data_28014 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 28014 _Entry.Title ; Backbone and sidechain 1H, 13C, and 15N Chemical Shift Assignments of RimP from E. coli ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2019-09-11 _Entry.Accession_date 2019-09-11 _Entry.Last_release_date 2019-09-11 _Entry.Original_release_date 2019-09-11 _Entry.Origination author _Entry.Format_name . _Entry.NMR_STAR_version 3.2.14.0 _Entry.NMR_STAR_dict_location . _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Source_data_format . _Entry.Source_data_format_version . _Entry.Generated_software_name . _Entry.Generated_software_version . _Entry.Generated_software_ID . _Entry.Generated_software_label . _Entry.Generated_date . _Entry.DOI . _Entry.UUID . _Entry.Related_coordinate_file_name . _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.ORCID _Entry_author.Entry_ID 1 Andreas Schedlbauer . . . . 28014 2 Tatsuya Kaminishi . . . . 28014 3 Idoia Iturrioz . . . . 28014 4 Borja 'Ochoa Lizarralde' . . . . 28014 5 David Gil-Carton . . . . 28014 6 Elisa 'de Astigarraga' . . . . 28014 7 Tammo Diercks . . . . 28014 8 Paola Fucini . . . . 28014 9 Sean Connell . . . . 28014 stop_ loop_ _Entry_src.ID _Entry_src.Project_name _Entry_src.Organization_full_name _Entry_src.Organization_initials _Entry_src.Entry_ID 1 . CICbiogune . 28014 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 28014 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 619 28014 '15N chemical shifts' 145 28014 '1H chemical shifts' 991 28014 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 . . 2021-07-28 2019-09-11 update BMRB 'update entry citation' 28014 1 . . 2020-12-14 2019-09-11 original author 'original release' 28014 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 7AFQ 'RimP from E. coli' 28014 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 28014 _Citation.ID 1 _Citation.Name . _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.PubMed_ID 32303998 _Citation.DOI . _Citation.Full_citation . _Citation.Title ; Backbone and sidechain NMR assignments for the ribosome maturation factor RimP from Escherichia coli ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Biomol. NMR Assign.' _Citation.Journal_name_full 'Biomolecular NMR assignments' _Citation.Journal_volume 14 _Citation.Journal_issue 2 _Citation.Journal_ASTM . _Citation.Journal_ISSN 1874-270X _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 189 _Citation.Page_last 193 _Citation.Year 2020 _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.ORCID _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Andreas Schedlbauer A. . . . 28014 1 2 Borja Ochoa-Lizarralde B. . . . 28014 1 3 Idoia Iturrioz I. . . . 28014 1 4 Retina Capuni R. . . . 28014 1 5 Tammo Diercks T. . . . 28014 1 6 Elisa 'de Astigarraga' E. . . . 28014 1 7 Paola Fucini P. . . . 28014 1 8 Sean Connell S. R. . . 28014 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 28014 _Assembly.ID 1 _Assembly.Name RimP _Assembly.BMRB_code . _Assembly.Number_of_components . _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _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 RimP 1 $RimP A . yes native no no . . . 28014 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_RimP _Entity.Sf_category entity _Entity.Sf_framecode RimP _Entity.Entry_ID 28014 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name RimP _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 ; MSTLEQKLTEMITAPVEALG FELVGIEFIRGRTSTLRIYI DSEDGINVDDCADVSHQVSA VLDVEDPITVAYNLEVSSPG LDRPLFTAEHYARFVGEEVT LVLRMAVQNRRKWQGVIKAV DGEMITVTVEGKDEVFALSN IQKANLVPHFA ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 151 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _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 . loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 . MET . 28014 1 2 . SER . 28014 1 3 . THR . 28014 1 4 . LEU . 28014 1 5 . GLU . 28014 1 6 . GLN . 28014 1 7 . LYS . 28014 1 8 . LEU . 28014 1 9 . THR . 28014 1 10 . GLU . 28014 1 11 . MET . 28014 1 12 . ILE . 28014 1 13 . THR . 28014 1 14 . ALA . 28014 1 15 . PRO . 28014 1 16 . VAL . 28014 1 17 . GLU . 28014 1 18 . ALA . 28014 1 19 . LEU . 28014 1 20 . GLY . 28014 1 21 . PHE . 28014 1 22 . GLU . 28014 1 23 . LEU . 28014 1 24 . VAL . 28014 1 25 . GLY . 28014 1 26 . ILE . 28014 1 27 . GLU . 28014 1 28 . PHE . 28014 1 29 . ILE . 28014 1 30 . ARG . 28014 1 31 . GLY . 28014 1 32 . ARG . 28014 1 33 . THR . 28014 1 34 . SER . 28014 1 35 . THR . 28014 1 36 . LEU . 28014 1 37 . ARG . 28014 1 38 . ILE . 28014 1 39 . TYR . 28014 1 40 . ILE . 28014 1 41 . ASP . 28014 1 42 . SER . 28014 1 43 . GLU . 28014 1 44 . ASP . 28014 1 45 . GLY . 28014 1 46 . ILE . 28014 1 47 . ASN . 28014 1 48 . VAL . 28014 1 49 . ASP . 28014 1 50 . ASP . 28014 1 51 . CYS . 28014 1 52 . ALA . 28014 1 53 . ASP . 28014 1 54 . VAL . 28014 1 55 . SER . 28014 1 56 . HIS . 28014 1 57 . GLN . 28014 1 58 . VAL . 28014 1 59 . SER . 28014 1 60 . ALA . 28014 1 61 . VAL . 28014 1 62 . LEU . 28014 1 63 . ASP . 28014 1 64 . VAL . 28014 1 65 . GLU . 28014 1 66 . ASP . 28014 1 67 . PRO . 28014 1 68 . ILE . 28014 1 69 . THR . 28014 1 70 . VAL . 28014 1 71 . ALA . 28014 1 72 . TYR . 28014 1 73 . ASN . 28014 1 74 . LEU . 28014 1 75 . GLU . 28014 1 76 . VAL . 28014 1 77 . SER . 28014 1 78 . SER . 28014 1 79 . PRO . 28014 1 80 . GLY . 28014 1 81 . LEU . 28014 1 82 . ASP . 28014 1 83 . ARG . 28014 1 84 . PRO . 28014 1 85 . LEU . 28014 1 86 . PHE . 28014 1 87 . THR . 28014 1 88 . ALA . 28014 1 89 . GLU . 28014 1 90 . HIS . 28014 1 91 . TYR . 28014 1 92 . ALA . 28014 1 93 . ARG . 28014 1 94 . PHE . 28014 1 95 . VAL . 28014 1 96 . GLY . 28014 1 97 . GLU . 28014 1 98 . GLU . 28014 1 99 . VAL . 28014 1 100 . THR . 28014 1 101 . LEU . 28014 1 102 . VAL . 28014 1 103 . LEU . 28014 1 104 . ARG . 28014 1 105 . MET . 28014 1 106 . ALA . 28014 1 107 . VAL . 28014 1 108 . GLN . 28014 1 109 . ASN . 28014 1 110 . ARG . 28014 1 111 . ARG . 28014 1 112 . LYS . 28014 1 113 . TRP . 28014 1 114 . GLN . 28014 1 115 . GLY . 28014 1 116 . VAL . 28014 1 117 . ILE . 28014 1 118 . LYS . 28014 1 119 . ALA . 28014 1 120 . VAL . 28014 1 121 . ASP . 28014 1 122 . GLY . 28014 1 123 . GLU . 28014 1 124 . MET . 28014 1 125 . ILE . 28014 1 126 . THR . 28014 1 127 . VAL . 28014 1 128 . THR . 28014 1 129 . VAL . 28014 1 130 . GLU . 28014 1 131 . GLY . 28014 1 132 . LYS . 28014 1 133 . ASP . 28014 1 134 . GLU . 28014 1 135 . VAL . 28014 1 136 . PHE . 28014 1 137 . ALA . 28014 1 138 . LEU . 28014 1 139 . SER . 28014 1 140 . ASN . 28014 1 141 . ILE . 28014 1 142 . GLN . 28014 1 143 . LYS . 28014 1 144 . ALA . 28014 1 145 . ASN . 28014 1 146 . LEU . 28014 1 147 . VAL . 28014 1 148 . PRO . 28014 1 149 . HIS . 28014 1 150 . PHE . 28014 1 151 . ALA . 28014 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . MET 1 1 28014 1 . SER 2 2 28014 1 . THR 3 3 28014 1 . LEU 4 4 28014 1 . GLU 5 5 28014 1 . GLN 6 6 28014 1 . LYS 7 7 28014 1 . LEU 8 8 28014 1 . THR 9 9 28014 1 . GLU 10 10 28014 1 . MET 11 11 28014 1 . ILE 12 12 28014 1 . THR 13 13 28014 1 . ALA 14 14 28014 1 . PRO 15 15 28014 1 . VAL 16 16 28014 1 . GLU 17 17 28014 1 . ALA 18 18 28014 1 . LEU 19 19 28014 1 . GLY 20 20 28014 1 . PHE 21 21 28014 1 . GLU 22 22 28014 1 . LEU 23 23 28014 1 . VAL 24 24 28014 1 . GLY 25 25 28014 1 . ILE 26 26 28014 1 . GLU 27 27 28014 1 . PHE 28 28 28014 1 . ILE 29 29 28014 1 . ARG 30 30 28014 1 . GLY 31 31 28014 1 . ARG 32 32 28014 1 . THR 33 33 28014 1 . SER 34 34 28014 1 . THR 35 35 28014 1 . LEU 36 36 28014 1 . ARG 37 37 28014 1 . ILE 38 38 28014 1 . TYR 39 39 28014 1 . ILE 40 40 28014 1 . ASP 41 41 28014 1 . SER 42 42 28014 1 . GLU 43 43 28014 1 . ASP 44 44 28014 1 . GLY 45 45 28014 1 . ILE 46 46 28014 1 . ASN 47 47 28014 1 . VAL 48 48 28014 1 . ASP 49 49 28014 1 . ASP 50 50 28014 1 . CYS 51 51 28014 1 . ALA 52 52 28014 1 . ASP 53 53 28014 1 . VAL 54 54 28014 1 . SER 55 55 28014 1 . HIS 56 56 28014 1 . GLN 57 57 28014 1 . VAL 58 58 28014 1 . SER 59 59 28014 1 . ALA 60 60 28014 1 . VAL 61 61 28014 1 . LEU 62 62 28014 1 . ASP 63 63 28014 1 . VAL 64 64 28014 1 . GLU 65 65 28014 1 . ASP 66 66 28014 1 . PRO 67 67 28014 1 . ILE 68 68 28014 1 . THR 69 69 28014 1 . VAL 70 70 28014 1 . ALA 71 71 28014 1 . TYR 72 72 28014 1 . ASN 73 73 28014 1 . LEU 74 74 28014 1 . GLU 75 75 28014 1 . VAL 76 76 28014 1 . SER 77 77 28014 1 . SER 78 78 28014 1 . PRO 79 79 28014 1 . GLY 80 80 28014 1 . LEU 81 81 28014 1 . ASP 82 82 28014 1 . ARG 83 83 28014 1 . PRO 84 84 28014 1 . LEU 85 85 28014 1 . PHE 86 86 28014 1 . THR 87 87 28014 1 . ALA 88 88 28014 1 . GLU 89 89 28014 1 . HIS 90 90 28014 1 . TYR 91 91 28014 1 . ALA 92 92 28014 1 . ARG 93 93 28014 1 . PHE 94 94 28014 1 . VAL 95 95 28014 1 . GLY 96 96 28014 1 . GLU 97 97 28014 1 . GLU 98 98 28014 1 . VAL 99 99 28014 1 . THR 100 100 28014 1 . LEU 101 101 28014 1 . VAL 102 102 28014 1 . LEU 103 103 28014 1 . ARG 104 104 28014 1 . MET 105 105 28014 1 . ALA 106 106 28014 1 . VAL 107 107 28014 1 . GLN 108 108 28014 1 . ASN 109 109 28014 1 . ARG 110 110 28014 1 . ARG 111 111 28014 1 . LYS 112 112 28014 1 . TRP 113 113 28014 1 . GLN 114 114 28014 1 . GLY 115 115 28014 1 . VAL 116 116 28014 1 . ILE 117 117 28014 1 . LYS 118 118 28014 1 . ALA 119 119 28014 1 . VAL 120 120 28014 1 . ASP 121 121 28014 1 . GLY 122 122 28014 1 . GLU 123 123 28014 1 . MET 124 124 28014 1 . ILE 125 125 28014 1 . THR 126 126 28014 1 . VAL 127 127 28014 1 . THR 128 128 28014 1 . VAL 129 129 28014 1 . GLU 130 130 28014 1 . GLY 131 131 28014 1 . LYS 132 132 28014 1 . ASP 133 133 28014 1 . GLU 134 134 28014 1 . VAL 135 135 28014 1 . PHE 136 136 28014 1 . ALA 137 137 28014 1 . LEU 138 138 28014 1 . SER 139 139 28014 1 . ASN 140 140 28014 1 . ILE 141 141 28014 1 . GLN 142 142 28014 1 . LYS 143 143 28014 1 . ALA 144 144 28014 1 . ASN 145 145 28014 1 . LEU 146 146 28014 1 . VAL 147 147 28014 1 . PRO 148 148 28014 1 . HIS 149 149 28014 1 . PHE 150 150 28014 1 . ALA 151 151 28014 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 28014 _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.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.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Details _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $RimP . 562 organism . 'Escherichia coli' 'E. coli' . . Bacteria . Escherichia coli . . . . . . . . . . . . . 28014 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 28014 _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_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.Details _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $RimP . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . . . . p7XNH3 . . . 28014 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 28014 _Sample.ID 1 _Sample.Name . _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 RimP '[U-98% 13C; U-98% 15N]' . . 1 $RimP . . 600 . . uM . . . . 28014 1 2 HEPES 'natural abundance' . . . . . . 10 . . mM . . . . 28014 1 3 MgCl2 'natural abundance' . . . . . . 6 . . mM . . . . 28014 1 4 NH4Cl 'natural abundance' . . . . . . 30 . . mM . . . . 