H 1 3.167 0.02 . 2 . . . . 102 ARG HD3 . 17959 1 1174 . 1 1 102 102 ARG C C 13 176.43 0.2 . 1 . . . . 102 ARG C . 17959 1 1175 . 1 1 102 102 ARG CA C 13 56.84 0.2 . 1 . . . . 102 ARG CA . 17959 1 1176 . 1 1 102 102 ARG CB C 13 30.75 0.2 . 1 . . . . 102 ARG CB . 17959 1 1177 . 1 1 102 102 ARG CG C 13 27.47 0.2 . 1 . . . . 102 ARG CG . 17959 1 1178 . 1 1 102 102 ARG CD C 13 43.71 0.2 . 1 . . . . 102 ARG CD . 17959 1 1179 . 1 1 102 102 ARG N N 15 118.84 0.2 . 1 . . . . 102 ARG N . 17959 1 1180 . 1 1 103 103 ASN H H 1 8.333 0.02 . 1 . . . . 103 ASN H . 17959 1 1181 . 1 1 103 103 ASN HA H 1 4.746 0.02 . 1 . . . . 103 ASN HA . 17959 1 1182 . 1 1 103 103 ASN HB2 H 1 2.792 0.02 . 2 . . . . 103 ASN HB2 . 17959 1 1183 . 1 1 103 103 ASN HB3 H 1 2.860 0.02 . 2 . . . . 103 ASN HB3 . 17959 1 1184 . 1 1 103 103 ASN C C 13 175.46 0.2 . 1 . . . . 103 ASN C . 17959 1 1185 . 1 1 103 103 ASN CA C 13 53.73 0.2 . 1 . . . . 103 ASN CA . 17959 1 1186 . 1 1 103 103 ASN CB C 13 38.67 0.2 . 1 . . . . 103 ASN CB . 17959 1 1187 . 1 1 103 103 ASN N N 15 118.57 0.2 . 1 . . . . 103 ASN N . 17959 1 1188 . 1 1 104 104 THR H H 1 7.904 0.02 . 1 . . . . 104 THR H . 17959 1 1189 . 1 1 104 104 THR HA H 1 4.224 0.02 . 1 . . . . 104 THR HA . 17959 1 1190 . 1 1 104 104 THR HB H 1 4.256 0.02 . 1 . . . . 104 THR HB . 17959 1 1191 . 1 1 104 104 THR HG21 H 1 1.137 0.02 . 1 . . . . 104 THR MG . 17959 1 1192 . 1 1 104 104 THR HG22 H 1 1.137 0.02 . 1 . . . . 104 THR MG . 17959 1 1193 . 1 1 104 104 THR HG23 H 1 1.137 0.02 . 1 . . . . 104 THR MG . 17959 1 1194 . 1 1 104 104 THR C C 13 174.57 0.2 . 1 . . . . 104 THR C . 17959 1 1195 . 1 1 104 104 THR CA C 13 62.30 0.2 . 1 . . . . 104 THR CA . 17959 1 1196 . 1 1 104 104 THR CB C 13 70.21 0.2 . 1 . . . . 104 THR CB . 17959 1 1197 . 1 1 104 104 THR CG2 C 13 22.25 0.2 . 1 . . . . 104 THR CG2 . 17959 1 1198 . 1 1 104 104 THR N N 15 113.36 0.2 . 1 . . . . 104 THR N . 17959 1 1199 . 1 1 105 105 SER H H 1 8.250 0.02 . 1 . . . . 105 SER H . 17959 1 1200 . 1 1 105 105 SER HA H 1 4.458 0.02 . 1 . . . . 105 SER HA . 17959 1 1201 . 1 1 105 105 SER HB2 H 1 3.829 0.02 . 2 . . . . 105 SER HB2 . 17959 1 1202 . 1 1 105 105 SER HB3 H 1 3.829 0.02 . 2 . . . . 105 SER HB3 . 17959 1 1203 . 1 1 105 105 SER C C 13 174.38 0.2 . 1 . . . . 105 SER C . 17959 1 1204 . 1 1 105 105 SER CA C 13 58.67 0.2 . 1 . . . . 105 SER CA . 17959 1 1205 . 1 1 105 105 SER CB C 13 63.94 0.2 . 1 . . . . 105 SER CB . 17959 1 1206 . 1 1 105 105 SER N N 15 117.57 0.2 . 1 . . . . 