28014 1 5 TCEP 'natural abundance' . . . . . . 75 . . uM . . . . 28014 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 28014 _Sample_condition_list.ID 1 _Sample_condition_list.Name . _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID pH 7.6 . pH 28014 1 pressure 1 . atm 28014 1 temperature 298 . K 28014 1 stop_ save_ ############################ # Computer software used # ############################ save_NMRPipe _Software.Sf_category software _Software.Sf_framecode NMRPipe _Software.Entry_ID 28014 _Software.ID 1 _Software.Type . _Software.Name NMRPipe _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . 28014 1 stop_ loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID processing . 28014 1 stop_ save_ save_ccpnmr _Software.Sf_category software _Software.Sf_framecode ccpnmr _Software.Entry_ID 28014 _Software.ID 2 _Software.Type . _Software.Name ccpnmr _Software.Version 2.4 _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID CCPN . . 28014 2 stop_ loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' . 28014 2 stop_ save_ save_X-PLOR_NIH _Software.Sf_category software _Software.Sf_framecode X-PLOR_NIH _Software.Entry_ID 28014 _Software.ID 3 _Software.Type . _Software.Name X-PLOR_NIH _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Schwieters, Kuszewski, Tjandra and Clore' . . 28014 3 stop_ loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID 'structure solution' . 28014 3 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_1 _NMR_spectrometer.Entry_ID 28014 _NMR_spectrometer.ID 1 _NMR_spectrometer.Name . _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_2 _NMR_spectrometer.Entry_ID 28014 _NMR_spectrometer.ID 2 _NMR_spectrometer.Name . _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 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 28014 _NMR_spectrometer_list.ID 1 _NMR_spectrometer_list.Name . loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 Bruker Avance . 600 . . . 28014 1 2 spectrometer_2 Bruker Avance . 800 . . . 28014 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 28014 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NUS_flag _Experiment.Interleaved_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.Details _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 15N TROSY' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . . 28014 1 2 '3D HNCO' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . . 28014 1 3 '3D HNCA' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . . 28014 1 4 '3D HNCACB' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . . 28014 1 5 '3D CBCA(CO)NH' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . . 28014 1 6 '3D HN(CO)CA' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . . 28014 1 7 '3D HN(CA)CO' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . . 28014 1 8 '3D HCCH-TOCSY' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . . 28014 1 9 '3D CNH NOESY' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . . 28014 1 10 '3D HNH NOESY' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . . 28014 1 11 '3D HCH NOESY' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . . 28014 1 12 '3D HNCAHA' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . . 28014 1 13 '3D HN(CO)CAHA' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . . 28014 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 28014 _Chem_shift_reference.ID 1 _Chem_shift_reference.Name . _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.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.251449530 . . . . . 28014 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . 28014 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.101329118 . . . . . 28014 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 28014 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name . _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 15N TROSY' . . . 28014 1 2 '3D HNCO' . . . 28014 1 3 '3D HNCA' . . . 28014 1 4 '3D HNCACB' . . . 28014 1 5 '3D CBCA(CO)NH' . . . 28014 1 6 '3D HN(CO)CA' . . . 28014 1 7 '3D HN(CA)CO' . . . 28014 1 8 '3D HCCH-TOCSY' . . . 28014 1 9 '3D CNH NOESY' . . . 28014 1 10 '3D HNH NOESY' . . . 28014 1 11 '3D HCH NOESY' . . . 28014 1 12 '3D HNCAHA' . . . 28014 1 13 '3D HN(CO)CAHA' . . . 28014 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_assembly_asym_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.Ambiguity_set_ID _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 4 4 LEU HA H 1 3.956 0.004 . 1 . . . . . 4 LEU HA . 28014 1 2 . 1 . 1 4 4 LEU HB2 H 1 1.524 0.002 . 2 . . . . . 4 LEU HB2 . 28014 1 3 . 1 . 1 4 4 LEU HB3 H 1 1.477 0.006 . 2 . . . . . 4 LEU HB3 . 28014 1 4 . 1 . 1 4 4 LEU HG H 1 1.081 0.003 . 1 . . . . . 4 LEU HG . 28014 1 5 . 1 . 1 4 4 LEU HD11 H 1 0.312 0.005 . 2 . . . . . 4 LEU HD11 . 28014 1 6 . 1 . 1 4 4 LEU HD12 H 1 0.312 0.005 . 2 . . . . . 4 LEU HD12 . 28014 1 7 . 1 . 1 4 4 LEU HD13 H 1 0.312 0.005 . 2 . . . . . 4 LEU HD13 . 28014 1 8 . 1 . 1 4 4 LEU HD21 H 1 0.558 0.003 . 2 . . . . . 4 LEU HD21 . 28014 1 9 . 1 . 1 4 4 LEU HD22 H 1 0.558 0.003 . 2 . . . . . 4 LEU HD22 . 28014 1 10 . 1 . 1 4 4 LEU HD23 H 1 0.558 0.003 . 2 . . . . . 4 LEU HD23 . 28014 1 11 . 1 . 1 4 4 LEU C C 13 178.322 0.000 . 1 . . . . . 4 LEU C . 28014 1 12 . 1 . 1 4 4 LEU CA C 13 58.162 0.042 . 1 . . . . . 4 LEU CA . 28014 1 13 . 1 . 1 4 4 LEU CB C 13 41.456 0.041 . 1 . . . . . 4 LEU CB . 28014 1 14 . 1 . 1 4 4 LEU CG C 13 27.051 0.119 . 1 . . . . . 4 LEU CG . 28014 1 15 . 1 . 1 4 4 LEU CD1 C 13 25.215 0.092 . 2 . . . . . 4 LEU CD1 . 28014 1 16 . 1 . 1 4 4 LEU CD2 C 13 22.764 0.025 . 2 . . . . . 4 LEU CD2 . 28014 1 17 . 1 . 1 5 5 GLU H H 1 9.124 0.005 . 1 . . . . . 5 GLU H . 28014 1 18 . 1 . 1 5 5 GLU HA H 1 3.566 0.007 . 1 . . . . . 5 GLU HA . 28014 1 19 . 1 . 1 5 5 GLU HB2 H 1 2.106 0.011 . 2 . . . . . 5 GLU HB2 . 28014 1 20 . 1 . 1 5 5 GLU HB3 H 1 1.902 0.006 . 2 . . . . . 5 GLU HB3 . 28014 1 21 . 1 . 1 5 5 GLU HG2 H 1 2.446 0.004 . 2 . . . . . 5 GLU HG2 . 28014 1 22 . 1 . 1 5 5 GLU HG3 H 1 2.050 0.003 . 2 . . . . . 5 GLU HG3 . 28014 1 23 . 1 . 1 5 5 GLU C C 13 179.705 0.002 . 1 . . . . . 5 GLU C . 28014 1 24 . 1 . 1 5 5 GLU CA C 13 61.508 0.060 . 1 . . . . . 5 GLU CA . 28014 1 25 . 1 . 1 5 5 GLU CB C 13 28.694 0.045 . 1 . . . . . 5 GLU CB . 28014 1 26 . 1 . 1 5 5 GLU CG C 13 38.199 0.047 . 1 . . . . . 5 GLU CG . 28014 1 27 . 1 . 1 5 5 GLU N N 15 117.704 0.072 . 1 . . . . . 5 GLU N . 28014 1 28 . 1 . 1 6 6 GLN H H 1 8.184 0.011 . 1 . . . . . 6 GLN H . 28014 1 29 . 1 . 1 6 6 GLN HA H 1 3.950 0.014 . 1 . . . . . 6 GLN HA . 28014 1 30 . 1 . 1 6 6 GLN HB2 H 1 2.156 0.010 . 2 . . . . . 6 GLN HB2 . 28014 1 31 . 1 . 1 6 6 GLN HB3 H 1 2.030 0.007 . 2 . . . . . 6 GLN HB3 . 28014 1 32 . 1 . 1 6 6 GLN HG2 H 1 2.356 0.003 . 2 . . . . . 6 GLN HG2 . 28014 1 33 . 1 . 1 6 6 GLN HG3 H 1 2.350 0.002 . 2 . . . . . 6 GLN HG3 . 28014 1 34 . 1 . 1 6 6 GLN HE21 H 1 7.550 0.003 . 1 . . . . . 6 GLN HE21 . 28014 1 35 . 1 . 1 6 6 GLN HE22 H 1 6.816 0.042 . 1 . . . . . 6 GLN HE22 . 28014 1 36 . 1 . 1 6 6 GLN C C 13 178.321 0.011 . 1 . . . . . 6 GLN C . 28014 1 37 . 1 . 1 6 6 GLN CA C 13 59.232 0.107 . 1 . . . . . 6 GLN CA . 28014 1 38 . 1 . 1 6 6 GLN CB C 13 28.364 0.084 . 1 . . . . . 6 GLN CB . 28014 1 39 . 1 . 1 6 6 GLN CG C 13 33.894 0.028 . 1 . . . . . 6 GLN CG . 28014 1 40 . 1 . 1 6 6 GLN CD C 13 180.071 0.000 . 1 . . . . . 6 GLN CD . 28014 1 41 . 1 . 1 6 6 GLN N N 15 121.763 0.055 . 1 . . . . . 6 GLN N . 28014 1 42 . 1 . 1 6 6 GLN NE2 N 15 112.080 0.025 . 1 . . . . . 6 GLN NE2 . 28014 1 43 . 1 . 1 7 7 LYS H H 1 8.005 0.005 . 1 . . . . . 7 LYS H . 28014 1 44 . 1 . 1 7 7 LYS HA H 1 3.978 0.004 . 1 . . . . . 7 LYS HA . 28014 1 45 . 1 . 1 7 7 LYS HB2 H 1 1.829 0.002 . 2 . . . . . 7 LYS HB2 . 28014 1 46 . 1 . 1 7 7 LYS HB3 H 1 1.830 0.004 . 2 . . . . . 7 LYS HB3 . 28014 1 47 . 1 . 1 7 7 LYS HG2 H 1 1.373 0.006 . 2 . . . . . 7 LYS HG2 . 28014 1 48 . 1 . 1 7 7 LYS HG3 H 1 1.299 0.005 . 2 . . . . . 7 LYS HG3 . 28014 1 49 . 1 . 1 7 7 LYS HD2 H 1 1.558 0.017 . 2 . . . . . 7 LYS HD2 . 28014 1 50 . 1 . 1 7 7 LYS HD3 H 1 1.566 0.000 . 2 . . . . . 7 LYS HD3 . 28014 1 51 . 1 . 1 7 7 LYS HE2 H 1 2.804 0.003 . 2 . . . . . 7 LYS HE2 . 28014 1 52 . 1 . 1 7 7 LYS HE3 H 1 2.804 0.000 . 2 . . . . . 7 LYS HE3 . 28014 1 53 . 1 . 1 7 7 LYS C C 13 179.415 0.000 . 1 . . . . . 7 LYS C . 28014 1 54 . 1 . 1 7 7 LYS CA C 13 59.055 0.057 . 1 . . . . . 7 LYS CA . 28014 1 55 . 1 . 1 7 7 LYS CB C 13 32.002 0.041 . 1 . . . . . 7 LYS CB . 28014 1 56 . 1 . 1 7 7 LYS CG C 13 24.744 0.062 . 1 . . . . . 7 LYS CG . 28014 1 57 . 1 . 1 7 7 LYS CD C 13 29.073 0.052 . 1 . . . . . 7 LYS CD . 28014 1 58 . 1 . 1 7 7 LYS CE C 13 41.982 0.061 . 1 . . . . . 7 LYS CE . 28014 1 59 . 1 . 1 7 7 LYS N N 15 121.621 0.045 . 1 . . . . . 7 LYS N . 28014 1 60 . 1 . 1 8 8 LEU H H 1 8.592 0.004 . 1 . . . . . 8 LEU H . 28014 1 61 . 1 . 1 8 8 LEU HA H 1 3.861 0.003 . 1 . . . . . 8 LEU HA . 28014 1 62 . 1 . 1 8 8 LEU HB2 H 1 1.792 0.000 . 2 . . . . . 8 LEU HB2 . 28014 1 63 . 1 . 1 8 8 LEU HB3 H 1 1.017 0.008 . 2 . . . . . 8 LEU HB3 . 28014 1 64 . 1 . 1 8 8 LEU HG H 1 0.440 0.003 . 1 . . . . . 8 LEU HG . 28014 1 65 . 1 . 1 8 8 LEU HD11 H 1 0.570 0.022 . 1 . . . . . 8 LEU HD11 . 28014 1 66 . 1 . 1 8 8 LEU HD12 H 1 0.570 0.022 . 1 . . . . . 8 LEU HD12 . 28014 1 67 . 1 . 1 8 8 LEU HD13 H 1 0.570 0.022 . 1 . . . . . 8 LEU HD13 . 28014 1 68 . 1 . 1 8 8 LEU C C 13 178.565 0.006 . 1 . . . . . 8 LEU C . 28014 1 69 . 1 . 1 8 8 LEU CA C 13 57.610 0.057 . 1 . . . . . 8 LEU CA . 28014 1 70 . 1 . 1 8 8 LEU CB C 13 42.400 0.067 . 1 . . . . . 8 LEU CB . 28014 1 71 . 1 . 1 8 8 LEU CG C 13 26.123 0.057 . 1 . . . . . 8 LEU CG . 28014 1 72 . 1 . 1 8 8 LEU CD1 C 13 22.853 0.039 . 1 . . . . . 8 LEU CD1 . 28014 1 73 . 1 . 1 8 8 LEU N N 15 117.886 0.080 . 1 . . . . . 8 LEU N . 28014 1 74 . 1 . 1 9 9 THR H H 1 8.119 0.003 . 1 . . . . . 9 THR H . 28014 1 75 . 1 . 1 9 9 THR HA H 1 3.442 0.002 . 1 . . . . . 9 THR HA . 28014 1 76 . 1 . 1 9 9 THR HB H 1 4.265 0.004 . 1 . . . . . 9 THR HB . 28014 1 77 . 1 . 1 9 9 THR HG21 H 1 1.008 0.006 . 1 . . . . . 9 THR HG21 . 28014 1 78 . 1 . 1 9 9 THR HG22 H 1 1.008 0.006 . 1 . . . . . 9 THR HG22 . 28014 1 79 . 1 . 1 9 9 THR HG23 H 1 1.008 0.006 . 1 . . . . . 9 THR HG23 . 28014 1 80 . 1 . 1 9 9 THR C C 13 176.873 0.000 . 1 . . . . . 9 THR C . 28014 1 81 . 1 . 1 9 9 THR CA C 13 68.237 0.032 . 1 . . . . . 9 THR CA . 28014 1 82 . 1 . 1 9 9 THR CB C 13 68.314 0.054 . 1 . . . . . 9 THR CB . 28014 1 83 . 1 . 1 9 9 THR CG2 C 13 20.912 0.028 . 1 . . . . . 9 THR CG2 . 28014 1 84 . 1 . 1 9 9 THR N N 15 116.608 0.062 . 1 . . . . . 9 THR N . 28014 1 85 . 1 . 1 10 10 GLU H H 1 7.847 0.003 . 1 . . . . . 10 GLU H . 28014 1 86 . 1 . 1 10 10 GLU HA H 1 3.976 0.006 . 1 . . . . . 10 GLU HA . 28014 1 87 . 1 . 1 10 10 GLU HB2 H 1 2.063 0.005 . 2 . . . . . 10 GLU HB2 . 28014 1 88 . 1 . 1 10 10 GLU HB3 H 1 2.359 0.000 . 2 . . . . . 10 GLU HB3 . 28014 1 89 . 1 . 1 10 10 GLU HG2 H 1 2.359 0.000 . 1 . . . . . 10 GLU HG2 . 28014 1 90 . 1 . 1 10 10 GLU HG3 H 1 2.361 0.003 . 1 . . . . . 10 GLU HG3 . 28014 1 91 . 1 . 1 10 10 GLU C C 13 178.500 0.004 . 