105 SER N . 17959 1 1207 . 1 1 106 106 LEU H H 1 8.108 0.02 . 1 . . . . 106 LEU H . 17959 1 1208 . 1 1 106 106 LEU HA H 1 4.354 0.02 . 1 . . . . 106 LEU HA . 17959 1 1209 . 1 1 106 106 LEU HB2 H 1 1.265 0.02 . 2 . . . . 106 LEU HB2 . 17959 1 1210 . 1 1 106 106 LEU HB3 H 1 1.396 0.02 . 2 . . . . 106 LEU HB3 . 17959 1 1211 . 1 1 106 106 LEU HG H 1 1.559 0.02 . 1 . . . . 106 LEU HG . 17959 1 1212 . 1 1 106 106 LEU HD11 H 1 0.844 0.02 . 2 . . . . 106 LEU MD1 . 17959 1 1213 . 1 1 106 106 LEU HD12 H 1 0.844 0.02 . 2 . . . . 106 LEU MD1 . 17959 1 1214 . 1 1 106 106 LEU HD13 H 1 0.844 0.02 . 2 . . . . 106 LEU MD1 . 17959 1 1215 . 1 1 106 106 LEU HD21 H 1 0.895 0.02 . 2 . . . . 106 LEU MD2 . 17959 1 1216 . 1 1 106 106 LEU HD22 H 1 0.895 0.02 . 2 . . . . 106 LEU MD2 . 17959 1 1217 . 1 1 106 106 LEU HD23 H 1 0.895 0.02 . 2 . . . . 106 LEU MD2 . 17959 1 1218 . 1 1 106 106 LEU C C 13 176.55 0.2 . 1 . . . . 106 LEU C . 17959 1 1219 . 1 1 106 106 LEU CA C 13 55.01 0.2 . 1 . . . . 106 LEU CA . 17959 1 1220 . 1 1 106 106 LEU CB C 13 42.83 0.2 . 1 . . . . 106 LEU CB . 17959 1 1221 . 1 1 106 106 LEU CG C 13 27.45 0.2 . 1 . . . . 106 LEU CG . 17959 1 1222 . 1 1 106 106 LEU CD1 C 13 25.45 0.2 . 2 . . . . 106 LEU CD1 . 17959 1 1223 . 1 1 106 106 LEU CD2 C 13 25.16 0.2 . 2 . . . . 106 LEU CD2 . 17959 1 1224 . 1 1 106 106 LEU N N 15 123.57 0.2 . 1 . . . . 106 LEU N . 17959 1 1225 . 1 1 107 107 ASN H H 1 8.282 0.02 . 1 . . . . 107 ASN H . 17959 1 1226 . 1 1 107 107 ASN HA H 1 4.906 0.02 . 1 . . . . 107 ASN HA . 17959 1 1227 . 1 1 107 107 ASN HB2 H 1 2.941 0.02 . 2 . . . . 107 ASN HB2 . 17959 1 1228 . 1 1 107 107 ASN HB3 H 1 2.869 0.02 . 2 . . . . 107 ASN HB3 . 17959 1 1229 . 1 1 107 107 ASN CA C 13 51.61 0.2 . 1 . . . . 107 ASN CA . 17959 1 1230 . 1 1 107 107 ASN CB C 13 38.50 0.2 . 1 . . . . 107 ASN CB . 17959 1 1231 . 1 1 107 107 ASN N N 15 120.94 0.2 . 1 . . . . 107 ASN N . 17959 1 1232 . 1 1 108 108 PRO HA H 1 4.220 0.02 . 1 . . . . 108 PRO HA . 17959 1 1233 . 1 1 108 108 PRO HB2 H 1 1.908 0.02 . 2 . . . . 108 PRO HB2 . 17959 1 1234 . 1 1 108 108 PRO HB3 H 1 2.350 0.02 . 2 . . . . 108 PRO HB3 . 17959 1 1235 . 1 1 108 108 PRO HG2 H 1 2.341 0.02 . 2 . . . . 108 PRO HG2 . 17959 1 1236 . 1 1 108 108 PRO HG3 H 1 1.944 0.02 . 2 . . . . 108 PRO HG3 . 17959 1 1237 . 1 1 108 108 PRO HD2 H 1 3.778 0.02 . 2 . . . . 108 PRO HD2 . 17959 1 1238 . 1 1 108 108 PRO HD3 H 1 3.778 0.02 . 2 . . . . 108 PRO HD3 . 17959 1 1239 . 1 1 108 108 PRO C C 13 178.84 0.2 . 1 . . . . 108 PRO C . 17959 1 1240 . 1 1 108 108 PRO CA C 13 65.77 0.2 . 1 . . . . 108 PRO CA . 17959 1 1241 . 1 1 108 108 PRO CB C 13 32.18 0.2 . 1 . . . . 108 PRO CB . 17959 1 1242 . 1 1 108 108 PRO CG C 13 27.67 0.2 . 1 . . . . 108 PRO CG . 17959 1 1243 . 1 1 108 108 PRO CD C 13 51.01 0.2 . 1 . . . . 108 PRO CD . 17959 1 1244 . 1 1 109 109 GLN H H 1 8.251 0.02 . 1 . . . . 109 GLN H . 17959 1 1245 . 1 1 109 109 GLN HA H 1 3.812 0.02 . 1 . . . . 109 GLN HA . 17959 1 1246 . 1 1 109 109 GLN HB2 H 1 2.092 0.02 . 2 . . . . 109 GLN HB2 . 17959 1 1247 . 1 1 109 109 GLN HB3 H 1 2.169 0.02 . 2 . . . . 109 GLN HB3 . 17959 1 1248 . 1 1 109 109 GLN HG2 H 1 2.313 0.02 . 2 . . . . 109 GLN HG2 . 17959 1 1249 . 1 1 109 109 GLN HG3 H 1 2.414 0.02 . 2 . . . . 109 GLN HG3 . 17959 1 1250 . 1 1 109 109 GLN C C 13 174.55 0.2 . 1 . . . . 109 GLN C . 17959 1 1251 . 1 1 109 109 GLN CA C 13 58.89 0.2 . 1 . . . . 109 GLN CA . 17959 1 1252 . 1 1 109 109 GLN CB C 13 28.29 0.2 . 1 . . . . 109 GLN CB . 17959 1 1253 . 1 1 109 109 GLN CG C 13 34.42 0.2 . 1 . . . . 109 GLN CG . 17959 1 1254 . 1 1 109 109 GLN N N 15 117.71 0.2 . 1 . . . . 109 GLN N . 17959 1 1255 . 1 1 110 110 GLU H H 1 8.079 0.02 . 1 . . . . 110 GLU H . 17959 1 1256 . 1 1 110 110 GLU HA H 1 4.269 0.02 . 1 . . . . 110 GLU HA . 17959 1 1257 . 1 1 110 110 GLU HB2 H 1 1.947 0.02 . 2 . . . . 110 GLU HB2 . 17959 1 1258 . 1 1 110 110 GLU HB3 H 1 2.046 0.02 . 2 . . . . 110 GLU HB3 . 17959 1 1259 . 1 1 110 110 GLU HG2 H 1 2.340 0.02 . 2 . . . . 110 GLU HG2 . 17959 1 1260 . 1 1 110 110 GLU HG3 H 1 2.340 0.02 . 2 . . . . 110 GLU HG3 . 17959 1 1261 . 1 1 110 110 GLU C C 13 177.99 0.2 . 1 . . . . 110 GLU C . 17959 1 1262 . 1 1 110 110 GLU CA C 13 56.44 0.2 . 1 . . . . 110 GLU CA . 17959 1 1263 . 1 1 110 110 GLU CB C 13 32.92 0.2 . 1 . . . . 110 GLU CB . 17959 1 1264 . 1 1 110 110 GLU N N 15 121.70 0.2 . 1 . . . . 110 GLU N . 17959 1 1265 . 1 1 111 111 LEU H H 1 8.230 0.02 . 1 . . . . 111 LEU H . 17959 1 1266 . 1 1 111 111 LEU C C 13 178.99 0.2 . 1 . . . . 111 LEU C . 17959 1 1267 . 1 1 111 111 LEU CA C 13 58.31 0.2 . 1 . . . . 111 LEU CA . 17959 1 1268 . 1 1 111 111 LEU CB C 13 42.18 0.2 . 1 . . . . 111 LEU CB . 17959 1 1269 . 1 1 111 111 LEU N N 15 119.61 0.2 . 1 . . . . 111 LEU N . 17959 1 1270 . 1 1 112 112 GLN H H 1 8.135 0.02 . 1 . . . . 112 GLN H . 17959 1 1271 . 1 1 112 112 GLN HA H 1 4.079 0.02 . 1 . . . . 112 GLN HA . 17959 1 1272 . 1 1 112 112 GLN HB2 H 1 1.879 0.02 . 2 . . . . 112 GLN HB2 . 17959 1 1273 . 