1 . . . . . 10 GLU C . 28014 1 92 . 1 . 1 10 10 GLU CA C 13 59.475 0.033 . 1 . . . . . 10 GLU CA . 28014 1 93 . 1 . 1 10 10 GLU CB C 13 29.396 0.052 . 1 . . . . . 10 GLU CB . 28014 1 94 . 1 . 1 10 10 GLU CG C 13 36.187 0.043 . 1 . . . . . 10 GLU CG . 28014 1 95 . 1 . 1 10 10 GLU N N 15 122.636 0.067 . 1 . . . . . 10 GLU N . 28014 1 96 . 1 . 1 11 11 MET H H 1 7.745 0.004 . 1 . . . . . 11 MET H . 28014 1 97 . 1 . 1 11 11 MET HA H 1 4.148 0.007 . 1 . . . . . 11 MET HA . 28014 1 98 . 1 . 1 11 11 MET HB2 H 1 2.075 0.003 . 2 . . . . . 11 MET HB2 . 28014 1 99 . 1 . 1 11 11 MET HB3 H 1 1.986 0.014 . 2 . . . . . 11 MET HB3 . 28014 1 100 . 1 . 1 11 11 MET HG2 H 1 2.612 0.006 . 2 . . . . . 11 MET HG2 . 28014 1 101 . 1 . 1 11 11 MET HG3 H 1 2.475 0.003 . 2 . . . . . 11 MET HG3 . 28014 1 102 . 1 . 1 11 11 MET HE1 H 1 1.929 0.005 . 1 . . . . . 11 MET HE1 . 28014 1 103 . 1 . 1 11 11 MET HE2 H 1 1.929 0.005 . 1 . . . . . 11 MET HE2 . 28014 1 104 . 1 . 1 11 11 MET HE3 H 1 1.929 0.005 . 1 . . . . . 11 MET HE3 . 28014 1 105 . 1 . 1 11 11 MET C C 13 177.526 0.012 . 1 . . . . . 11 MET C . 28014 1 106 . 1 . 1 11 11 MET CA C 13 58.382 0.044 . 1 . . . . . 11 MET CA . 28014 1 107 . 1 . 1 11 11 MET CB C 13 34.626 0.038 . 1 . . . . . 11 MET CB . 28014 1 108 . 1 . 1 11 11 MET CG C 13 31.587 0.044 . 1 . . . . . 11 MET CG . 28014 1 109 . 1 . 1 11 11 MET CE C 13 16.911 0.025 . 1 . . . . . 11 MET CE . 28014 1 110 . 1 . 1 11 11 MET N N 15 116.892 0.075 . 1 . . . . . 11 MET N . 28014 1 111 . 1 . 1 12 12 ILE H H 1 8.012 0.004 . 1 . . . . . 12 ILE H . 28014 1 112 . 1 . 1 12 12 ILE HA H 1 3.917 0.013 . 1 . . . . . 12 ILE HA . 28014 1 113 . 1 . 1 12 12 ILE HB H 1 1.825 0.006 . 1 . . . . . 12 ILE HB . 28014 1 114 . 1 . 1 12 12 ILE HG12 H 1 1.566 0.004 . 2 . . . . . 12 ILE HG12 . 28014 1 115 . 1 . 1 12 12 ILE HG13 H 1 1.027 0.000 . 2 . . . . . 12 ILE HG13 . 28014 1 116 . 1 . 1 12 12 ILE HG21 H 1 0.818 0.003 . 1 . . . . . 12 ILE HG21 . 28014 1 117 . 1 . 1 12 12 ILE HG22 H 1 0.818 0.003 . 1 . . . . . 12 ILE HG22 . 28014 1 118 . 1 . 1 12 12 ILE HG23 H 1 0.818 0.003 . 1 . . . . . 12 ILE HG23 . 28014 1 119 . 1 . 1 12 12 ILE HD11 H 1 0.676 0.004 . 1 . . . . . 12 ILE HD11 . 28014 1 120 . 1 . 1 12 12 ILE HD12 H 1 0.676 0.004 . 1 . . . . . 12 ILE HD12 . 28014 1 121 . 1 . 1 12 12 ILE HD13 H 1 0.676 0.004 . 1 . . . . . 12 ILE HD13 . 28014 1 122 . 1 . 1 12 12 ILE C C 13 175.493 0.016 . 1 . . . . . 12 ILE C . 28014 1 123 . 1 . 1 12 12 ILE CA C 13 62.471 0.124 . 1 . . . . . 12 ILE CA . 28014 1 124 . 1 . 1 12 12 ILE CB C 13 38.851 0.067 . 1 . . . . . 12 ILE CB . 28014 1 125 . 1 . 1 12 12 ILE CG1 C 13 29.228 0.111 . 1 . . . . . 12 ILE CG1 . 28014 1 126 . 1 . 1 12 12 ILE CG2 C 13 18.438 0.068 . 1 . . . . . 12 ILE CG2 . 28014 1 127 . 1 . 1 12 12 ILE CD1 C 13 14.825 0.023 . 1 . . . . . 12 ILE CD1 . 28014 1 128 . 1 . 1 12 12 ILE N N 15 114.015 0.094 . 1 . . . . . 12 ILE N . 28014 1 129 . 1 . 1 13 13 THR H H 1 7.626 0.004 . 1 . . . . . 13 THR H . 28014 1 130 . 1 . 1 13 13 THR HA H 1 3.627 0.002 . 1 . . . . . 13 THR HA . 28014 1 131 . 1 . 1 13 13 THR HB H 1 4.112 0.001 . 1 . . . . . 13 THR HB . 28014 1 132 . 1 . 1 13 13 THR HG21 H 1 1.089 0.005 . 1 . . . . . 13 THR HG21 . 28014 1 133 . 1 . 1 13 13 THR HG22 H 1 1.089 0.005 . 1 . . . . . 13 THR HG22 . 28014 1 134 . 1 . 1 13 13 THR HG23 H 1 1.089 0.005 . 1 . . . . . 13 THR HG23 . 28014 1 135 . 1 . 1 13 13 THR C C 13 174.614 0.000 . 1 . . . . . 13 THR C . 28014 1 136 . 1 . 1 13 13 THR CA C 13 69.071 0.020 . 1 . . . . . 13 THR CA . 28014 1 137 . 1 . 1 13 13 THR CB C 13 69.071 0.040 . 1 . . . . . 13 THR CB . 28014 1 138 . 1 . 1 13 13 THR CG2 C 13 20.799 0.069 . 1 . . . . . 13 THR CG2 . 28014 1 139 . 1 . 1 13 13 THR N N 15 117.700 0.036 . 1 . . . . . 13 THR N . 28014 1 140 . 1 . 1 14 14 ALA H H 1 8.011 0.005 . 1 . . . . . 14 ALA H . 28014 1 141 . 1 . 1 14 14 ALA HA H 1 4.328 0.002 . 1 . . . . . 14 ALA HA . 28014 1 142 . 1 . 1 14 14 ALA HB1 H 1 1.402 0.003 . 1 . . . . . 14 ALA HB1 . 28014 1 143 . 1 . 1 14 14 ALA HB2 H 1 1.402 0.003 . 1 . . . . . 14 ALA HB2 . 28014 1 144 . 1 . 1 14 14 ALA HB3 H 1 1.402 0.003 . 1 . . . . . 14 ALA HB3 . 28014 1 145 . 1 . 1 14 14 ALA C C 13 177.822 0.000 . 1 . . . . . 14 ALA C . 28014 1 146 . 1 . 1 14 14 ALA CA C 13 56.733 0.058 . 1 . . . . . 14 ALA CA . 28014 1 147 . 1 . 1 14 14 ALA CB C 13 15.225 0.048 . 1 . . . . . 14 ALA CB . 28014 1 148 . 1 . 1 14 14 ALA N N 15 120.167 0.062 . 1 . . . . . 14 ALA N . 28014 1 149 . 1 . 1 15 15 PRO HA H 1 4.318 0.003 . 1 . . . . . 15 PRO HA . 28014 1 150 . 1 . 1 15 15 PRO HB2 H 1 2.227 0.016 . 2 . . . . . 15 PRO HB2 . 28014 1 151 . 1 . 1 15 15 PRO HB3 H 1 1.529 0.001 . 2 . . . . . 15 PRO HB3 . 28014 1 152 . 1 . 1 15 15 PRO HG2 H 1 2.242 0.000 . 2 . . . . . 15 PRO HG2 . 28014 1 153 . 1 . 1 15 15 PRO HG3 H 1 1.910 0.006 . 2 . . . . . 15 PRO HG3 . 28014 1 154 . 1 . 1 15 15 PRO HD2 H 1 3.858 0.012 . 2 . . . . . 15 PRO HD2 . 28014 1 155 . 1 . 1 15 15 PRO HD3 H 1 3.455 0.004 . 2 . . . . . 15 PRO HD3 . 28014 1 156 . 1 . 1 15 15 PRO C C 13 178.496 0.000 . 1 . . . . . 15 PRO C . 28014 1 157 . 1 . 1 15 15 PRO CA C 13 65.473 0.042 . 1 . . . . . 15 PRO CA . 28014 1 158 . 1 . 1 15 15 PRO CB C 13 30.818 0.072 . 1 . . . . . 15 PRO CB . 28014 1 159 . 1 . 1 15 15 PRO CG C 13 27.960 0.064 . 1 . . . . . 15 PRO CG . 28014 1 160 . 1 . 1 15 15 PRO CD C 13 49.786 0.057 . 1 . . . . . 15 PRO CD . 28014 1 161 . 1 . 1 16 16 VAL H H 1 7.159 0.004 . 1 . . . . . 16 VAL H . 28014 1 162 . 1 . 1 16 16 VAL HA H 1 3.535 0.004 . 1 . . . . . 16 VAL HA . 28014 1 163 . 1 . 1 16 16 VAL HB H 1 2.182 0.001 . 1 . . . . . 16 VAL HB . 28014 1 164 . 1 . 1 16 16 VAL HG11 H 1 0.893 0.003 . 2 . . . . . 16 VAL HG11 . 28014 1 165 . 1 . 1 16 16 VAL HG12 H 1 0.893 0.003 . 2 . . . . . 16 VAL HG12 . 28014 1 166 . 1 . 1 16 16 VAL HG13 H 1 0.893 0.003 . 2 . . . . . 16 VAL HG13 . 28014 1 167 . 1 . 1 16 16 VAL HG21 H 1 0.787 0.007 . 2 . . . . . 16 VAL HG21 . 28014 1 168 . 1 . 1 16 16 VAL HG22 H 1 0.787 0.007 . 2 . . . . . 16 VAL HG22 . 28014 1 169 . 1 . 1 16 16 VAL HG23 H 1 0.787 0.007 . 2 . . . . . 16 VAL HG23 . 28014 1 170 . 1 . 1 16 16 VAL C C 13 177.872 0.000 . 1 . . . . . 16 VAL C . 28014 1 171 . 1 . 1 16 16 VAL CA C 13 67.735 0.052 . 1 . . . . . 16 VAL CA . 28014 1 172 . 1 . 1 16 16 VAL CB C 13 32.101 0.112 . 1 . . . . . 16 VAL CB . 28014 1 173 . 1 . 1 16 16 VAL CG1 C 13 24.383 0.048 . 2 . . . . . 16 VAL CG1 . 28014 1 174 . 1 . 1 16 16 VAL CG2 C 13 22.941 0.035 . 2 . . . . . 16 VAL CG2 . 28014 1 175 . 1 . 1 16 16 VAL N N 15 116.203 0.072 . 1 . . . . . 16 VAL N . 28014 1 176 . 1 . 1 17 17 GLU H H 1 8.564 0.004 . 1 . . . . . 17 GLU H . 28014 1 177 . 1 . 1 17 17 GLU HA H 1 4.591 0.006 . 1 . . . . . 17 GLU HA . 28014 1 178 . 1 . 1 17 17 GLU HB2 H 1 1.863 0.037 . 2 . . . . . 17 GLU HB2 . 28014 1 179 . 1 . 1 17 17 GLU HB3 H 1 2.663 0.000 . 2 . . . . . 17 GLU HB3 . 28014 1 180 . 1 . 1 17 17 GLU HG2 H 1 2.670 0.010 . 2 . . . . . 17 GLU HG2 . 28014 1 181 . 1 . 1 17 17 GLU HG3 H 1 2.371 0.000 . 2 . . . . . 17 GLU HG3 . 28014 1 182 . 1 . 1 17 17 GLU C C 13 181.957 0.000 . 1 . . . . . 17 GLU C . 28014 1 183 . 1 . 1 17 17 GLU CA C 13 58.936 0.041 . 1 . . . . . 17 GLU CA . 28014 1 184 . 1 . 1 17 17 GLU CB C 13 28.871 0.093 . 1 . . . . . 17 GLU CB . 28014 1 185 . 1 . 1 17 17 GLU CG C 13 37.066 0.057 . 1 . . . . . 17 GLU CG . 28014 1 186 . 1 . 1 17 17 GLU N N 15 118.826 0.046 . 1 . . . . . 17 GLU N . 28014 1 187 . 1 . 1 18 18 ALA H H 1 8.460 0.011 . 1 . . . . . 18 ALA H . 28014 1 188 . 1 . 1 18 18 ALA HA H 1 4.077 0.007 . 1 . . . . . 18 ALA HA . 28014 1 189 . 1 . 1 18 18 ALA HB1 H 1 1.406 0.004 . 1 . . . . . 18 ALA HB1 . 28014 1 190 . 1 . 1 18 18 ALA HB2 H 1 1.406 0.004 . 1 . . . . . 18 ALA HB2 . 28014 1 191 . 1 . 1 18 18 ALA HB3 H 1 1.406 0.004 . 1 . . . . . 18 ALA HB3 . 28014 1 192 . 1 . 1 18 18 ALA C C 13 179.420 0.000 . 1 . . . . . 18 ALA C . 28014 1 193 . 1 . 1 18 18 ALA CA C 13 54.526 0.075 . 1 . . . . . 18 ALA CA . 28014 1 194 . 1 . 1 18 18 ALA CB C 13 17.872 0.042 . 1 . . . . . 18 ALA CB . 28014 1 195 . 1 . 1 18 18 ALA N N 15 123.255 0.096 . 1 . . . . . 18 ALA N . 28014 1 196 . 1 . 1 19 19 LEU H H 1 7.092 0.014 . 1 . . . . . 19 LEU H . 28014 1 197 . 1 . 1 19 19 LEU HA H 1 4.164 0.007 . 1 . . . . . 19 LEU HA . 28014 1 198 . 1 . 1 19 19 LEU HB2 H 1 1.930 0.005 . 2 . . . . . 19 LEU HB2 . 28014 1 199 . 1 . 1 19 19 LEU HB3 H 1 1.683 0.013 . 2 . . . . . 19 LEU HB3 . 28014 1 200 . 1 . 1 19 19 LEU HG H 1 0.895 0.002 . 1 . . . . . 19 LEU HG . 28014 1 201 . 1 . 1 19 19 LEU HD11 H 1 0.850 0.018 . 1 . . . . . 19 LEU HD11 . 28014 1 202 . 1 . 1 19 19 LEU HD12 H 1 0.850 0.018 . 1 . . . . . 19 LEU HD12 . 28014 1 203 . 1 . 1 19 19 LEU HD13 H 1 0.850 0.018 . 1 . . . . . 19 LEU HD13 . 28014 1 204 . 1 . 1 19 19 LEU C C 13 176.197 0.000 . 1 . . . . . 19 LEU C . 28014 1 205 . 1 . 1 19 19 LEU CA C 13 54.703 0.049 . 1 . . . . . 19 LEU CA . 28014 1 206 . 1 . 1 19 19 LEU CB C 13 42.914 0.046 . 1 . . . . . 19 LEU CB . 28014 1 207 . 1 . 1 19 19 LEU CG C 13 26.436 0.033 . 1 . . . . . 19 LEU CG . 28014 1 208 . 1 . 1 19 19 LEU CD1 C 13 22.723 0.062 . 1 . . . . . 19 LEU CD1 . 28014 1 209 . 1 . 1 19 19 LEU N N 15 116.569 0.075 . 1 . . . . . 19 LEU N . 28014 1 210 . 1 . 1 20 20 GLY H H 1 7.785 0.004 . 1 . . . . . 20 GLY H . 28014 1 211 . 1 . 1 20 20 GLY HA2 H 1 3.815 0.010 . 2 . . . . . 20 GLY HA2 . 28014 1 212 . 1 . 1 20 20 GLY HA3 H 1 3.499 0.008 . 2 . . . . . 20 GLY HA3 . 28014 1 213 . 1 . 1 20 20 GLY C C 13 173.720 0.019 . 1 . . . . . 20 GLY C . 28014 1 214 . 1 . 1 20 20 GLY CA C 13 44.692 0.024 . 1 . . . . . 20 GLY CA . 28014 1 215 . 1 . 1 20 20 GLY N N 15 105.107 0.030 . 1 . . . . . 20 GLY N . 28014 1 216 . 1 . 1 21 21 PHE H H 1 6.980 0.005 . 1 . . . . . 21 PHE H . 28014 1 217 . 1 . 1 21 21 PHE HA H 1 4.953 0.005 . 1 . . . . . 21 PHE HA . 28014 1 218 . 1 . 1 21 21 PHE HB2 H 1 2.749 0.000 . 2 . . . . . 21 PHE HB2 . 28014 1 219 . 1 . 1 21 21 PHE HB3 H 1 2.609 0.000 . 2 . . . . . 21 PHE HB3 . 28014 1 220 . 1 . 1 21 21 PHE HD1 H 1 6.890 0.039 . 1 . . . . . 21 PHE HD1 . 28014 1 221 . 1 . 1 21 21 PHE HD2 H 1 6.890 0.039 . 1 . . . . . 21 PHE HD2 . 28014 1 222 . 1 . 1 21 21 PHE C C 13 173.871 0.018 . 1 . . . . . 21 PHE C . 28014 1 223 . 1 . 1 21 21 PHE CA C 13 55.868 0.034 . 1 . . . . . 21 PHE CA . 28014 1 224 . 1 . 1 21 21 PHE CB C 13 41.250 0.134 . 1 . . . . . 21 PHE CB . 28014 1 225 . 1 . 1 21 21 PHE N N 15 118.124 0.088 . 1 . . . . . 21 PHE N . 28014 1 226 . 1 . 1 22 22 GLU H H 1 8.706 0.003 . 1 . . . . . 22 GLU H . 28014 1 227 . 1 . 1 22 22 GLU HA H 1 4.495 0.006 . 1 . . . . . 22 GLU HA . 28014 1 228 . 1 . 1 22 22 GLU HB2 H 1 1.785 0.000 . 2 . . . . . 22 GLU HB2 . 28014 1 229 . 1 . 1 22 22 GLU HB3 H 1 1.778 0.000 . 2 . . . . . 22 GLU HB3 . 28014 1 230 . 1 . 1 22 22 GLU HG2 H 1 1.775 0.001 . 2 . . . . . 22 GLU HG2 . 28014 1 231 . 1 . 1 22 22 GLU HG3 H 1 1.767 0.000 . 2 . . . . . 22 GLU HG3 . 28014 1 232 . 1 . 1 22 22 GLU C C 13 176.382 0.015 . 1 . . . . . 22 GLU C . 28014 1 233 . 1 . 1 22 22 GLU CA C 13 54.348 0.061 . 1 . . . . . 22 GLU CA . 28014 1 234 . 1 . 1 22 22 GLU CB C 13 31.931 0.044 . 1 . . . . . 22 GLU CB . 28014 1 235 . 1 . 