1 1 112 112 GLN HB3 H 1 2.117 0.02 . 2 . . . . 112 GLN HB3 . 17959 1 1274 . 1 1 112 112 GLN HG2 H 1 2.297 0.02 . 2 . . . . 112 GLN HG2 . 17959 1 1275 . 1 1 112 112 GLN HG3 H 1 2.405 0.02 . 2 . . . . 112 GLN HG3 . 17959 1 1276 . 1 1 112 112 GLN C C 13 178.49 0.2 . 1 . . . . 112 GLN C . 17959 1 1277 . 1 1 112 112 GLN CA C 13 57.95 0.2 . 1 . . . . 112 GLN CA . 17959 1 1278 . 1 1 112 112 GLN CB C 13 28.67 0.2 . 1 . . . . 112 GLN CB . 17959 1 1279 . 1 1 112 112 GLN CG C 13 35.04 0.2 . 1 . . . . 112 GLN CG . 17959 1 1280 . 1 1 112 112 GLN N N 15 119.05 0.2 . 1 . . . . 112 GLN N . 17959 1 1281 . 1 1 113 113 ARG H H 1 8.053 0.02 . 1 . . . . 113 ARG H . 17959 1 1282 . 1 1 113 113 ARG C C 13 178.50 0.2 . 1 . . . . 113 ARG C . 17959 1 1283 . 1 1 113 113 ARG CA C 13 59.20 0.2 . 1 . . . . 113 ARG CA . 17959 1 1284 . 1 1 113 113 ARG CB C 13 30.07 0.2 . 1 . . . . 113 ARG CB . 17959 1 1285 . 1 1 113 113 ARG N N 15 119.59 0.2 . 1 . . . . 113 ARG N . 17959 1 1286 . 1 1 114 114 GLU H H 1 8.179 0.02 . 1 . . . . 114 GLU H . 17959 1 1287 . 1 1 114 114 GLU HA H 1 4.036 0.02 . 1 . . . . 114 GLU HA . 17959 1 1288 . 1 1 114 114 GLU HB2 H 1 1.858 0.02 . 2 . . . . 114 GLU HB2 . 17959 1 1289 . 1 1 114 114 GLU HB3 H 1 2.119 0.02 . 2 . . . . 114 GLU HB3 . 17959 1 1290 . 1 1 114 114 GLU HG2 H 1 2.402 0.02 . 2 . . . . 114 GLU HG2 . 17959 1 1291 . 1 1 114 114 GLU HG3 H 1 2.402 0.02 . 2 . . . . 114 GLU HG3 . 17959 1 1292 . 1 1 114 114 GLU C C 13 178.16 0.2 . 1 . . . . 114 GLU C . 17959 1 1293 . 1 1 114 114 GLU CA C 13 58.88 0.2 . 1 . . . . 114 GLU CA . 17959 1 1294 . 1 1 114 114 GLU CB C 13 28.31 0.2 . 1 . . . . 114 GLU CB . 17959 1 1295 . 1 1 114 114 GLU N N 15 118.32 0.2 . 1 . . . . 114 GLU N . 17959 1 1296 . 1 1 115 115 ARG H H 1 7.908 0.02 . 1 . . . . 115 ARG H . 17959 1 1297 . 1 1 115 115 ARG HA H 1 4.069 0.02 . 1 . . . . 115 ARG HA . 17959 1 1298 . 1 1 115 115 ARG HB2 H 1 1.709 0.02 . 2 . . . . 115 ARG HB2 . 17959 1 1299 . 1 1 115 115 ARG HB3 H 1 1.740 0.02 . 2 . . . . 115 ARG HB3 . 17959 1 1300 . 1 1 115 115 ARG HG2 H 1 1.581 0.02 . 2 . . . . 115 ARG HG2 . 17959 1 1301 . 1 1 115 115 ARG HG3 H 1 1.581 0.02 . 2 . . . . 115 ARG HG3 . 17959 1 1302 . 1 1 115 115 ARG HD2 H 1 3.150 0.02 . 2 . . . . 115 ARG HD2 . 17959 1 1303 . 1 1 115 115 ARG HD3 H 1 3.150 0.02 . 2 . . . . 115 ARG HD3 . 17959 1 1304 . 1 1 115 115 ARG C C 13 178.45 0.2 . 1 . . . . 115 ARG C . 17959 1 1305 . 1 1 115 115 ARG CA C 13 59.11 0.2 . 1 . . . . 115 ARG CA . 17959 1 1306 . 