1 22 22 GLU CG C 13 35.576 0.059 . 1 . . . . . 22 GLU CG . 28014 1 236 . 1 . 1 22 22 GLU N N 15 119.835 0.064 . 1 . . . . . 22 GLU N . 28014 1 237 . 1 . 1 23 23 LEU H H 1 9.238 0.004 . 1 . . . . . 23 LEU H . 28014 1 238 . 1 . 1 23 23 LEU HA H 1 4.598 0.011 . 1 . . . . . 23 LEU HA . 28014 1 239 . 1 . 1 23 23 LEU HG H 1 1.252 0.009 . 1 . . . . . 23 LEU HG . 28014 1 240 . 1 . 1 23 23 LEU HD11 H 1 0.791 0.005 . 2 . . . . . 23 LEU HD11 . 28014 1 241 . 1 . 1 23 23 LEU HD12 H 1 0.791 0.005 . 2 . . . . . 23 LEU HD12 . 28014 1 242 . 1 . 1 23 23 LEU HD13 H 1 0.791 0.005 . 2 . . . . . 23 LEU HD13 . 28014 1 243 . 1 . 1 23 23 LEU HD21 H 1 0.804 0.001 . 2 . . . . . 23 LEU HD21 . 28014 1 244 . 1 . 1 23 23 LEU HD22 H 1 0.804 0.001 . 2 . . . . . 23 LEU HD22 . 28014 1 245 . 1 . 1 23 23 LEU HD23 H 1 0.804 0.001 . 2 . . . . . 23 LEU HD23 . 28014 1 246 . 1 . 1 23 23 LEU C C 13 175.771 0.000 . 1 . . . . . 23 LEU C . 28014 1 247 . 1 . 1 23 23 LEU CA C 13 54.179 0.130 . 1 . . . . . 23 LEU CA . 28014 1 248 . 1 . 1 23 23 LEU CB C 13 41.347 0.033 . 1 . . . . . 23 LEU CB . 28014 1 249 . 1 . 1 23 23 LEU CG C 13 27.613 0.031 . 1 . . . . . 23 LEU CG . 28014 1 250 . 1 . 1 23 23 LEU CD1 C 13 24.378 0.065 . 2 . . . . . 23 LEU CD1 . 28014 1 251 . 1 . 1 23 23 LEU CD2 C 13 27.552 0.083 . 2 . . . . . 23 LEU CD2 . 28014 1 252 . 1 . 1 23 23 LEU N N 15 126.909 0.038 . 1 . . . . . 23 LEU N . 28014 1 253 . 1 . 1 24 24 VAL H H 1 8.908 0.005 . 1 . . . . . 24 VAL H . 28014 1 254 . 1 . 1 24 24 VAL HA H 1 3.899 0.005 . 1 . . . . . 24 VAL HA . 28014 1 255 . 1 . 1 24 24 VAL HB H 1 1.786 0.006 . 1 . . . . . 24 VAL HB . 28014 1 256 . 1 . 1 24 24 VAL HG11 H 1 0.727 0.005 . 2 . . . . . 24 VAL HG11 . 28014 1 257 . 1 . 1 24 24 VAL HG12 H 1 0.727 0.005 . 2 . . . . . 24 VAL HG12 . 28014 1 258 . 1 . 1 24 24 VAL HG13 H 1 0.727 0.005 . 2 . . . . . 24 VAL HG13 . 28014 1 259 . 1 . 1 24 24 VAL HG21 H 1 0.749 0.008 . 2 . . . . . 24 VAL HG21 . 28014 1 260 . 1 . 1 24 24 VAL HG22 H 1 0.749 0.008 . 2 . . . . . 24 VAL HG22 . 28014 1 261 . 1 . 1 24 24 VAL HG23 H 1 0.749 0.008 . 2 . . . . . 24 VAL HG23 . 28014 1 262 . 1 . 1 24 24 VAL C C 13 175.664 0.000 . 1 . . . . . 24 VAL C . 28014 1 263 . 1 . 1 24 24 VAL CA C 13 65.167 0.042 . 1 . . . . . 24 VAL CA . 28014 1 264 . 1 . 1 24 24 VAL CB C 13 31.690 0.071 . 1 . . . . . 24 VAL CB . 28014 1 265 . 1 . 1 24 24 VAL CG1 C 13 22.540 0.064 . 2 . . . . . 24 VAL CG1 . 28014 1 266 . 1 . 1 24 24 VAL CG2 C 13 20.853 0.058 . 2 . . . . . 24 VAL CG2 . 28014 1 267 . 1 . 1 24 24 VAL N N 15 131.699 0.041 . 1 . . . . . 24 VAL N . 28014 1 268 . 1 . 1 25 25 GLY H H 1 7.156 0.009 . 1 . . . . . 25 GLY H . 28014 1 269 . 1 . 1 25 25 GLY HA2 H 1 2.914 0.007 . 2 . . . . . 25 GLY HA2 . 28014 1 270 . 1 . 1 25 25 GLY HA3 H 1 3.398 0.009 . 2 . . . . . 25 GLY HA3 . 28014 1 271 . 1 . 1 25 25 GLY C C 13 170.002 0.000 . 1 . . . . . 25 GLY C . 28014 1 272 . 1 . 1 25 25 GLY CA C 13 44.548 0.035 . 1 . . . . . 25 GLY CA . 28014 1 273 . 1 . 1 25 25 GLY N N 15 101.361 0.064 . 1 . . . . . 25 GLY N . 28014 1 274 . 1 . 1 26 26 ILE H H 1 7.406 0.008 . 1 . . . . . 26 ILE H . 28014 1 275 . 1 . 1 26 26 ILE HA H 1 5.126 0.005 . 1 . . . . . 26 ILE HA . 28014 1 276 . 1 . 1 26 26 ILE HB H 1 1.522 0.006 . 1 . . . . . 26 ILE HB . 28014 1 277 . 1 . 1 26 26 ILE HG12 H 1 1.257 0.009 . 2 . . . . . 26 ILE HG12 . 28014 1 278 . 1 . 1 26 26 ILE HG13 H 1 0.880 0.018 . 2 . . . . . 26 ILE HG13 . 28014 1 279 . 1 . 1 26 26 ILE HG21 H 1 0.657 0.005 . 1 . . . . . 26 ILE HG21 . 28014 1 280 . 1 . 1 26 26 ILE HG22 H 1 0.657 0.005 . 1 . . . . . 26 ILE HG22 . 28014 1 281 . 1 . 1 26 26 ILE HG23 H 1 0.657 0.005 . 1 . . . . . 26 ILE HG23 . 28014 1 282 . 1 . 1 26 26 ILE HD11 H 1 0.652 0.005 . 1 . . . . . 26 ILE HD11 . 28014 1 283 . 1 . 1 26 26 ILE HD12 H 1 0.652 0.005 . 1 . . . . . 26 ILE HD12 . 28014 1 284 . 1 . 1 26 26 ILE HD13 H 1 0.652 0.005 . 1 . . . . . 26 ILE HD13 . 28014 1 285 . 1 . 1 26 26 ILE C C 13 173.831 0.000 . 1 . . . . . 26 ILE C . 28014 1 286 . 1 . 1 26 26 ILE CA C 13 58.536 0.029 . 1 . . . . . 26 ILE CA . 28014 1 287 . 1 . 1 26 26 ILE CB C 13 41.879 0.107 . 1 . . . . . 26 ILE CB . 28014 1 288 . 1 . 1 26 26 ILE CG1 C 13 27.096 0.054 . 1 . . . . . 26 ILE CG1 . 28014 1 289 . 1 . 1 26 26 ILE CG2 C 13 18.818 0.057 . 1 . . . . . 26 ILE CG2 . 28014 1 290 . 1 . 1 26 26 ILE CD1 C 13 15.383 0.058 . 1 . . . . . 26 ILE CD1 . 28014 1 291 . 1 . 1 26 26 ILE N N 15 115.216 0.074 . 1 . . . . . 26 ILE N . 28014 1 292 . 1 . 1 27 27 GLU H H 1 9.066 0.004 . 1 . . . . . 27 GLU H . 28014 1 293 . 1 . 1 27 27 GLU HA H 1 4.711 0.009 . 1 . . . . . 27 GLU HA . 28014 1 294 . 1 . 1 27 27 GLU HB2 H 1 2.079 0.006 . 2 . . . . . 27 GLU HB2 . 28014 1 295 . 1 . 1 27 27 GLU HB3 H 1 2.014 0.003 . 2 . . . . . 27 GLU HB3 . 28014 1 296 . 1 . 1 27 27 GLU HG2 H 1 2.339 0.008 . 2 . . . . . 27 GLU HG2 . 28014 1 297 . 1 . 1 27 27 GLU HG3 H 1 2.247 0.008 . 2 . . . . . 27 GLU HG3 . 28014 1 298 . 1 . 1 27 27 GLU C C 13 173.562 0.011 . 1 . . . . . 27 GLU C . 28014 1 299 . 1 . 1 27 27 GLU CA C 13 54.974 0.048 . 1 . . . . . 27 GLU CA . 28014 1 300 . 1 . 1 27 27 GLU CB C 13 34.556 0.058 . 1 . . . . . 27 GLU CB . 28014 1 301 . 1 . 1 27 27 GLU CG C 13 36.755 0.024 . 1 . . . . . 27 GLU CG . 28014 1 302 . 1 . 1 27 27 GLU N N 15 122.165 0.037 . 1 . . . . . 27 GLU N . 28014 1 303 . 1 . 1 28 28 PHE H H 1 9.473 0.003 . 1 . . . . . 28 PHE H . 28014 1 304 . 1 . 1 28 28 PHE HA H 1 5.347 0.009 . 1 . . . . . 28 PHE HA . 28014 1 305 . 1 . 1 28 28 PHE HB2 H 1 3.031 0.000 . 2 . . . . . 28 PHE HB2 . 28014 1 306 . 1 . 1 28 28 PHE HB3 H 1 2.339 0.005 . 2 . . . . . 28 PHE HB3 . 28014 1 307 . 1 . 1 28 28 PHE HD1 H 1 6.877 0.003 . 1 . . . . . 28 PHE HD1 . 28014 1 308 . 1 . 1 28 28 PHE HD2 H 1 6.877 0.003 . 1 . . . . . 28 PHE HD2 . 28014 1 309 . 1 . 1 28 28 PHE HE1 H 1 6.776 0.002 . 1 . . . . . 28 PHE HE1 . 28014 1 310 . 1 . 1 28 28 PHE HE2 H 1 6.776 0.002 . 1 . . . . . 28 PHE HE2 . 28014 1 311 . 1 . 1 28 28 PHE C C 13 174.046 0.008 . 1 . . . . . 28 PHE C . 28014 1 312 . 1 . 1 28 28 PHE CA C 13 56.232 0.080 . 1 . . . . . 28 PHE CA . 28014 1 313 . 1 . 1 28 28 PHE CB C 13 40.169 0.066 . 1 . . . . . 28 PHE CB . 28014 1 314 . 1 . 1 28 28 PHE N N 15 126.534 0.053 . 1 . . . . . 28 PHE N . 28014 1 315 . 1 . 1 29 29 ILE H H 1 8.909 0.004 . 1 . . . . . 29 ILE H . 28014 1 316 . 1 . 1 29 29 ILE HA H 1 3.978 0.005 . 1 . . . . . 29 ILE HA . 28014 1 317 . 1 . 1 29 29 ILE HB H 1 1.661 0.007 . 1 . . . . . 29 ILE HB . 28014 1 318 . 1 . 1 29 29 ILE HG12 H 1 1.273 0.003 . 2 . . . . . 29 ILE HG12 . 28014 1 319 . 1 . 1 29 29 ILE HG13 H 1 1.041 0.003 . 2 . . . . . 29 ILE HG13 . 28014 1 320 . 1 . 1 29 29 ILE HG21 H 1 0.738 0.005 . 1 . . . . . 29 ILE HG21 . 28014 1 321 . 1 . 1 29 29 ILE HG22 H 1 0.738 0.005 . 1 . . . . . 29 ILE HG22 . 28014 1 322 . 1 . 1 29 29 ILE HG23 H 1 0.738 0.005 . 1 . . . . . 29 ILE HG23 . 28014 1 323 . 1 . 1 29 29 ILE HD11 H 1 0.660 0.005 . 1 . . . . . 29 ILE HD11 . 28014 1 324 . 1 . 1 29 29 ILE HD12 H 1 0.660 0.005 . 1 . . . . . 29 ILE HD12 . 28014 1 325 . 1 . 1 29 29 ILE HD13 H 1 0.660 0.005 . 1 . . . . . 29 ILE HD13 . 28014 1 326 . 1 . 1 29 29 ILE C C 13 175.256 0.005 . 1 . . . . . 29 ILE C . 28014 1 327 . 1 . 1 29 29 ILE CA C 13 60.075 0.042 . 1 . . . . . 29 ILE CA . 28014 1 328 . 1 . 1 29 29 ILE CB C 13 38.709 0.083 . 1 . . . . . 29 ILE CB . 28014 1 329 . 1 . 1 29 29 ILE CG1 C 13 27.245 0.031 . 1 . . . . . 29 ILE CG1 . 28014 1 330 . 1 . 1 29 29 ILE CG2 C 13 17.735 0.041 . 1 . . . . . 29 ILE CG2 . 28014 1 331 . 1 . 1 29 29 ILE CD1 C 13 12.994 0.080 . 1 . . . . . 29 ILE CD1 . 28014 1 332 . 1 . 1 29 29 ILE N N 15 129.999 0.067 . 1 . . . . . 29 ILE N . 28014 1 333 . 1 . 1 30 30 ARG H H 1 8.395 0.006 . 1 . . . . . 30 ARG H . 28014 1 334 . 1 . 1 30 30 ARG HA H 1 4.204 0.003 . 1 . . . . . 30 ARG HA . 28014 1 335 . 1 . 1 30 30 ARG HB2 H 1 1.670 0.002 . 2 . . . . . 30 ARG HB2 . 28014 1 336 . 1 . 1 30 30 ARG HB3 H 1 1.555 0.017 . 2 . . . . . 30 ARG HB3 . 28014 1 337 . 1 . 1 30 30 ARG HG2 H 1 1.546 0.022 . 2 . . . . . 30 ARG HG2 . 28014 1 338 . 1 . 1 30 30 ARG HG3 H 1 1.431 0.003 . 2 . . . . . 30 ARG HG3 . 28014 1 339 . 1 . 1 30 30 ARG HD2 H 1 3.117 0.001 . 2 . . . . . 30 ARG HD2 . 28014 1 340 . 1 . 1 30 30 ARG HD3 H 1 3.052 0.002 . 2 . . . . . 30 ARG HD3 . 28014 1 341 . 1 . 1 30 30 ARG C C 13 176.277 0.000 . 1 . . . . . 30 ARG C . 28014 1 342 . 1 . 1 30 30 ARG CA C 13 55.404 0.044 . 1 . . . . . 30 ARG CA . 28014 1 343 . 1 . 1 30 30 ARG CB C 13 30.483 0.033 . 1 . . . . . 30 ARG CB . 28014 1 344 . 1 . 1 30 30 ARG CG C 13 27.675 0.034 . 1 . . . . . 30 ARG CG . 28014 1 345 . 1 . 1 30 30 ARG CD C 13 43.020 0.037 . 1 . . . . . 30 ARG CD . 28014 1 346 . 1 . 1 30 30 ARG N N 15 127.596 0.044 . 1 . . . . . 30 ARG N . 28014 1 347 . 1 . 1 31 31 GLY H H 1 7.697 0.005 . 1 . . . . . 31 GLY H . 28014 1 348 . 1 . 1 31 31 GLY HA2 H 1 3.734 0.006 . 2 . . . . . 31 GLY HA2 . 28014 1 349 . 1 . 1 31 31 GLY HA3 H 1 4.016 0.001 . 2 . . . . . 31 GLY HA3 . 28014 1 350 . 1 . 1 31 31 GLY C C 13 172.539 0.000 . 1 . . . . . 31 GLY C . 28014 1 351 . 1 . 1 31 31 GLY CA C 13 44.691 0.044 . 1 . . . . . 31 GLY CA . 28014 1 352 . 1 . 1 31 31 GLY N N 15 111.736 0.084 . 1 . . . . . 31 GLY N . 28014 1 353 . 1 . 1 32 32 ARG HA H 1 3.918 0.004 . 1 . . . . . 32 ARG HA . 28014 1 354 . 1 . 1 32 32 ARG HB2 H 1 1.760 0.002 . 1 . . . . . 32 ARG HB2 . 28014 1 355 . 1 . 1 32 32 ARG HG2 H 1 1.644 0.003 . 2 . . . . . 32 ARG HG2 . 28014 1 356 . 1 . 1 32 32 ARG HG3 H 1 1.557 0.001 . 2 . . . . . 32 ARG HG3 . 28014 1 357 . 1 . 1 32 32 ARG HD2 H 1 3.135 0.002 . 1 . . . . . 32 ARG HD2 . 28014 1 358 . 1 . 1 32 32 ARG C C 13 179.789 0.000 . 1 . . . . . 32 ARG C . 28014 1 359 . 1 . 1 32 32 ARG CA C 13 60.313 0.054 . 1 . . . . . 32 ARG CA . 28014 1 360 . 1 . 1 32 32 ARG CB C 13 29.146 0.017 . 1 . . . . . 32 ARG CB . 28014 1 361 . 1 . 1 32 32 ARG CG C 13 27.273 0.051 . 1 . . . . . 32 ARG CG . 28014 1 362 . 1 . 1 32 32 ARG CD C 13 43.157 0.014 . 1 . . . . . 32 ARG CD . 28014 1 363 . 1 . 1 33 33 THR H H 1 7.567 0.005 . 1 . . . . . 33 THR H . 28014 1 364 . 1 . 1 33 33 THR HA H 1 4.146 0.005 . 1 . . . . . 33 THR HA . 28014 1 365 . 1 . 1 33 33 THR HB H 1 3.793 0.003 . 1 . . . . . 33 THR HB . 28014 1 366 . 1 . 1 33 33 THR HG21 H 1 0.978 0.004 . 1 . . . . . 33 THR HG21 . 28014 1 367 . 1 . 1 33 33 THR HG22 H 1 0.978 0.004 . 1 . . . . . 33 THR HG22 . 28014 1 368 . 1 . 1 33 33 THR HG23 H 1 0.978 0.004 . 1 . . . . . 33 THR HG23 . 28014 1 369 . 1 . 1 33 33 THR C C 13 174.462 0.009 . 1 . . . . . 33 THR C . 28014 1 370 . 1 . 1 33 33 THR CA C 13 62.489 0.030 . 1 . . . . . 33 THR CA . 28014 1 371 . 1 . 1 33 33 THR CB C 13 69.510 0.068 . 1 . . . . . 33 THR CB . 28014 1 372 . 1 . 1 33 33 THR CG2 C 13 21.476 0.029 . 1 . . . . . 33 THR CG2 . 28014 1 373 . 1 . 1 33 33 THR N N 15 111.208 0.087 . 1 . . . . . 33 THR N . 28014 1 374 . 1 . 1 34 34 SER H H 1 8.328 0.003 . 1 . . . . . 34 SER H . 28014 1 375 . 1 . 1 34 34 SER HA H 1 4.731 0.004 . 1 . . . . . 34 SER HA . 28014 1 376 . 1 . 1 34 34 SER HB2 H 1 3.735 0.008 . 2 . . . . . 34 SER HB2 . 28014 1 377 . 1 . 1 34 34 SER HB3 H 1 3.383 0.007 . 2 . . . . . 34 SER HB3 . 28014 1 378 . 1 . 1 34 34 SER C C 13 172.505 0.003 . 