1 1 115 115 ARG CB C 13 26.65 0.2 . 1 . . . . 115 ARG CB . 17959 1 1307 . 1 1 115 115 ARG CG C 13 27.41 0.2 . 1 . . . . 115 ARG CG . 17959 1 1308 . 1 1 115 115 ARG CD C 13 43.73 0.2 . 1 . . . . 115 ARG CD . 17959 1 1309 . 1 1 115 115 ARG N N 15 120.38 0.2 . 1 . . . . 115 ARG N . 17959 1 1310 . 1 1 116 116 GLN H H 1 8.045 0.02 . 1 . . . . 116 GLN H . 17959 1 1311 . 1 1 116 116 GLN HA H 1 4.132 0.02 . 1 . . . . 116 GLN HA . 17959 1 1312 . 1 1 116 116 GLN HB2 H 1 1.876 0.02 . 2 . . . . 116 GLN HB2 . 17959 1 1313 . 1 1 116 116 GLN HB3 H 1 1.876 0.02 . 2 . . . . 116 GLN HB3 . 17959 1 1314 . 1 1 116 116 GLN HG2 H 1 2.329 0.02 . 2 . . . . 116 GLN HG2 . 17959 1 1315 . 1 1 116 116 GLN HG3 H 1 2.404 0.02 . 2 . . . . 116 GLN HG3 . 17959 1 1316 . 1 1 116 116 GLN C C 13 178.41 0.2 . 1 . . . . 116 GLN C . 17959 1 1317 . 1 1 116 116 GLN CA C 13 58.27 0.2 . 1 . . . . 116 GLN CA . 17959 1 1318 . 1 1 116 116 GLN CB C 13 28.63 0.2 . 1 . . . . 116 GLN CB . 17959 1 1319 . 1 1 116 116 GLN CG C 13 34.50 0.2 . 1 . . . . 116 GLN CG . 17959 1 1320 . 1 1 116 116 GLN N N 15 121.06 0.2 . 1 . . . . 116 GLN N . 17959 1 1321 . 1 1 117 117 LEU H H 1 8.063 0.02 . 1 . . . . 117 LEU H . 17959 1 1322 . 1 1 117 117 LEU HA H 1 4.042 0.02 . 1 . . . . 117 LEU HA . 17959 1 1323 . 1 1 117 117 LEU HB2 H 1 1.686 0.02 . 2 . . . . 117 LEU HB2 . 17959 1 1324 . 1 1 117 117 LEU HB3 H 1 1.686 0.02 . 2 . . . . 117 LEU HB3 . 17959 1 1325 . 1 1 117 117 LEU HG H 1 1.573 0.02 . 1 . . . . 117 LEU HG . 17959 1 1326 . 1 1 117 117 LEU HD11 H 1 0.818 0.02 . 2 . . . . 117 LEU MD1 . 17959 1 1327 . 1 1 117 117 LEU HD12 H 1 0.818 0.02 . 2 . . . . 117 LEU MD1 . 17959 1 1328 . 1 1 117 117 LEU HD13 H 1 0.818 0.02 . 2 . . . . 117 LEU MD1 . 17959 1 1329 . 1 1 117 117 LEU HD21 H 1 0.818 0.02 . 2 . . . . 117 LEU MD2 . 17959 1 1330 . 1 1 117 117 LEU HD22 H 1 0.818 0.02 . 2 . . . . 117 LEU MD2 . 17959 1 1331 . 1 1 117 117 LEU HD23 H 1 0.818 0.02 . 2 . . . . 117 LEU MD2 . 17959 1 1332 . 1 1 117 117 LEU C C 13 179.21 0.2 . 1 . . . . 117 LEU C . 17959 1 1333 . 1 1 117 117 LEU CA C 13 57.81 0.2 . 1 . . . . 117 LEU CA . 17959 1 1334 . 1 1 117 117 LEU CB C 13 42.03 0.2 . 1 . . . . 117 LEU CB . 17959 1 1335 . 1 1 117 117 LEU CG C 13 27.55 0.2 . 1 . . . . 117 LEU CG . 17959 1 1336 . 1 1 117 117 LEU CD1 C 13 25.38 0.2 . 2 . . . . 117 LEU CD1 . 17959 1 1337 . 1 1 117 117 LEU CD2 C 13 25.38 0.2 . 2 . . . . 117 LEU CD2 . 17959 1 1338 . 1 1 117 117 LEU N N 15 120.40 0.2 . 1 . . . . 117 LEU N . 17959 1 1339 . 