1 . . . . . 34 SER C . 28014 1 379 . 1 . 1 34 34 SER CA C 13 59.487 0.029 . 1 . . . . . 34 SER CA . 28014 1 380 . 1 . 1 34 34 SER CB C 13 64.764 0.062 . 1 . . . . . 34 SER CB . 28014 1 381 . 1 . 1 34 34 SER N N 15 122.910 0.077 . 1 . . . . . 34 SER N . 28014 1 382 . 1 . 1 35 35 THR H H 1 8.689 0.004 . 1 . . . . . 35 THR H . 28014 1 383 . 1 . 1 35 35 THR HA H 1 4.919 0.010 . 1 . . . . . 35 THR HA . 28014 1 384 . 1 . 1 35 35 THR HB H 1 3.626 0.008 . 1 . . . . . 35 THR HB . 28014 1 385 . 1 . 1 35 35 THR HG21 H 1 0.908 0.002 . 1 . . . . . 35 THR HG21 . 28014 1 386 . 1 . 1 35 35 THR HG22 H 1 0.908 0.002 . 1 . . . . . 35 THR HG22 . 28014 1 387 . 1 . 1 35 35 THR HG23 H 1 0.908 0.002 . 1 . . . . . 35 THR HG23 . 28014 1 388 . 1 . 1 35 35 THR C C 13 171.829 0.000 . 1 . . . . . 35 THR C . 28014 1 389 . 1 . 1 35 35 THR CA C 13 61.815 0.042 . 1 . . . . . 35 THR CA . 28014 1 390 . 1 . 1 35 35 THR CB C 13 72.124 0.077 . 1 . . . . . 35 THR CB . 28014 1 391 . 1 . 1 35 35 THR CG2 C 13 21.366 0.043 . 1 . . . . . 35 THR CG2 . 28014 1 392 . 1 . 1 35 35 THR N N 15 118.725 0.090 . 1 . . . . . 35 THR N . 28014 1 393 . 1 . 1 36 36 LEU H H 1 9.061 0.005 . 1 . . . . . 36 LEU H . 28014 1 394 . 1 . 1 36 36 LEU HA H 1 4.895 0.005 . 1 . . . . . 36 LEU HA . 28014 1 395 . 1 . 1 36 36 LEU HB2 H 1 1.976 0.019 . 2 . . . . . 36 LEU HB2 . 28014 1 396 . 1 . 1 36 36 LEU HB3 H 1 0.975 0.009 . 2 . . . . . 36 LEU HB3 . 28014 1 397 . 1 . 1 36 36 LEU HG H 1 1.278 0.009 . 1 . . . . . 36 LEU HG . 28014 1 398 . 1 . 1 36 36 LEU HD11 H 1 0.580 0.004 . 2 . . . . . 36 LEU HD11 . 28014 1 399 . 1 . 1 36 36 LEU HD12 H 1 0.580 0.004 . 2 . . . . . 36 LEU HD12 . 28014 1 400 . 1 . 1 36 36 LEU HD13 H 1 0.580 0.004 . 2 . . . . . 36 LEU HD13 . 28014 1 401 . 1 . 1 36 36 LEU HD21 H 1 0.639 0.005 . 2 . . . . . 36 LEU HD21 . 28014 1 402 . 1 . 1 36 36 LEU HD22 H 1 0.639 0.005 . 2 . . . . . 36 LEU HD22 . 28014 1 403 . 1 . 1 36 36 LEU HD23 H 1 0.639 0.005 . 2 . . . . . 36 LEU HD23 . 28014 1 404 . 1 . 1 36 36 LEU C C 13 171.804 0.000 . 1 . . . . . 36 LEU C . 28014 1 405 . 1 . 1 36 36 LEU CA C 13 53.595 0.106 . 1 . . . . . 36 LEU CA . 28014 1 406 . 1 . 1 36 36 LEU CB C 13 43.353 0.070 . 1 . . . . . 36 LEU CB . 28014 1 407 . 1 . 1 36 36 LEU CG C 13 27.505 0.132 . 1 . . . . . 36 LEU CG . 28014 1 408 . 1 . 1 36 36 LEU CD1 C 13 24.358 0.036 . 1 . . . . . 36 LEU CD1 . 28014 1 409 . 1 . 1 36 36 LEU CD2 C 13 24.419 0.007 . 1 . . . . . 36 LEU CD2 . 28014 1 410 . 1 . 1 36 36 LEU N N 15 129.198 0.089 . 1 . . . . . 36 LEU N . 28014 1 411 . 1 . 1 37 37 ARG H H 1 9.235 0.007 . 1 . . . . . 37 ARG H . 28014 1 412 . 1 . 1 37 37 ARG HA H 1 5.030 0.011 . 1 . . . . . 37 ARG HA . 28014 1 413 . 1 . 1 37 37 ARG HB2 H 1 1.530 0.002 . 2 . . . . . 37 ARG HB2 . 28014 1 414 . 1 . 1 37 37 ARG HB3 H 1 1.445 0.005 . 2 . . . . . 37 ARG HB3 . 28014 1 415 . 1 . 1 37 37 ARG HG2 H 1 1.100 0.001 . 2 . . . . . 37 ARG HG2 . 28014 1 416 . 1 . 1 37 37 ARG HG3 H 1 0.897 0.014 . 2 . . . . . 37 ARG HG3 . 28014 1 417 . 1 . 1 37 37 ARG HD2 H 1 2.974 0.004 . 2 . . . . . 37 ARG HD2 . 28014 1 418 . 1 . 1 37 37 ARG HD3 H 1 2.894 0.002 . 2 . . . . . 37 ARG HD3 . 28014 1 419 . 1 . 1 37 37 ARG C C 13 173.941 0.006 . 1 . . . . . 37 ARG C . 28014 1 420 . 1 . 1 37 37 ARG CA C 13 54.585 0.038 . 1 . . . . . 37 ARG CA . 28014 1 421 . 1 . 1 37 37 ARG CB C 13 31.915 0.050 . 1 . . . . . 37 ARG CB . 28014 1 422 . 1 . 1 37 37 ARG CG C 13 27.710 0.045 . 1 . . . . . 37 ARG CG . 28014 1 423 . 1 . 1 37 37 ARG CD C 13 43.481 0.029 . 1 . . . . . 37 ARG CD . 28014 1 424 . 1 . 1 37 37 ARG N N 15 128.436 0.089 . 1 . . . . . 37 ARG N . 28014 1 425 . 1 . 1 38 38 ILE H H 1 8.504 0.008 . 1 . . . . . 38 ILE H . 28014 1 426 . 1 . 1 38 38 ILE HA H 1 4.230 0.006 . 1 . . . . . 38 ILE HA . 28014 1 427 . 1 . 1 38 38 ILE HB H 1 1.703 0.005 . 1 . . . . . 38 ILE HB . 28014 1 428 . 1 . 1 38 38 ILE HG12 H 1 1.353 0.003 . 2 . . . . . 38 ILE HG12 . 28014 1 429 . 1 . 1 38 38 ILE HG13 H 1 0.918 0.007 . 2 . . . . . 38 ILE HG13 . 28014 1 430 . 1 . 1 38 38 ILE HG21 H 1 0.595 0.007 . 1 . . . . . 38 ILE HG21 . 28014 1 431 . 1 . 1 38 38 ILE HG22 H 1 0.595 0.007 . 1 . . . . . 38 ILE HG22 . 28014 1 432 . 1 . 1 38 38 ILE HG23 H 1 0.595 0.007 . 1 . . . . . 38 ILE HG23 . 28014 1 433 . 1 . 1 38 38 ILE HD11 H 1 0.669 0.004 . 1 . . . . . 38 ILE HD11 . 28014 1 434 . 1 . 1 38 38 ILE HD12 H 1 0.669 0.004 . 1 . . . . . 38 ILE HD12 . 28014 1 435 . 1 . 1 38 38 ILE HD13 H 1 0.669 0.004 . 1 . . . . . 38 ILE HD13 . 28014 1 436 . 1 . 1 38 38 ILE C C 13 173.918 0.000 . 1 . . . . . 38 ILE C . 28014 1 437 . 1 . 1 38 38 ILE CA C 13 59.527 0.045 . 1 . . . . . 38 ILE CA . 28014 1 438 . 1 . 1 38 38 ILE CB C 13 39.886 0.050 . 1 . . . . . 38 ILE CB . 28014 1 439 . 1 . 1 38 38 ILE CG1 C 13 27.404 0.079 . 1 . . . . . 38 ILE CG1 . 28014 1 440 . 1 . 1 38 38 ILE CG2 C 13 17.408 0.030 . 1 . . . . . 38 ILE CG2 . 28014 1 441 . 1 . 1 38 38 ILE CD1 C 13 14.816 0.051 . 1 . . . . . 38 ILE CD1 . 28014 1 442 . 1 . 1 38 38 ILE N N 15 124.300 0.063 . 1 . . . . . 38 ILE N . 28014 1 443 . 1 . 1 39 39 TYR H H 1 8.579 0.004 . 1 . . . . . 39 TYR H . 28014 1 444 . 1 . 1 39 39 TYR HA H 1 5.459 0.011 . 1 . . . . . 39 TYR HA . 28014 1 445 . 1 . 1 39 39 TYR HB2 H 1 2.762 0.013 . 2 . . . . . 39 TYR HB2 . 28014 1 446 . 1 . 1 39 39 TYR HB3 H 1 2.318 0.004 . 2 . . . . . 39 TYR HB3 . 28014 1 447 . 1 . 1 39 39 TYR C C 13 175.731 0.000 . 1 . . . . . 39 TYR C . 28014 1 448 . 1 . 1 39 39 TYR CA C 13 56.118 0.036 . 1 . . . . . 39 TYR CA . 28014 1 449 . 1 . 1 39 39 TYR CB C 13 40.173 0.048 . 1 . . . . . 39 TYR CB . 28014 1 450 . 1 . 1 39 39 TYR N N 15 124.112 0.080 . 1 . . . . . 39 TYR N . 28014 1 451 . 1 . 1 40 40 ILE H H 1 8.589 0.005 . 1 . . . . . 40 ILE H . 28014 1 452 . 1 . 1 40 40 ILE HA H 1 5.504 0.004 . 1 . . . . . 40 ILE HA . 28014 1 453 . 1 . 1 40 40 ILE HB H 1 1.618 0.004 . 1 . . . . . 40 ILE HB . 28014 1 454 . 1 . 1 40 40 ILE HG12 H 1 0.642 0.034 . 2 . . . . . 40 ILE HG12 . 28014 1 455 . 1 . 1 40 40 ILE HG13 H 1 1.032 0.020 . 2 . . . . . 40 ILE HG13 . 28014 1 456 . 1 . 1 40 40 ILE HG21 H 1 0.733 0.006 . 1 . . . . . 40 ILE HG21 . 28014 1 457 . 1 . 1 40 40 ILE HG22 H 1 0.733 0.006 . 1 . . . . . 40 ILE HG22 . 28014 1 458 . 1 . 1 40 40 ILE HG23 H 1 0.733 0.006 . 1 . . . . . 40 ILE HG23 . 28014 1 459 . 1 . 1 40 40 ILE HD11 H 1 0.100 0.004 . 1 . . . . . 40 ILE HD11 . 28014 1 460 . 1 . 1 40 40 ILE HD12 H 1 0.100 0.004 . 1 . . . . . 40 ILE HD12 . 28014 1 461 . 1 . 1 40 40 ILE HD13 H 1 0.100 0.004 . 1 . . . . . 40 ILE HD13 . 28014 1 462 . 1 . 1 40 40 ILE C C 13 172.843 0.000 . 1 . . . . . 40 ILE C . 28014 1 463 . 1 . 1 40 40 ILE CA C 13 58.692 0.029 . 1 . . . . . 40 ILE CA . 28014 1 464 . 1 . 1 40 40 ILE CB C 13 42.605 0.040 . 1 . . . . . 40 ILE CB . 28014 1 465 . 1 . 1 40 40 ILE CG1 C 13 24.128 0.093 . 1 . . . . . 40 ILE CG1 . 28014 1 466 . 1 . 1 40 40 ILE CG2 C 13 19.049 0.061 . 1 . . . . . 40 ILE CG2 . 28014 1 467 . 1 . 1 40 40 ILE CD1 C 13 14.484 0.089 . 1 . . . . . 40 ILE CD1 . 28014 1 468 . 1 . 1 40 40 ILE N N 15 117.558 0.097 . 1 . . . . . 40 ILE N . 28014 1 469 . 1 . 1 41 41 ASP H H 1 8.634 0.006 . 1 . . . . . 41 ASP H . 28014 1 470 . 1 . 1 41 41 ASP HA H 1 5.088 0.005 . 1 . . . . . 41 ASP HA . 28014 1 471 . 1 . 1 41 41 ASP HB2 H 1 2.533 0.004 . 2 . . . . . 41 ASP HB2 . 28014 1 472 . 1 . 1 41 41 ASP HB3 H 1 2.157 0.004 . 2 . . . . . 41 ASP HB3 . 28014 1 473 . 1 . 1 41 41 ASP C C 13 174.765 0.000 . 1 . . . . . 41 ASP C . 28014 1 474 . 1 . 1 41 41 ASP CA C 13 51.991 0.057 . 1 . . . . . 41 ASP CA . 28014 1 475 . 1 . 1 41 41 ASP CB C 13 45.332 0.026 . 1 . . . . . 41 ASP CB . 28014 1 476 . 1 . 1 41 41 ASP N N 15 115.841 0.086 . 1 . . . . . 41 ASP N . 28014 1 477 . 1 . 1 42 42 SER H H 1 8.674 0.009 . 1 . . . . . 42 SER H . 28014 1 478 . 1 . 1 42 42 SER HA H 1 4.760 0.007 . 1 . . . . . 42 SER HA . 28014 1 479 . 1 . 1 42 42 SER HB2 H 1 4.230 0.003 . 2 . . . . . 42 SER HB2 . 28014 1 480 . 1 . 1 42 42 SER HB3 H 1 3.622 0.008 . 2 . . . . . 42 SER HB3 . 28014 1 481 . 1 . 1 42 42 SER C C 13 175.656 0.000 . 1 . . . . . 42 SER C . 28014 1 482 . 1 . 1 42 42 SER CA C 13 57.512 0.036 . 1 . . . . . 42 SER CA . 28014 1 483 . 1 . 1 42 42 SER CB C 13 65.468 0.019 . 1 . . . . . 42 SER CB . 28014 1 484 . 1 . 1 42 42 SER N N 15 112.764 0.139 . 1 . . . . . 42 SER N . 28014 1 485 . 1 . 1 43 43 GLU HA H 1 4.082 0.007 . 1 . . . . . 43 GLU HA . 28014 1 486 . 1 . 1 43 43 GLU HB2 H 1 1.976 0.004 . 2 . . . . . 43 GLU HB2 . 28014 1 487 . 1 . 1 43 43 GLU HB3 H 1 1.966 0.000 . 2 . . . . . 43 GLU HB3 . 28014 1 488 . 1 . 1 43 43 GLU HG2 H 1 2.236 0.000 . 2 . . . . . 43 GLU HG2 . 28014 1 489 . 1 . 1 43 43 GLU HG3 H 1 2.228 0.000 . 2 . . . . . 43 GLU HG3 . 28014 1 490 . 1 . 1 43 43 GLU C C 13 177.130 0.000 . 1 . . . . . 43 GLU C . 28014 1 491 . 1 . 1 43 43 GLU CA C 13 59.137 0.118 . 1 . . . . . 43 GLU CA . 28014 1 492 . 1 . 1 43 43 GLU CB C 13 29.372 0.031 . 1 . . . . . 43 GLU CB . 28014 1 493 . 1 . 1 43 43 GLU CG C 13 36.151 0.049 . 1 . . . . . 43 GLU CG . 28014 1 494 . 1 . 1 44 44 ASP H H 1 8.180 0.003 . 1 . . . . . 44 ASP H . 28014 1 495 . 1 . 1 44 44 ASP HA H 1 4.712 0.008 . 1 . . . . . 44 ASP HA . 28014 1 496 . 1 . 1 44 44 ASP HB2 H 1 2.801 0.001 . 2 . . . . . 44 ASP HB2 . 28014 1 497 . 1 . 1 44 44 ASP HB3 H 1 2.456 0.002 . 2 . . . . . 44 ASP HB3 . 28014 1 498 . 1 . 1 44 44 ASP C C 13 176.376 0.008 . 1 . . . . . 44 ASP C . 28014 1 499 . 1 . 1 44 44 ASP CA C 13 54.383 0.067 . 1 . . . . . 44 ASP CA . 28014 1 500 . 1 . 1 44 44 ASP CB C 13 41.638 0.018 . 1 . . . . . 44 ASP CB . 28014 1 501 . 1 . 1 44 44 ASP N N 15 117.013 0.064 . 1 . . . . . 44 ASP N . 28014 1 502 . 1 . 1 45 45 GLY H H 1 7.462 0.005 . 1 . . . . . 45 GLY H . 28014 1 503 . 1 . 1 45 45 GLY HA2 H 1 4.292 0.008 . 2 . . . . . 45 GLY HA2 . 28014 1 504 . 1 . 1 45 45 GLY HA3 H 1 3.749 0.007 . 2 . . . . . 45 GLY HA3 . 28014 1 505 . 1 . 1 45 45 GLY C C 13 171.885 0.000 . 1 . . . . . 45 GLY C . 28014 1 506 . 1 . 1 45 45 GLY CA C 13 44.203 0.017 . 1 . . . . . 45 GLY CA . 28014 1 507 . 1 . 1 45 45 GLY N N 15 132.504 0.068 . 1 . . . . . 45 GLY N . 28014 1 508 . 1 . 1 46 46 ILE H H 1 8.193 0.004 . 1 . . . . . 46 ILE H . 28014 1 509 . 1 . 1 46 46 ILE HA H 1 4.586 0.008 . 1 . . . . . 46 ILE HA . 28014 1 510 . 1 . 1 46 46 ILE HB H 1 1.821 0.005 . 1 . . . . . 46 ILE HB . 28014 1 511 . 1 . 1 46 46 ILE HG12 H 1 1.468 0.006 . 2 . . . . . 46 ILE HG12 . 28014 1 512 . 1 . 1 46 46 ILE HG13 H 1 1.231 0.006 . 2 . . . . . 46 ILE HG13 . 28014 1 513 . 1 . 1 46 46 ILE HG21 H 1 0.610 0.010 . 1 . . . . . 46 ILE HG21 . 28014 1 514 . 1 . 1 46 46 ILE HG22 H 1 0.610 0.010 . 1 . . . . . 46 ILE HG22 . 28014 1 515 . 1 . 1 46 46 ILE HG23 H 1 0.610 0.010 . 1 . . . . . 46 ILE HG23 . 28014 1 516 . 1 . 1 46 46 ILE HD11 H 1 0.331 0.004 . 1 . . . . . 46 ILE HD11 . 28014 1 517 . 1 . 1 46 46 ILE HD12 H 1 0.331 0.004 . 1 . . . . . 46 ILE HD12 . 28014 1 518 . 1 . 1 46 46 ILE HD13 H 1 0.331 0.004 . 1 . . . . . 46 ILE HD13 . 28014 1 519 . 1 . 1 46 46 ILE C C 13 175.884 0.010 . 1 . . . . . 46 ILE C . 28014 1 520 . 1 . 1 46 46 ILE CA C 13 57.509 0.049 . 1 . . . . . 46 ILE CA . 28014 1 521 . 1 . 1 46 46 ILE CB C 13 38.926 0.092 . 1 . . . . . 46 ILE CB . 