1 1 118 118 ARG H H 1 7.907 0.02 . 1 . . . . 118 ARG H . 17959 1 1340 . 1 1 118 118 ARG C C 13 178.06 0.2 . 1 . . . . 118 ARG C . 17959 1 1341 . 1 1 118 118 ARG CA C 13 58.50 0.2 . 1 . . . . 118 ARG CA . 17959 1 1342 . 1 1 118 118 ARG N N 15 118.46 0.2 . 1 . . . . 118 ARG N . 17959 1 1343 . 1 1 119 119 MET H H 1 7.862 0.02 . 1 . . . . 119 MET H . 17959 1 1344 . 1 1 119 119 MET HA H 1 4.049 0.02 . 1 . . . . 119 MET HA . 17959 1 1345 . 1 1 119 119 MET HB2 H 1 2.090 0.02 . 2 . . . . 119 MET HB2 . 17959 1 1346 . 1 1 119 119 MET HB3 H 1 2.090 0.02 . 2 . . . . 119 MET HB3 . 17959 1 1347 . 1 1 119 119 MET HG2 H 1 2.409 0.02 . 2 . . . . 119 MET HG2 . 17959 1 1348 . 1 1 119 119 MET HG3 H 1 2.323 0.02 . 2 . . . . 119 MET HG3 . 17959 1 1349 . 1 1 119 119 MET C C 13 176.79 0.2 . 1 . . . . 119 MET C . 17959 1 1350 . 1 1 119 119 MET CA C 13 58.20 0.2 . 1 . . . . 119 MET CA . 17959 1 1351 . 1 1 119 119 MET CB C 13 28.47 0.2 . 1 . . . . 119 MET CB . 17959 1 1352 . 1 1 119 119 MET N N 15 118.22 0.2 . 1 . . . . 119 MET N . 17959 1 1353 . 1 1 120 120 LEU H H 1 7.868 0.02 . 1 . . . . 120 LEU H . 17959 1 1354 . 1 1 120 120 LEU C C 13 178.78 0.2 . 1 . . . . 120 LEU C . 17959 1 1355 . 1 1 120 120 LEU CA C 13 55.86 0.2 . 1 . . . . 120 LEU CA . 17959 1 1356 . 1 1 120 120 LEU CB C 13 42.29 0.2 . 1 . . . . 120 LEU CB . 17959 1 1357 . 1 1 120 120 LEU N N 15 120.13 0.2 . 1 . . . . 120 LEU N . 17959 1 1358 . 1 1 121 121 GLN H H 1 7.923 0.02 . 1 . . . . 121 GLN H . 17959 1 1359 . 1 1 121 121 GLN C C 13 178.59 0.2 . 1 . . . . 121 GLN C . 17959 1 1360 . 1 1 121 121 GLN CA C 13 59.12 0.2 . 1 . . . . 121 GLN CA . 17959 1 1361 . 1 1 121 121 GLN CB C 13 28.39 0.2 . 1 . . . . 121 GLN CB . 17959 1 1362 . 1 1 121 121 GLN N N 15 118.47 0.2 . 1 . . . . 121 GLN N . 17959 1 1363 . 1 1 122 122 ASP H H 1 8.086 0.02 . 1 . . . . 122 ASP H . 17959 1 1364 . 1 1 122 122 ASP C C 13 175.83 0.2 . 1 . . . . 122 ASP C . 17959 1 1365 . 1 1 122 122 ASP CA C 13 58.48 0.2 . 1 . . . . 122 ASP CA . 17959 1 1366 . 1 1 122 122 ASP N N 15 119.16 0.2 . 1 . . . . 122 ASP N . 17959 1 1367 . 1 1 123 123 LEU H H 1 8.124 0.02 . 1 . . . . 123 LEU H . 17959 1 1368 . 1 1 123 123 LEU HA H 1 4.265 0.02 . 1 . . . . 123 LEU HA . 17959 1 1369 . 1 1 123 123 LEU HB2 H 1 1.599 0.02 . 2 . . . . 123 LEU HB2 . 17959 1 1370 . 1 1 123 123 LEU HB3 H 1 1.599 0.02 . 2 . . . . 123 LEU HB3 . 17959 1 1371 . 1 1 123 123 LEU HG H 1 1.321 0.02 . 1 . . . . 123 LEU HG . 17959 1 1372 . 1 1 123 123 LEU HD11 H 1 0.892 0.02 . 2 . . . . 123 LEU MD1 . 