28014 1 522 . 1 . 1 46 46 ILE CG1 C 13 26.581 0.052 . 1 . . . . . 46 ILE CG1 . 28014 1 523 . 1 . 1 46 46 ILE CG2 C 13 18.816 0.059 . 1 . . . . . 46 ILE CG2 . 28014 1 524 . 1 . 1 46 46 ILE CD1 C 13 10.947 0.061 . 1 . . . . . 46 ILE CD1 . 28014 1 525 . 1 . 1 46 46 ILE N N 15 120.612 0.162 . 1 . . . . . 46 ILE N . 28014 1 526 . 1 . 1 47 47 ASN H H 1 9.464 0.005 . 1 . . . . . 47 ASN H . 28014 1 527 . 1 . 1 47 47 ASN HA H 1 5.088 0.007 . 1 . . . . . 47 ASN HA . 28014 1 528 . 1 . 1 47 47 ASN HB2 H 1 3.134 0.003 . 2 . . . . . 47 ASN HB2 . 28014 1 529 . 1 . 1 47 47 ASN HB3 H 1 2.765 0.002 . 2 . . . . . 47 ASN HB3 . 28014 1 530 . 1 . 1 47 47 ASN C C 13 176.579 0.000 . 1 . . . . . 47 ASN C . 28014 1 531 . 1 . 1 47 47 ASN CA C 13 50.964 0.025 . 1 . . . . . 47 ASN CA . 28014 1 532 . 1 . 1 47 47 ASN CB C 13 41.288 0.044 . 1 . . . . . 47 ASN CB . 28014 1 533 . 1 . 1 47 47 ASN N N 15 127.144 0.107 . 1 . . . . . 47 ASN N . 28014 1 534 . 1 . 1 48 48 VAL H H 1 8.206 0.007 . 1 . . . . . 48 VAL H . 28014 1 535 . 1 . 1 48 48 VAL HA H 1 3.769 0.006 . 1 . . . . . 48 VAL HA . 28014 1 536 . 1 . 1 48 48 VAL HB H 1 2.063 0.001 . 1 . . . . . 48 VAL HB . 28014 1 537 . 1 . 1 48 48 VAL HG11 H 1 0.959 0.003 . 1 . . . . . 48 VAL HG11 . 28014 1 538 . 1 . 1 48 48 VAL HG12 H 1 0.959 0.003 . 1 . . . . . 48 VAL HG12 . 28014 1 539 . 1 . 1 48 48 VAL HG13 H 1 0.959 0.003 . 1 . . . . . 48 VAL HG13 . 28014 1 540 . 1 . 1 48 48 VAL C C 13 178.211 0.000 . 1 . . . . . 48 VAL C . 28014 1 541 . 1 . 1 48 48 VAL CA C 13 66.026 0.064 . 1 . . . . . 48 VAL CA . 28014 1 542 . 1 . 1 48 48 VAL CB C 13 31.763 0.037 . 1 . . . . . 48 VAL CB . 28014 1 543 . 1 . 1 48 48 VAL CG1 C 13 20.859 0.043 . 1 . . . . . 48 VAL CG1 . 28014 1 544 . 1 . 1 48 48 VAL N N 15 116.945 0.040 . 1 . . . . . 48 VAL N . 28014 1 545 . 1 . 1 49 49 ASP H H 1 8.003 0.008 . 1 . . . . . 49 ASP H . 28014 1 546 . 1 . 1 49 49 ASP HA H 1 4.389 0.004 . 1 . . . . . 49 ASP HA . 28014 1 547 . 1 . 1 49 49 ASP HB2 H 1 2.689 0.002 . 2 . . . . . 49 ASP HB2 . 28014 1 548 . 1 . 1 49 49 ASP HB3 H 1 2.671 0.003 . 2 . . . . . 49 ASP HB3 . 28014 1 549 . 1 . 1 49 49 ASP C C 13 178.091 0.000 . 1 . . . . . 49 ASP C . 28014 1 550 . 1 . 1 49 49 ASP CA C 13 57.230 0.046 . 1 . . . . . 49 ASP CA . 28014 1 551 . 1 . 1 49 49 ASP CB C 13 39.833 0.061 . 1 . . . . . 49 ASP CB . 28014 1 552 . 1 . 1 49 49 ASP N N 15 122.625 0.103 . 1 . . . . . 49 ASP N . 28014 1 553 . 1 . 1 50 50 ASP H H 1 7.859 0.008 . 1 . . . . . 50 ASP H . 28014 1 554 . 1 . 1 50 50 ASP HA H 1 4.330 0.004 . 1 . . . . . 50 ASP HA . 28014 1 555 . 1 . 1 50 50 ASP HB2 H 1 2.347 0.002 . 1 . . . . . 50 ASP HB2 . 28014 1 556 . 1 . 1 50 50 ASP C C 13 178.163 0.000 . 1 . . . . . 50 ASP C . 28014 1 557 . 1 . 1 50 50 ASP CA C 13 57.482 0.038 . 1 . . . . . 50 ASP CA . 28014 1 558 . 1 . 1 50 50 ASP CB C 13 41.602 0.065 . 1 . . . . . 50 ASP CB . 28014 1 559 . 1 . 1 50 50 ASP N N 15 121.294 0.092 . 1 . . . . . 50 ASP N . 28014 1 560 . 1 . 1 51 51 CYS H H 1 7.346 0.005 . 1 . . . . . 51 CYS H . 28014 1 561 . 1 . 1 51 51 CYS HA H 1 3.620 0.006 . 1 . . . . . 51 CYS HA . 28014 1 562 . 1 . 1 51 51 CYS HB2 H 1 3.042 0.026 . 2 . . . . . 51 CYS HB2 . 28014 1 563 . 1 . 1 51 51 CYS HB3 H 1 2.503 0.003 . 2 . . . . . 51 CYS HB3 . 28014 1 564 . 1 . 1 51 51 CYS C C 13 176.668 0.000 . 1 . . . . . 51 CYS C . 28014 1 565 . 1 . 1 51 51 CYS CA C 13 63.341 0.049 . 1 . . . . . 51 CYS CA . 28014 1 566 . 1 . 1 51 51 CYS CB C 13 26.440 0.036 . 1 . . . . . 51 CYS CB . 28014 1 567 . 1 . 1 51 51 CYS N N 15 115.335 0.074 . 1 . . . . . 51 CYS N . 28014 1 568 . 1 . 1 52 52 ALA H H 1 7.727 0.005 . 1 . . . . . 52 ALA H . 28014 1 569 . 1 . 1 52 52 ALA HA H 1 4.015 0.007 . 1 . . . . . 52 ALA HA . 28014 1 570 . 1 . 1 52 52 ALA HB1 H 1 1.457 0.007 . 1 . . . . . 52 ALA HB1 . 28014 1 571 . 1 . 1 52 52 ALA HB2 H 1 1.457 0.007 . 1 . . . . . 52 ALA HB2 . 28014 1 572 . 1 . 1 52 52 ALA HB3 H 1 1.457 0.007 . 1 . . . . . 52 ALA HB3 . 28014 1 573 . 1 . 1 52 52 ALA C C 13 179.948 0.000 . 1 . . . . . 52 ALA C . 28014 1 574 . 1 . 1 52 52 ALA CA C 13 55.011 0.053 . 1 . . . . . 52 ALA CA . 28014 1 575 . 1 . 1 52 52 ALA CB C 13 17.958 0.056 . 1 . . . . . 52 ALA CB . 28014 1 576 . 1 . 1 52 52 ALA N N 15 123.673 0.068 . 1 . . . . . 52 ALA N . 28014 1 577 . 1 . 1 53 53 ASP H H 1 8.350 0.003 . 1 . . . . . 53 ASP H . 28014 1 578 . 1 . 1 53 53 ASP HA H 1 4.443 0.004 . 1 . . . . . 53 ASP HA . 28014 1 579 . 1 . 1 53 53 ASP HB2 H 1 2.678 0.003 . 1 . . . . . 53 ASP HB2 . 28014 1 580 . 1 . 1 53 53 ASP C C 13 179.752 0.010 . 1 . . . . . 53 ASP C . 28014 1 581 . 1 . 1 53 53 ASP CA C 13 57.602 0.037 . 1 . . . . . 53 ASP CA . 28014 1 582 . 1 . 1 53 53 ASP CB C 13 40.094 0.078 . 1 . . . . . 53 ASP CB . 28014 1 583 . 1 . 1 53 53 ASP N N 15 121.095 0.024 . 1 . . . . . 53 ASP N . 28014 1 584 . 1 . 1 54 54 VAL H H 1 8.182 0.009 . 1 . . . . . 54 VAL H . 28014 1 585 . 1 . 1 54 54 VAL HA H 1 3.420 0.008 . 1 . . . . . 54 VAL HA . 28014 1 586 . 1 . 1 54 54 VAL HB H 1 1.974 0.006 . 1 . . . . . 54 VAL HB . 28014 1 587 . 1 . 1 54 54 VAL HG11 H 1 0.932 0.012 . 2 . . . . . 54 VAL HG11 . 28014 1 588 . 1 . 1 54 54 VAL HG12 H 1 0.932 0.012 . 2 . . . . . 54 VAL HG12 . 28014 1 589 . 1 . 1 54 54 VAL HG13 H 1 0.932 0.012 . 2 . . . . . 54 VAL HG13 . 28014 1 590 . 1 . 1 54 54 VAL HG21 H 1 0.755 0.004 . 2 . . . . . 54 VAL HG21 . 28014 1 591 . 1 . 1 54 54 VAL HG22 H 1 0.755 0.004 . 2 . . . . . 54 VAL HG22 . 28014 1 592 . 1 . 1 54 54 VAL HG23 H 1 0.755 0.004 . 2 . . . . . 54 VAL HG23 . 28014 1 593 . 1 . 1 54 54 VAL C C 13 177.370 0.002 . 1 . . . . . 54 VAL C . 28014 1 594 . 1 . 1 54 54 VAL CA C 13 67.005 0.133 . 1 . . . . . 54 VAL CA . 28014 1 595 . 1 . 1 54 54 VAL CB C 13 31.318 0.032 . 1 . . . . . 54 VAL CB . 28014 1 596 . 1 . 1 54 54 VAL CG1 C 13 25.324 0.058 . 2 . . . . . 54 VAL CG1 . 28014 1 597 . 1 . 1 54 54 VAL CG2 C 13 22.865 0.092 . 2 . . . . . 54 VAL CG2 . 28014 1 598 . 1 . 1 54 54 VAL N N 15 119.633 0.154 . 1 . . . . . 54 VAL N . 28014 1 599 . 1 . 1 55 55 SER H H 1 8.469 0.004 . 1 . . . . . 55 SER H . 28014 1 600 . 1 . 1 55 55 SER HA H 1 3.735 0.009 . 1 . . . . . 55 SER HA . 28014 1 601 . 1 . 1 55 55 SER HB2 H 1 3.616 0.003 . 2 . . . . . 55 SER HB2 . 28014 1 602 . 1 . 1 55 55 SER HB3 H 1 3.610 0.001 . 2 . . . . . 55 SER HB3 . 28014 1 603 . 1 . 1 55 55 SER C C 13 176.795 0.000 . 1 . . . . . 55 SER C . 28014 1 604 . 1 . 1 55 55 SER CA C 13 62.503 0.059 . 1 . . . . . 55 SER CA . 28014 1 605 . 1 . 1 55 55 SER CB C 13 62.553 0.038 . 1 . . . . . 55 SER CB . 28014 1 606 . 1 . 1 55 55 SER N N 15 115.632 0.035 . 1 . . . . . 55 SER N . 28014 1 607 . 1 . 1 56 56 HIS H H 1 8.083 0.003 . 1 . . . . . 56 HIS H . 28014 1 608 . 1 . 1 56 56 HIS HA H 1 4.297 0.009 . 1 . . . . . 56 HIS HA . 28014 1 609 . 1 . 1 56 56 HIS HB2 H 1 3.255 0.001 . 1 . . . . . 56 HIS HB2 . 28014 1 610 . 1 . 1 56 56 HIS C C 13 178.050 0.041 . 1 . . . . . 56 HIS C . 28014 1 611 . 1 . 1 56 56 HIS CA C 13 59.582 0.042 . 1 . . . . . 56 HIS CA . 28014 1 612 . 1 . 1 56 56 HIS CB C 13 30.033 0.053 . 1 . . . . . 56 HIS CB . 28014 1 613 . 1 . 1 56 56 HIS N N 15 119.224 0.060 . 1 . . . . . 56 HIS N . 28014 1 614 . 1 . 1 57 57 GLN H H 1 7.841 0.004 . 1 . . . . . 57 GLN H . 28014 1 615 . 1 . 1 57 57 GLN HA H 1 4.108 0.009 . 1 . . . . . 57 GLN HA . 28014 1 616 . 1 . 1 57 57 GLN HB2 H 1 2.131 0.002 . 2 . . . . . 57 GLN HB2 . 28014 1 617 . 1 . 1 57 57 GLN HB3 H 1 2.031 0.003 . 2 . . . . . 57 GLN HB3 . 28014 1 618 . 1 . 1 57 57 GLN HG2 H 1 2.549 0.003 . 2 . . . . . 57 GLN HG2 . 28014 1 619 . 1 . 1 57 57 GLN HG3 H 1 2.411 0.003 . 2 . . . . . 57 GLN HG3 . 28014 1 620 . 1 . 1 57 57 GLN HE21 H 1 7.602 0.002 . 1 . . . . . 57 GLN HE21 . 28014 1 621 . 1 . 1 57 57 GLN HE22 H 1 6.909 0.002 . 1 . . . . . 57 GLN HE22 . 28014 1 622 . 1 . 1 57 57 GLN C C 13 178.929 0.019 . 1 . . . . . 57 GLN C . 28014 1 623 . 1 . 1 57 57 GLN CA C 13 58.212 0.035 . 1 . . . . . 57 GLN CA . 28014 1 624 . 1 . 1 57 57 GLN CB C 13 28.588 0.053 . 1 . . . . . 57 GLN CB . 28014 1 625 . 1 . 1 57 57 GLN CG C 13 33.145 0.041 . 1 . . . . . 57 GLN CG . 28014 1 626 . 1 . 1 57 57 GLN CD C 13 178.999 0.000 . 1 . . . . . 57 GLN CD . 28014 1 627 . 1 . 1 57 57 GLN N N 15 118.165 0.056 . 1 . . . . . 57 GLN N . 28014 1 628 . 1 . 1 57 57 GLN NE2 N 15 112.740 0.016 . 1 . . . . . 57 GLN NE2 . 28014 1 629 . 1 . 1 58 58 VAL H H 1 8.957 0.003 . 1 . . . . . 58 VAL H . 28014 1 630 . 1 . 1 58 58 VAL HA H 1 3.456 0.005 . 1 . . . . . 58 VAL HA . 28014 1 631 . 1 . 1 58 58 VAL HB H 1 2.028 0.002 . 1 . . . . . 58 VAL HB . 28014 1 632 . 1 . 1 58 58 VAL HG11 H 1 0.890 0.003 . 2 . . . . . 58 VAL HG11 . 28014 1 633 . 1 . 1 58 58 VAL HG12 H 1 0.890 0.003 . 2 . . . . . 58 VAL HG12 . 28014 1 634 . 1 . 1 58 58 VAL HG13 H 1 0.890 0.003 . 2 . . . . . 58 VAL HG13 . 28014 1 635 . 1 . 1 58 58 VAL HG21 H 1 0.810 0.012 . 2 . . . . . 58 VAL HG21 . 28014 1 636 . 1 . 1 58 58 VAL HG22 H 1 0.810 0.012 . 2 . . . . . 58 VAL HG22 . 28014 1 637 . 1 . 1 58 58 VAL HG23 H 1 0.810 0.012 . 2 . . . . . 58 VAL HG23 . 28014 1 638 . 1 . 1 58 58 VAL C C 13 177.705 0.005 . 1 . . . . . 58 VAL C . 28014 1 639 . 1 . 1 58 58 VAL CA C 13 66.917 0.066 . 1 . . . . . 58 VAL CA . 28014 1 640 . 1 . 1 58 58 VAL CB C 13 31.132 0.061 . 1 . . . . . 58 VAL CB . 28014 1 641 . 1 . 1 58 58 VAL CG1 C 13 24.284 0.058 . 2 . . . . . 58 VAL CG1 . 28014 1 642 . 1 . 1 58 58 VAL CG2 C 13 22.234 0.046 . 2 . . . . . 58 VAL CG2 . 28014 1 643 . 1 . 1 58 58 VAL N N 15 118.950 0.103 . 1 . . . . . 58 VAL N . 28014 1 644 . 1 . 1 59 59 SER H H 1 8.449 0.003 . 1 . . . . . 59 SER H . 28014 1 645 . 1 . 1 59 59 SER HA H 1 3.990 0.006 . 1 . . . . . 59 SER HA . 28014 1 646 . 1 . 1 59 59 SER HB2 H 1 3.835 0.002 . 2 . . . . . 59 SER HB2 . 28014 1 647 . 1 . 1 59 59 SER HB3 H 1 3.913 0.020 . 2 . . . . . 59 SER HB3 . 28014 1 648 . 1 . 1 59 59 SER C C 13 175.581 0.000 . 1 . . . . . 59 SER C . 28014 1 649 . 1 . 1 59 59 SER CA C 13 62.571 0.114 . 1 . . . . . 59 SER CA . 28014 1 650 . 1 . 1 59 59 SER CB C 13 62.712 0.000 . 1 . . . . . 59 SER CB . 28014 1 651 . 1 . 1 59 59 SER N N 15 116.203 0.044 . 1 . . . . . 59 SER N . 28014 1 652 . 1 . 1 60 60 ALA H H 1 7.225 0.005 . 1 . . . . . 60 ALA H . 28014 1 653 . 1 . 1 60 60 ALA HA H 1 4.086 0.006 . 1 . . . . . 60 ALA HA . 28014 1 654 . 1 . 1 60 60 ALA HB1 H 1 1.362 0.003 . 1 . . . . . 60 ALA HB1 . 28014 1 655 . 1 . 1 60 60 ALA HB2 H 1 1.362 0.003 . 1 . . . . . 60 ALA HB2 . 28014 1 656 . 1 . 1 60 60 ALA HB3 H 1 1.362 0.003 . 1 . . . . . 60 ALA HB3 . 28014 1 657 . 1 . 1 60 60 ALA C C 13 180.514 0.006 . 1 . . . . . 60 ALA C . 28014 1 658 . 1 . 1 60 60 ALA CA C 13 54.886 0.075 . 1 . . . . . 60 ALA CA . 28014 1 659 . 1 . 1 60 60 ALA CB C 13 17.856 0.059 . 1 . . . . . 60 ALA CB . 28014 1 660 . 1 . 1 60 60 ALA N N 15 121.537 0.103 . 1 . . . . . 60 ALA N . 28014 1 661 . 1 . 1 61 61 VAL H H 1 7.312 0.005 . 1 . . . . . 61 VAL H . 28014 1 662 . 1 . 1 61 61 VAL HA H 1 3.781 0.006 . 1 . . . . . 61 VAL HA . 28014 1 663 . 1 . 1 61 61 VAL HB H 1 2.214 0.004 . 1 . . . . . 61 VAL HB . 28014 1 664 . 1 . 1 61 61 VAL HG11 H 1 1.054 0.003 . 2 . . . . . 61 VAL HG11 . 28014 1 665 . 1 . 1 61 61 VAL HG12 H 1 1.054 0.003 . 2 . . . . . 61 VAL HG12 . 28014 1 666 . 1 . 1 61 61 VAL HG13 H 1 1.054 0.003 . 2 . . . . . 61 VAL HG13 . 28014 1 667 . 1 . 1 61 61 VAL HG21 H 1 0.894 0.006 . 2 . . . . . 61 VAL HG21 . 28014 1 668 . 1 . 1 61 61 VAL HG22 H 1 0.894 0.006 . 2 . . . . . 61 VAL HG22 . 28014 1 669 . 1 . 1 61 61 VAL HG23 H 1 0.894 0.006 . 2 . . . . . 61 VAL HG23 . 28014 1 670 . 1 . 1 61 61 VAL C C 13 178.419 0.009 . 1 . . . . . 61 VAL C . 28014 1 671 . 1 . 1 61 61 VAL CA C 13 65.663 0.040 . 1 . . . . . 61 VAL CA . 28014 1 672 . 1 . 1 61 61 VAL CB C 13 32.119 0.029 . 1 . . . . . 61 VAL CB . 28014 1 673 . 1 . 1 61 61 VAL CG1 C 13 22.393 0.029 . 2 . . . . . 61 VAL CG1 . 28014 1 674 . 1 . 1 61 61 VAL CG2 C 13 21.126 0.029 . 2 . . . . . 61 VAL CG2 . 28014 1 675 . 1 . 1 61 61 VAL N N 15 118.299 0.062 . 1 . . . . . 61 VAL N . 28014 1 676 . 1 . 1 62 62 LEU H H 1 8.128 0.004 . 1 . . . . . 62 LEU H . 28014 1 677 . 1 . 1 62 62 LEU HA H 1 4.093 0.007 . 1 . . . . . 62 LEU HA . 28014 1 678 . 1 . 1 62 62 LEU HB2 H 1 1.771 0.002 . 2 . . . . . 62 LEU HB2 . 28014 1 679 . 1 . 1 62 62 LEU HB3 H 1 1.397 0.031 . 2 . . . . . 62 LEU HB3 . 28014 1 680 . 1 . 1 62 62 LEU HG H 1 0.736 0.001 . 1 . . . . . 62 LEU HG . 28014 1 681 . 1 . 1 62 62 LEU HD11 H 1 0.676 0.006 . 1 . . . . . 62 LEU HD11 . 28014 1 682 . 1 . 1 62 62 LEU HD12 H 1 0.676 0.006 . 1 . . . . . 62 LEU HD12 . 28014 1 683 . 1 . 1 62 62 LEU HD13 H 1 0.676 0.006 . 1 . . . . . 62 LEU HD13 . 28014 1 684 . 1 . 1 62 62 LEU C C 13 178.452 0.017 . 1 . . . . . 62 LEU C . 28014 1 685 . 1 . 1 62 62 LEU CA C 13 57.083 0.046 . 1 . . . . . 62 LEU CA . 28014 1 686 . 1 . 1 62 62 LEU CB C 13 40.877 0.133 . 1 . . . . . 62 LEU CB . 28014 1 687 . 1 . 1 62 62 LEU CG C 13 26.017 0.039 . 1 . . . . . 62 LEU CG . 28014 1 688 . 1 . 1 62 62 LEU CD1 C 13 22.421 0.020 . 2 . . . . . 62 LEU CD1 . 28014 1 689 . 1 . 1 62 62 LEU CD2 C 13 22.500 0.083 . 2 . . . . . 62 LEU CD2 . 28014 1 690 . 1 . 1 62 62 LEU N N 15 120.189 0.065 . 1 . . . . . 62 LEU N . 28014 1 691 . 1 . 1 63 63 ASP H H 1 7.996 0.003 . 1 . . . . . 63 ASP H . 28014 1 692 . 1 . 1 63 63 ASP HA H 1 4.378 0.004 . 1 . . . . . 63 ASP HA . 28014 1 693 . 1 . 1 63 63 ASP HB2 H 1 2.699 0.004 . 2 . . . . . 63 ASP HB2 . 28014 1 694 . 1 . 1 63 63 ASP HB3 H 1 2.531 0.002 . 2 . . . . . 63 ASP HB3 . 28014 1 695 . 1 . 1 63 63 ASP C C 13 177.719 0.015 . 1 . . . . . 63 ASP C . 28014 1 696 . 1 . 1 63 63 ASP CA C 13 56.378 0.033 . 1 . . . . . 63 ASP CA . 28014 1 697 . 1 . 1 63 63 ASP CB C 13 40.987 0.030 . 1 . . . . . 63 ASP CB . 28014 1 698 . 1 . 1 63 63 ASP N N 15 117.352 0.037 . 1 . . . . . 63 ASP N . 28014 1 699 . 1 . 1 64 64 VAL H H 1 7.086 0.011 . 1 . . . . . 64 VAL H . 28014 1 700 . 1 . 1 64 64 VAL HA H 1 3.772 0.008 . 1 . . . . . 64 VAL HA . 28014 1 701 . 1 . 1 64 64 VAL HB H 1 2.104 0.003 . 1 . . . . . 64 VAL HB . 28014 1 702 . 1 . 1 64 64 VAL HG11 H 1 0.985 0.007 . 2 . . . . . 64 VAL HG11 . 28014 1 703 . 1 . 1 64 64 VAL HG12 H 1 0.985 0.007 . 2 . . . . . 64 VAL HG12 . 28014 1 704 . 1 . 1 64 64 VAL HG13 H 1 0.985 0.007 . 2 . . . . . 64 VAL HG13 . 28014 1 705 . 1 . 1 64 64 VAL HG21 H 1 0.887 0.007 . 2 . . . . . 64 VAL HG21 . 28014 1 706 . 1 . 1 64 64 VAL HG22 H 1 0.887 0.007 . 2 . . . . . 64 VAL HG22 . 28014 1 707 . 1 . 1 64 64 VAL HG23 H 1 0.887 0.007 . 2 . . . . . 64 VAL HG23 . 28014 1 708 . 1 . 1 64 64 VAL C C 13 176.876 0.004 . 1 . . . . . 64 VAL C . 28014 1 709 . 1 . 1 64 64 VAL CA C 13 64.747 0.039 . 1 . . . . . 64 VAL CA . 28014 1 710 . 1 . 1 64 64 VAL CB C 13 32.332 0.076 . 1 . . . . . 64 VAL CB . 28014 1 711 . 1 . 1 64 64 VAL CG1 C 13 21.795 0.072 . 2 . . . . . 64 VAL CG1 . 28014 1 712 . 1 . 1 64 64 VAL CG2 C 13 21.192 0.108 . 2 . . . . . 64 VAL CG2 . 28014 1 713 . 1 . 1 64 64 VAL N N 15 117.436 0.118 . 1 . . . . . 64 VAL N . 28014 1 714 . 1 . 1 65 65 GLU H H 1 7.545 0.013 . 1 . . . . . 65 GLU H . 28014 1 715 . 1 . 1 65 65 GLU HA H 1 4.089 0.006 . 1 . . . . . 65 GLU HA . 28014 1 716 . 1 . 1 65 65 GLU HB2 H 1 1.877 0.002 . 2 . . . . . 65 GLU HB2 . 28014 1 717 . 1 . 1 65 65 GLU HB3 H 1 1.743 0.006 . 2 . . . . . 65 GLU HB3 . 28014 1 718 . 1 . 1 65 65 GLU HG2 H 1 2.139 0.001 . 2 . . . . . 65 GLU HG2 . 28014 1 719 . 1 . 1 65 65 GLU HG3 H 1 2.033 0.002 . 2 . . . . . 65 GLU HG3 . 28014 1 720 . 1 . 1 65 65 GLU C C 13 174.126 0.006 . 1 . . . . . 65 GLU C . 28014 1 721 . 1 . 1 65 65 GLU CA C 13 56.693 0.136 . 1 . . . . . 65 GLU CA . 28014 1 722 . 1 . 1 65 65 GLU CB C 13 30.791 0.046 . 1 . . . . . 65 GLU CB . 28014 1 723 . 1 . 1 65 65 GLU CG C 13 35.825 0.030 . 1 . . . . . 65 GLU CG . 28014 1 724 . 1 . 1 65 65 GLU N N 15 119.094 0.221 . 1 . . . . . 65 GLU N . 28014 1 725 . 1 . 1 66 66 ASP H H 1 8.121 0.004 . 1 . . . . . 66 ASP H . 28014 1 726 . 1 . 1 66 66 ASP HA H 1 4.776 0.005 . 1 . . . . . 66 ASP HA . 28014 1 727 . 1 . 1 66 66 ASP HB2 H 1 2.814 0.003 . 2 . . . . . 66 ASP HB2 . 28014 1 728 . 1 . 1 66 66 ASP HB3 H 1 2.683 0.003 . 2 . . . . . 66 ASP HB3 . 28014 1 729 . 1 . 1 66 66 ASP C C 13 174.862 0.000 . 1 . . . . . 66 ASP C . 28014 1 730 . 1 . 1 66 66 ASP CA C 13 52.137 0.043 . 1 . . . . . 66 ASP CA . 28014 1 731 . 1 . 1 66 66 ASP CB C 13 42.036 0.035 . 1 . . . . . 66 ASP CB . 28014 1 732 . 1 . 1 66 66 ASP N N 15 121.631 0.071 . 1 . . . . . 66 ASP N . 28014 1 733 . 1 . 1 67 67 PRO HA H 1 4.370 0.022 . 1 . . . . . 67 PRO HA . 28014 1 734 . 1 . 1 67 67 PRO HB2 H 1 2.017 0.000 . 2 . . . . . 67 PRO HB2 . 28014 1 735 . 1 . 1 67 67 PRO HB3 H 1 1.679 0.011 . 2 . . . . . 67 PRO HB3 . 28014 1 736 . 1 . 1 67 67 PRO HG2 H 1 1.737 0.000 . 2 . . . . . 67 PRO HG2 . 28014 1 737 . 1 . 1 67 67 PRO HG3 H 1 1.548 0.001 . 2 . . . . . 67 PRO HG3 . 28014 1 738 . 1 . 1 67 67 PRO HD2 H 1 3.880 0.001 . 2 . . . . . 67 PRO HD2 . 28014 1 739 . 1 . 1 67 67 PRO HD3 H 1 3.568 0.009 . 2 . . . . . 67 PRO HD3 . 28014 1 740 . 1 . 1 67 67 PRO C C 13 176.194 0.000 . 1 . . . . . 67 PRO C . 28014 1 741 . 1 . 1 67 67 PRO CA C 13 63.286 0.036 . 1 . . . . . 67 PRO CA . 28014 1 742 . 1 . 1 67 67 PRO CB C 13 31.927 0.073 . 1 . . . . . 67 PRO CB . 28014 1 743 . 1 . 1 67 67 PRO CG C 13 26.930 0.070 . 1 . . . . . 67 PRO CG . 28014 1 744 . 1 . 1 67 67 PRO CD C 13 49.873 0.020 . 1 . . . . . 67 PRO CD . 28014 1 745 . 1 . 1 68 68 ILE H H 1 8.197 0.008 . 1 . . . . . 68 ILE H . 28014 1 746 . 1 . 1 68 68 ILE HA H 1 3.722 0.004 . 1 . . . . . 68 ILE HA . 28014 1 747 . 1 . 1 68 68 ILE HB H 1 1.686 0.000 . 1 . . . . . 68 ILE HB . 28014 1 748 . 1 . 1 68 68 ILE HG12 H 1 1.035 0.001 . 2 . . . . . 68 ILE HG12 . 28014 1 749 . 1 . 1 68 68 ILE HG13 H 1 0.169 0.004 . 2 . . . . . 68 ILE HG13 . 28014 1 750 . 1 . 1 68 68 ILE HG21 H 1 0.680 0.006 . 1 . . . . . 68 ILE HG21 . 28014 1 751 . 1 . 1 68 68 ILE HG22 H 1 0.680 0.006 . 1 . . . . . 68 ILE HG22 . 28014 1 752 . 1 . 1 68 68 ILE HG23 H 1 0.680 0.006 . 1 . . . . . 68 ILE HG23 . 28014 1 753 . 1 . 1 68 68 ILE HD11 H 1 -0.078 0.010 . 1 . . . . . 68 ILE HD11 . 28014 1 754 . 1 . 1 68 68 ILE HD12 H 1 -0.078 0.010 . 1 . . . . . 68 ILE HD12 . 28014 1 755 . 1 . 1 68 68 ILE HD13 H 1 -0.078 0.010 . 1 . . . . . 68 ILE HD13 . 28014 1 756 . 1 . 1 68 68 ILE C C 13 177.043 0.000 . 1 . . . . . 68 ILE C . 28014 1 757 . 1 . 1 68 68 ILE CA C 13 62.222 0.085 . 1 . . . . . 68 ILE CA . 28014 1 758 . 1 . 1 68 68 ILE CB C 13 37.876 0.072 . 1 . . . . . 68 ILE CB . 28014 1 759 . 1 . 1 68 68 ILE CG1 C 13 28.334 0.059 . 1 . . . . . 68 ILE CG1 . 28014 1 760 . 1 . 1 68 68 ILE CG2 C 13 19.830 0.058 . 1 . . . . . 68 ILE CG2 . 28014 1 761 . 1 . 1 68 68 ILE CD1 C 13 12.906 0.085 . 1 . . . . . 68 ILE CD1 . 28014 1 762 . 1 . 1 68 68 ILE N N 15 121.762 0.067 . 1 . . . . . 68 ILE N . 28014 1 763 . 1 . 1 69 69 THR HA H 1 4.306 0.005 . 1 . . . . . 69 THR HA . 28014 1 764 . 1 . 1 69 69 THR HB H 1 4.406 0.004 . 1 . . . . . 69 THR HB . 28014 1 765 . 1 . 1 69 69 THR HG21 H 1 1.076 0.005 . 1 . . . . . 69 THR HG21 . 28014 1 766 . 1 . 1 69 69 THR HG22 H 1 1.076 0.005 . 1 . . . . . 69 THR HG22 . 28014 1 767 . 1 . 1 69 69 THR HG23 H 1 1.076 0.005 . 1 . . . . . 69 THR HG23 . 28014 1 768 . 1 . 1 69 69 THR C C 13 178.623 0.000 . 1 . . . . . 69 THR C . 28014 1 769 . 1 . 1 69 69 THR CA C 13 62.732 0.022 . 1 . . . . . 69 THR CA . 28014 1 770 . 1 . 1 69 69 THR CB C 13 68.917 0.042 . 1 . . . . . 69 THR CB . 28014 1 771 . 1 . 1 69 69 THR CG2 C 13 21.587 0.017 . 1 . . . . . 69 THR CG2 . 28014 1 772 . 1 . 1 70 70 VAL H H 1 6.935 0.008 . 1 . . . . . 70 VAL H . 28014 1 773 . 1 . 1 70 70 VAL HA H 1 4.552 0.006 . 1 . . . . . 70 VAL HA . 28014 1 774 . 1 . 1 70 70 VAL HB H 1 2.426 0.006 . 1 . . . . . 70 VAL HB . 28014 1 775 . 1 . 1 70 70 VAL HG11 H 1 0.906 0.015 . 2 . . . . . 70 VAL HG11 . 28014 1 776 . 1 . 1 70 70 VAL HG12 H 1 0.906 0.015 . 2 . . . . . 70 VAL HG12 . 28014 1 777 . 1 . 1 70 70 VAL HG13 H 1 0.906 0.015 . 2 . . . . . 70 VAL HG13 . 28014 1 778 . 1 . 1 70 70 VAL HG21 H 1 0.835 0.006 . 2 . . . . . 70 VAL HG21 . 28014 1 779 . 1 . 1 70 70 VAL HG22 H 1 0.835 0.006 . 2 . . . . . 70 VAL HG22 . 28014 1 780 . 1 . 1 70 70 VAL HG23 H 1 0.835 0.006 . 2 . . . . . 70 VAL HG23 . 28014 1 781 . 1 . 1 70 70 VAL C C 13 175.064 0.000 . 1 . . . . . 70 VAL C . 28014 1 782 . 1 . 1 70 70 VAL CA C 13 59.377 0.031 . 1 . . . . . 70 VAL CA . 28014 1 783 . 1 . 1 70 70 VAL CB C 13 34.121 0.038 . 1 . . . . . 70 VAL CB . 28014 1 784 . 1 . 1 70 70 VAL CG1 C 13 21.622 0.042 . 2 . . . . . 70 VAL CG1 . 28014 1 785 . 1 . 1 70 70 VAL CG2 C 13 18.018 0.056 . 2 . . . . . 70 VAL CG2 . 28014 1 786 . 1 . 1 70 70 VAL N N 15 114.070 0.143 . 1 . . . . . 70 VAL N . 28014 1 787 . 1 . 1 71 71 ALA H H 1 8.394 0.009 . 1 . . . . . 71 ALA H . 28014 1 788 . 1 . 1 71 71 ALA HA H 1 4.298 0.006 . 1 . . . . . 71 ALA HA . 28014 1 789 . 1 . 1 71 71 ALA HB1 H 1 1.360 0.005 . 1 . . . . . 71 ALA HB1 . 28014 1 790 . 1 . 1 71 71 ALA HB2 H 1 1.360 0.005 . 1 . . . . . 71 ALA HB2 . 28014 1 791 . 1 . 1 71 71 ALA HB3 H 1 1.360 0.005 . 1 . . . . . 71 ALA HB3 . 28014 1 792 . 1 . 1 71 71 ALA C C 13 178.057 0.000 . 1 . . . . . 71 ALA C . 28014 1 793 . 1 . 1 71 71 ALA CA C 13 52.799 0.025 . 1 . . . . . 71 ALA CA . 28014 1 794 . 1 . 1 71 71 ALA CB C 13 18.946 0.105 . 1 . . . . . 71 ALA CB . 28014 1 795 . 1 . 1 71 71 ALA N N 15 123.789 0.170 . 1 . . . . . 71 ALA N . 28014 1 796 . 1 . 1 72 72 TYR H H 1 8.201 0.005 . 1 . . . . . 72 TYR H . 28014 1 797 . 1 . 1 72 72 TYR HA H 1 5.239 0.010 . 1 . . . . . 72 TYR HA . 28014 1 798 . 1 . 1 72 72 TYR HB2 H 1 2.693 0.000 . 2 . . . . . 72 TYR HB2 . 28014 1 799 . 1 . 1 72 72 TYR HB3 H 1 2.534 0.000 . 2 . . . . . 72 TYR HB3 . 28014 1 800 . 1 . 1 72 72 TYR C C 13 172.979 0.001 . 1 . . . . . 72 TYR C . 28014 1 801 . 1 . 1 72 72 TYR CA C 13 56.069 0.047 . 1 . . . . . 72 TYR CA . 28014 1 802 . 1 . 1 72 72 TYR CB C 13 41.111 0.078 . 1 . . . . . 72 TYR CB . 28014 1 803 . 1 . 1 72 72 TYR N N 15 118.316 0.190 . 1 . . . . . 72 TYR N . 28014 1 804 . 1 . 1 73 73 ASN H H 1 8.414 0.003 . 1 . . . . . 73 ASN H . 28014 1 805 . 1 . 1 73 73 ASN HA H 1 4.792 0.005 . 1 . . . . . 73 ASN HA . 28014 1 806 . 1 . 1 73 73 ASN HB2 H 1 2.621 0.000 . 2 . . . . . 73 ASN HB2 . 28014 1 807 . 1 . 1 73 73 ASN HB3 H 1 2.611 0.003 . 2 . . . . . 73 ASN HB3 . 28014 1 808 . 1 . 1 73 73 ASN HD21 H 1 7.518 0.006 . 1 . . . . . 73 ASN HD21 . 28014 1 809 . 1 . 