17959 1 1373 . 1 1 123 123 LEU HD12 H 1 0.892 0.02 . 2 . . . . 123 LEU MD1 . 17959 1 1374 . 1 1 123 123 LEU HD13 H 1 0.892 0.02 . 2 . . . . 123 LEU MD1 . 17959 1 1375 . 1 1 123 123 LEU HD21 H 1 0.892 0.02 . 2 . . . . 123 LEU MD2 . 17959 1 1376 . 1 1 123 123 LEU HD22 H 1 0.892 0.02 . 2 . . . . 123 LEU MD2 . 17959 1 1377 . 1 1 123 123 LEU HD23 H 1 0.892 0.02 . 2 . . . . 123 LEU MD2 . 17959 1 1378 . 1 1 123 123 LEU C C 13 177.80 0.2 . 1 . . . . 123 LEU C . 17959 1 1379 . 1 1 123 123 LEU CA C 13 55.97 0.2 . 1 . . . . 123 LEU CA . 17959 1 1380 . 1 1 123 123 LEU CB C 13 42.71 0.2 . 1 . . . . 123 LEU CB . 17959 1 1381 . 1 1 123 123 LEU CG C 13 26.33 0.2 . 1 . . . . 123 LEU CG . 17959 1 1382 . 1 1 123 123 LEU N N 15 121.87 0.2 . 1 . . . . 123 LEU N . 17959 1 1383 . 1 1 124 124 GLY H H 1 8.031 0.02 . 1 . . . . 124 GLY H . 17959 1 1384 . 1 1 124 124 GLY HA2 H 1 3.764 0.02 . 2 . . . . 124 GLY HA2 . 17959 1 1385 . 1 1 124 124 GLY HA3 H 1 3.838 0.02 . 2 . . . . 124 GLY HA3 . 17959 1 1386 . 1 1 124 124 GLY C C 13 176.81 0.2 . 1 . . . . 124 GLY C . 17959 1 1387 . 1 1 124 124 GLY CA C 13 45.47 0.2 . 1 . . . . 124 GLY CA . 17959 1 1388 . 1 1 124 124 GLY N N 15 106.95 0.2 . 1 . . . . 124 GLY N . 17959 1 1389 . 1 1 125 125 PHE H H 1 7.872 0.02 . 1 . . . . 125 PHE H . 17959 1 1390 . 1 1 125 125 PHE HA H 1 4.295 0.02 . 1 . . . . 125 PHE HA . 17959 1 1391 . 1 1 125 125 PHE HB2 H 1 3.170 0.02 . 2 . . . . 125 PHE HB2 . 17959 1 1392 . 1 1 125 125 PHE HB3 H 1 3.170 0.02 . 2 . . . . 125 PHE HB3 . 17959 1 1393 . 1 1 125 125 PHE C C 13 176.21 0.2 . 1 . . . . 125 PHE C . 17959 1 1394 . 1 1 125 125 PHE CA C 13 55.65 0.2 . 1 . . . . 125 PHE CA . 17959 1 1395 . 1 1 125 125 PHE CB C 13 42.25 0.2 . 1 . . . . 125 PHE CB . 17959 1 1396 . 1 1 125 125 PHE N N 15 119.65 0.2 . 1 . . . . 125 PHE N . 17959 1 1397 . 1 1 126 126 LYS H H 1 7.928 0.02 . 1 . . . . 126 LYS H . 17959 1 1398 . 1 1 126 126 LYS C C 13 176.00 0.2 . 1 . . . . 126 LYS C . 17959 1 1399 . 1 1 126 126 LYS CA C 13 56.53 0.2 . 1 . . . . 126 LYS CA . 17959 1 1400 . 1 1 126 126 LYS CB C 13 33.87 0.2 . 1 . . . . 126 LYS CB . 17959 1 1401 . 1 1 126 126 LYS N N 15 120.73 0.2 . 1 . . . . 126 LYS N . 17959 1 1402 . 1 1 127 127 ASP H H 1 8.229 0.02 . 1 . . . . 127 ASP H . 17959 1 1403 . 1 1 127 127 ASP HA H 1 4.618 0.02 . 1 . . . . 127 ASP HA . 17959 1 1404 . 1 1 127 127 ASP HB2 H 1 2.695 0.02 . 2 . . . . 127 ASP HB2 . 17959 1 1405 . 1 1 127 127 ASP HB3 H 1 2.839 0.02 . 2 . . . . 127 ASP HB3 . 17959 1 1406 . 1 1 127 127 ASP C C 13 175.39 0.2 . 1 . . . . 127 ASP C . 17959 1 1407 . 1 1 127 127 ASP CA C 13 54.00 0.2 . 1 . . . . 127 ASP CA . 17959 1 1408 . 1 1 127 127 ASP CB C 13 39.73 0.2 . 1 . . . . 127 ASP CB . 17959 1 1409 . 1 1 127 127 ASP N N 15 119.27 0.2 . 1 . . . . 127 ASP N . 17959 1 1410 . 1 1 128 128 LEU H H 1 8.078 0.02 . 1 . . . . 128 LEU H . 17959 1 1411 . 1 1 128 128 LEU HA H 1 4.385 0.02 . 1 . . . . 128 LEU HA . 17959 1 1412 . 1 1 128 128 LEU HB2 H 1 1.604 0.02 . 2 . . . . 128 LEU HB2 . 17959 1 1413 . 1 1 128 128 LEU HB3 H 1 1.604 0.02 . 2 . . . . 128 LEU HB3 . 17959 1 1414 . 1 1 128 128 LEU HG H 1 1.231 0.02 . 1 . . . . 128 LEU HG . 17959 1 1415 . 1 1 128 128 LEU HD11 H 1 0.855 0.02 . 2 . . . . 128 LEU MD1 . 17959 1 1416 . 1 1 128 128 LEU HD12 H 1 0.855 0.02 . 2 . . . . 128 LEU MD1 . 17959 1 1417 . 1 1 128 128 LEU HD13 H 1 0.855 0.02 . 2 . . . . 128 LEU MD1 . 17959 1 1418 . 1 1 128 128 LEU HD21 H 1 0.918 0.02 . 2 . . . . 128 LEU MD2 . 17959 1 1419 . 1 1 128 128 LEU HD22 H 1 0.918 0.02 . 2 . . . . 128 LEU MD2 . 17959 1 1420 . 1 1 128 128 LEU HD23 H 1 0.918 0.02 . 2 . . . . 128 LEU MD2 . 17959 1 1421 . 1 1 128 128 LEU C C 13 176.97 0.2 . 1 . . . . 128 LEU C . 17959 1 1422 . 1 1 128 128 LEU CA C 13 55.51 0.2 . 1 . . . . 128 LEU CA . 17959 1 1423 . 1 1 128 128 LEU CB C 13 42.57 0.2 . 1 . . . . 128 LEU CB . 17959 1 1424 . 1 1 128 128 LEU CG C 13 27.28 0.2 . 1 . . . . 128 LEU CG . 17959 1 1425 . 1 1 128 128 LEU CD1 C 13 25.64 0.2 . 2 . . . . 128 LEU CD1 . 17959 1 1426 . 1 1 128 128 LEU CD2 C 13 25.31 0.2 . 2 . . . . 128 LEU CD2 . 17959 1 1427 . 1 1 128 128 LEU N N 15 121.99 0.2 . 1 . . . . 128 LEU N . 17959 1 1428 . 1 1 129 129 THR H H 1 7.766 0.02 . 1 . . . . 129 THR H . 17959 1 1429 . 1 1 129 129 THR HA H 1 4.391 0.02 . 1 . . . . 129 THR HA . 17959 1 1430 . 1 1 129 129 THR HB H 1 4.244 0.02 . 1 . . . . 129 THR HB . 17959 1 1431 . 1 1 129 129 THR HG21 H 1 1.179 0.02 . 1 . . . . 129 THR MG . 17959 1 1432 . 1 1 129 129 THR HG22 H 1 1.179 0.02 . 1 . . . . 129 THR MG . 17959 1 1433 . 1 1 129 129 THR HG23 H 1 1.179 0.02 . 1 . . . . 129 THR MG . 17959 1 1434 . 1 1 129 129 THR C C 13 178.47 0.2 . 1 . . . . 129 THR C . 17959 1 1435 . 1 1 129 129 THR CA C 13 62.92 0.2 . 1 . . . . 129 THR CA . 17959 1 1436 . 1 1 129 129 THR CB C 13 71.34 0.2 . 1 . . . . 129 THR CB . 17959 1 1437 . 1 1 129 129 THR CG2 C 13 21.15 0.2 . 1 . . . . 129 THR CG2 . 17959 1 1438 . 1 1 129 129 THR N N 15 117.63 0.2 . 1 . . . . 129 THR N . 17959 1 stop_ save_