1 73 73 ASN HD22 H 1 6.851 0.014 . 1 . . . . . 73 ASN HD22 . 28014 1 810 . 1 . 1 73 73 ASN C C 13 173.338 0.012 . 1 . . . . . 73 ASN C . 28014 1 811 . 1 . 1 73 73 ASN CA C 13 51.341 0.040 . 1 . . . . . 73 ASN CA . 28014 1 812 . 1 . 1 73 73 ASN CB C 13 41.074 0.030 . 1 . . . . . 73 ASN CB . 28014 1 813 . 1 . 1 73 73 ASN CG C 13 176.387 0.000 . 1 . . . . . 73 ASN CG . 28014 1 814 . 1 . 1 73 73 ASN N N 15 117.561 0.067 . 1 . . . . . 73 ASN N . 28014 1 815 . 1 . 1 73 73 ASN ND2 N 15 114.294 0.009 . 1 . . . . . 73 ASN ND2 . 28014 1 816 . 1 . 1 74 74 LEU H H 1 8.702 0.004 . 1 . . . . . 74 LEU H . 28014 1 817 . 1 . 1 74 74 LEU HA H 1 5.125 0.007 . 1 . . . . . 74 LEU HA . 28014 1 818 . 1 . 1 74 74 LEU HB2 H 1 1.646 0.005 . 2 . . . . . 74 LEU HB2 . 28014 1 819 . 1 . 1 74 74 LEU HB3 H 1 1.423 0.004 . 2 . . . . . 74 LEU HB3 . 28014 1 820 . 1 . 1 74 74 LEU HG H 1 1.431 0.002 . 1 . . . . . 74 LEU HG . 28014 1 821 . 1 . 1 74 74 LEU HD11 H 1 0.820 0.004 . 2 . . . . . 74 LEU HD11 . 28014 1 822 . 1 . 1 74 74 LEU HD12 H 1 0.820 0.004 . 2 . . . . . 74 LEU HD12 . 28014 1 823 . 1 . 1 74 74 LEU HD13 H 1 0.820 0.004 . 2 . . . . . 74 LEU HD13 . 28014 1 824 . 1 . 1 74 74 LEU HD21 H 1 0.841 0.010 . 2 . . . . . 74 LEU HD21 . 28014 1 825 . 1 . 1 74 74 LEU HD22 H 1 0.841 0.010 . 2 . . . . . 74 LEU HD22 . 28014 1 826 . 1 . 1 74 74 LEU HD23 H 1 0.841 0.010 . 2 . . . . . 74 LEU HD23 . 28014 1 827 . 1 . 1 74 74 LEU C C 13 176.066 0.005 . 1 . . . . . 74 LEU C . 28014 1 828 . 1 . 1 74 74 LEU CA C 13 54.442 0.032 . 1 . . . . . 74 LEU CA . 28014 1 829 . 1 . 1 74 74 LEU CB C 13 44.730 0.041 . 1 . . . . . 74 LEU CB . 28014 1 830 . 1 . 1 74 74 LEU CG C 13 27.725 0.050 . 1 . . . . . 74 LEU CG . 28014 1 831 . 1 . 1 74 74 LEU CD1 C 13 26.495 0.103 . 2 . . . . . 74 LEU CD1 . 28014 1 832 . 1 . 1 74 74 LEU CD2 C 13 25.168 0.162 . 2 . . . . . 74 LEU CD2 . 28014 1 833 . 1 . 1 74 74 LEU N N 15 124.998 0.034 . 1 . . . . . 74 LEU N . 28014 1 834 . 1 . 1 75 75 GLU H H 1 9.086 0.003 . 1 . . . . . 75 GLU H . 28014 1 835 . 1 . 1 75 75 GLU HA H 1 4.507 0.007 . 1 . . . . . 75 GLU HA . 28014 1 836 . 1 . 1 75 75 GLU HB2 H 1 1.718 0.003 . 2 . . . . . 75 GLU HB2 . 28014 1 837 . 1 . 1 75 75 GLU HB3 H 1 1.517 0.002 . 2 . . . . . 75 GLU HB3 . 28014 1 838 . 1 . 1 75 75 GLU HG2 H 1 1.941 0.002 . 2 . . . . . 75 GLU HG2 . 28014 1 839 . 1 . 1 75 75 GLU HG3 H 1 1.937 0.001 . 2 . . . . . 75 GLU HG3 . 28014 1 840 . 1 . 1 75 75 GLU C C 13 173.852 0.010 . 1 . . . . . 75 GLU C . 28014 1 841 . 1 . 1 75 75 GLU CA C 13 55.152 0.038 . 1 . . . . . 75 GLU CA . 28014 1 842 . 1 . 1 75 75 GLU CB C 13 33.531 0.040 . 1 . . . . . 75 GLU CB . 28014 1 843 . 1 . 1 75 75 GLU CG C 13 35.966 0.012 . 1 . . . . . 75 GLU CG . 28014 1 844 . 1 . 1 75 75 GLU N N 15 127.112 0.072 . 1 . . . . . 75 GLU N . 28014 1 845 . 1 . 1 76 76 VAL H H 1 8.465 0.003 . 1 . . . . . 76 VAL H . 28014 1 846 . 1 . 1 76 76 VAL HA H 1 4.778 0.006 . 1 . . . . . 76 VAL HA . 28014 1 847 . 1 . 1 76 76 VAL HB H 1 1.715 0.004 . 1 . . . . . 76 VAL HB . 28014 1 848 . 1 . 1 76 76 VAL HG11 H 1 0.670 0.005 . 2 . . . . . 76 VAL HG11 . 28014 1 849 . 1 . 1 76 76 VAL HG12 H 1 0.670 0.005 . 2 . . . . . 76 VAL HG12 . 28014 1 850 . 1 . 1 76 76 VAL HG13 H 1 0.670 0.005 . 2 . . . . . 76 VAL HG13 . 28014 1 851 . 1 . 1 76 76 VAL HG21 H 1 0.757 0.004 . 2 . . . . . 76 VAL HG21 . 28014 1 852 . 1 . 1 76 76 VAL HG22 H 1 0.757 0.004 . 2 . . . . . 76 VAL HG22 . 28014 1 853 . 1 . 1 76 76 VAL HG23 H 1 0.757 0.004 . 2 . . . . . 76 VAL HG23 . 28014 1 854 . 1 . 1 76 76 VAL C C 13 174.545 0.000 . 1 . . . . . 76 VAL C . 28014 1 855 . 1 . 1 76 76 VAL CA C 13 60.747 0.035 . 1 . . . . . 76 VAL CA . 28014 1 856 . 1 . 1 76 76 VAL CB C 13 33.335 0.097 . 1 . . . . . 76 VAL CB . 28014 1 857 . 1 . 1 76 76 VAL CG1 C 13 21.107 0.045 . 2 . . . . . 76 VAL CG1 . 28014 1 858 . 1 . 1 76 76 VAL CG2 C 13 22.261 0.049 . 2 . . . . . 76 VAL CG2 . 28014 1 859 . 1 . 1 76 76 VAL N N 15 125.472 0.058 . 1 . . . . . 76 VAL N . 28014 1 860 . 1 . 1 77 77 SER H H 1 8.797 0.004 . 1 . . . . . 77 SER H . 28014 1 861 . 1 . 1 77 77 SER HA H 1 4.833 0.006 . 1 . . . . . 77 SER HA . 28014 1 862 . 1 . 1 77 77 SER HB2 H 1 3.508 0.004 . 2 . . . . . 77 SER HB2 . 28014 1 863 . 1 . 1 77 77 SER HB3 H 1 3.405 0.003 . 2 . . . . . 77 SER HB3 . 28014 1 864 . 1 . 1 77 77 SER C C 13 172.839 0.017 . 1 . . . . . 77 SER C . 28014 1 865 . 1 . 1 77 77 SER CA C 13 56.907 0.036 . 1 . . . . . 77 SER CA . 28014 1 866 . 1 . 1 77 77 SER CB C 13 66.605 0.024 . 1 . . . . . 77 SER CB . 28014 1 867 . 1 . 1 77 77 SER N N 15 120.474 0.050 . 1 . . . . . 77 SER N . 28014 1 868 . 1 . 1 78 78 SER H H 1 8.366 0.008 . 1 . . . . . 78 SER H . 28014 1 869 . 1 . 1 78 78 SER HA H 1 5.612 0.005 . 1 . . . . . 78 SER HA . 28014 1 870 . 1 . 1 78 78 SER HB2 H 1 4.136 0.003 . 2 . . . . . 78 SER HB2 . 28014 1 871 . 1 . 1 78 78 SER HB3 H 1 3.618 0.003 . 2 . . . . . 78 SER HB3 . 28014 1 872 . 1 . 1 78 78 SER C C 13 174.060 0.000 . 1 . . . . . 78 SER C . 28014 1 873 . 1 . 1 78 78 SER CA C 13 56.434 0.029 . 1 . . . . . 78 SER CA . 28014 1 874 . 1 . 1 78 78 SER CB C 13 63.310 0.027 . 1 . . . . . 78 SER CB . 28014 1 875 . 1 . 1 78 78 SER N N 15 116.477 0.061 . 1 . . . . . 78 SER N . 28014 1 876 . 1 . 1 79 79 PRO HA H 1 4.227 0.004 . 1 . . . . . 79 PRO HA . 28014 1 877 . 1 . 1 79 79 PRO HB2 H 1 1.902 0.000 . 2 . . . . . 79 PRO HB2 . 28014 1 878 . 1 . 1 79 79 PRO HB3 H 1 1.910 0.005 . 2 . . . . . 79 PRO HB3 . 28014 1 879 . 1 . 1 79 79 PRO HG2 H 1 1.998 0.006 . 1 . . . . . 79 PRO HG2 . 28014 1 880 . 1 . 1 79 79 PRO HD2 H 1 4.445 0.000 . 2 . . . . . 79 PRO HD2 . 28014 1 881 . 1 . 1 79 79 PRO HD3 H 1 3.714 0.006 . 2 . . . . . 79 PRO HD3 . 28014 1 882 . 1 . 1 79 79 PRO C C 13 176.321 0.000 . 1 . . . . . 79 PRO C . 28014 1 883 . 1 . 1 79 79 PRO CA C 13 64.127 0.036 . 1 . . . . . 79 PRO CA . 28014 1 884 . 1 . 1 79 79 PRO CB C 13 32.662 0.093 . 1 . . . . . 79 PRO CB . 28014 1 885 . 1 . 1 79 79 PRO CG C 13 28.390 0.059 . 1 . . . . . 79 PRO CG . 28014 1 886 . 1 . 1 79 79 PRO CD C 13 50.442 0.046 . 1 . . . . . 79 PRO CD . 28014 1 887 . 1 . 1 80 80 GLY H H 1 8.062 0.006 . 1 . . . . . 80 GLY H . 28014 1 888 . 1 . 1 80 80 GLY HA2 H 1 3.974 0.001 . 2 . . . . . 80 GLY HA2 . 28014 1 889 . 1 . 1 80 80 GLY HA3 H 1 3.823 0.006 . 2 . . . . . 80 GLY HA3 . 28014 1 890 . 1 . 1 80 80 GLY C C 13 173.921 0.007 . 1 . . . . . 80 GLY C . 28014 1 891 . 1 . 1 80 80 GLY CA C 13 43.892 0.034 . 1 . . . . . 80 GLY CA . 28014 1 892 . 1 . 1 80 80 GLY N N 15 105.753 0.084 . 1 . . . . . 80 GLY N . 28014 1 893 . 1 . 1 81 81 LEU H H 1 8.539 0.010 . 1 . . . . . 81 LEU H . 28014 1 894 . 1 . 1 81 81 LEU HA H 1 3.961 0.004 . 1 . . . . . 81 LEU HA . 28014 1 895 . 1 . 1 81 81 LEU HB2 H 1 1.573 0.001 . 2 . . . . . 81 LEU HB2 . 28014 1 896 . 1 . 1 81 81 LEU HB3 H 1 1.295 0.007 . 2 . . . . . 81 LEU HB3 . 28014 1 897 . 1 . 1 81 81 LEU HG H 1 1.620 0.011 . 1 . . . . . 81 LEU HG . 28014 1 898 . 1 . 1 81 81 LEU HD11 H 1 0.845 0.003 . 2 . . . . . 81 LEU HD11 . 28014 1 899 . 1 . 1 81 81 LEU HD12 H 1 0.845 0.003 . 2 . . . . . 81 LEU HD12 . 28014 1 900 . 1 . 1 81 81 LEU HD13 H 1 0.845 0.003 . 2 . . . . . 81 LEU HD13 . 28014 1 901 . 1 . 1 81 81 LEU HD21 H 1 0.769 0.004 . 2 . . . . . 81 LEU HD21 . 28014 1 902 . 1 . 1 81 81 LEU HD22 H 1 0.769 0.004 . 2 . . . . . 81 LEU HD22 . 28014 1 903 . 1 . 1 81 81 LEU HD23 H 1 0.769 0.004 . 2 . . . . . 81 LEU HD23 . 28014 1 904 . 1 . 1 81 81 LEU C C 13 178.206 0.000 . 1 . . . . . 81 LEU C . 28014 1 905 . 1 . 1 81 81 LEU CA C 13 56.768 0.033 . 1 . . . . . 81 LEU CA . 28014 1 906 . 1 . 1 81 81 LEU CB C 13 41.754 0.040 . 1 . . . . . 81 LEU CB . 28014 1 907 . 1 . 1 81 81 LEU CG C 13 27.090 0.109 . 1 . . . . . 81 LEU CG . 28014 1 908 . 1 . 1 81 81 LEU CD1 C 13 25.255 0.026 . 2 . . . . . 81 LEU CD1 . 28014 1 909 . 1 . 1 81 81 LEU CD2 C 13 22.634 0.021 . 2 . . . . . 81 LEU CD2 . 28014 1 910 . 1 . 1 81 81 LEU N N 15 119.390 0.124 . 1 . . . . . 81 LEU N . 28014 1 911 . 1 . 1 82 82 ASP H H 1 8.955 0.003 . 1 . . . . . 82 ASP H . 28014 1 912 . 1 . 1 82 82 ASP HA H 1 4.557 0.008 . 1 . . . . . 82 ASP HA . 28014 1 913 . 1 . 1 82 82 ASP HB2 H 1 2.551 0.000 . 2 . . . . . 82 ASP HB2 . 28014 1 914 . 1 . 1 82 82 ASP HB3 H 1 2.042 0.000 . 2 . . . . . 82 ASP HB3 . 28014 1 915 . 1 . 1 82 82 ASP C C 13 175.962 0.003 . 1 . . . . . 82 ASP C . 28014 1 916 . 1 . 1 82 82 ASP CA C 13 51.211 0.051 . 1 . . . . . 82 ASP CA . 28014 1 917 . 1 . 1 82 82 ASP CB C 13 37.626 0.044 . 1 . . . . . 82 ASP CB . 28014 1 918 . 1 . 1 82 82 ASP N N 15 118.680 0.087 . 1 . . . . . 82 ASP N . 28014 1 919 . 1 . 1 83 83 ARG H H 1 6.460 0.011 . 1 . . . . . 83 ARG H . 28014 1 920 . 1 . 1 83 83 ARG HA H 1 3.900 0.006 . 1 . . . . . 83 ARG HA . 28014 1 921 . 1 . 1 83 83 ARG HB2 H 1 1.352 0.000 . 2 . . . . . 83 ARG HB2 . 28014 1 922 . 1 . 1 83 83 ARG HB3 H 1 1.285 0.002 . 2 . . . . . 83 ARG HB3 . 28014 1 923 . 1 . 1 83 83 ARG HG2 H 1 1.079 0.016 . 2 . . . . . 83 ARG HG2 . 28014 1 924 . 1 . 1 83 83 ARG HG3 H 1 1.050 0.000 . 2 . . . . . 83 ARG HG3 . 28014 1 925 . 1 . 1 83 83 ARG HD2 H 1 2.817 0.000 . 2 . . . . . 83 ARG HD2 . 28014 1 926 . 1 . 1 83 83 ARG HD3 H 1 2.631 0.000 . 2 . . . . . 83 ARG HD3 . 28014 1 927 . 1 . 1 83 83 ARG C C 13 172.802 0.000 . 1 . . . . . 83 ARG C . 28014 1 928 . 1 . 1 83 83 ARG CA C 13 54.269 0.077 . 1 . . . . . 83 ARG CA . 28014 1 929 . 1 . 1 83 83 ARG CB C 13 31.318 0.074 . 1 . . . . . 83 ARG CB . 28014 1 930 . 1 . 1 83 83 ARG CG C 13 26.158 0.042 . 1 . . . . . 83 ARG CG . 28014 1 931 . 1 . 1 83 83 ARG CD C 13 43.856 0.013 . 1 . . . . . 83 ARG CD . 28014 1 932 . 1 . 1 83 83 ARG N N 15 118.849 0.076 . 1 . . . . . 83 ARG N . 28014 1 933 . 1 . 1 84 84 PRO HA H 1 4.828 0.004 . 1 . . . . . 84 PRO HA . 28014 1 934 . 1 . 1 84 84 PRO HB2 H 1 1.647 0.013 . 2 . . . . . 84 PRO HB2 . 28014 1 935 . 1 . 1 84 84 PRO HB3 H 1 1.049 0.000 . 2 . . . . . 84 PRO HB3 . 28014 1 936 . 1 . 1 84 84 PRO C C 13 175.202 0.000 . 1 . . . . . 84 PRO C . 28014 1 937 . 1 . 1 84 84 PRO CA C 13 61.311 0.047 . 1 . . . . . 84 PRO CA . 28014 1 938 . 1 . 1 84 84 PRO CB C 13 31.925 0.057 . 1 . . . . . 84 PRO CB . 28014 1 939 . 1 . 1 84 84 PRO CG C 13 25.673 0.000 . 1 . . . . . 84 PRO CG . 28014 1 940 . 1 . 1 85 85 LEU H H 1 7.109 0.006 . 1 . . . . . 85 LEU H . 28014 1 941 . 1 . 1 85 85 LEU HA H 1 4.211 0.002 . 1 . . . . . 85 LEU HA . 28014 1 942 . 1 . 1 85 85 LEU HG H 1 0.991 0.004 . 1 . . . . . 85 LEU HG . 28014 1 943 . 1 . 1 85 85 LEU HD11 H 1 0.067 0.011 . 2 . . . . . 85 LEU HD11 . 28014 1 944 . 1 . 1 85 85 LEU HD12 H 1 0.067 0.011 . 2 . . . . . 85 LEU HD12 . 28014 1 945 . 1 . 1 85 85 LEU HD13 H 1 0.067 0.011 . 2 . . . . . 85 LEU HD13 . 28014 1 946 . 1 . 1 85 85 LEU HD21 H 1 0.081 0.003 . 2 . . . . . 85 LEU HD21 . 28014 1 947 . 1 . 1 85 85 LEU HD22 H 1 0.081 0.003 . 2 . . . . . 85 LEU HD22 . 28014 1 948 . 1 . 1 85 85 LEU HD23 H 1 0.081 0.003 . 2 . . . . . 85 LEU HD23 . 28014 1 949 . 1 . 1 85 85 LEU CA C 13 53.828 0.068 . 1 . . . . . 85 LEU CA . 28014 1 950 . 1 . 1 85 85 LEU CB C 13 43.036 0.052 . 1 . . . . . 85 LEU CB . 28014 1 951 . 1 . 1 85 85 LEU CG C 13 27.215 0.078 . 1 . . . . . 85 LEU CG . 28014 1 952 . 1 . 1 85 85 LEU CD1 C 13 25.907 0.063 . 2 . . . . . 85 LEU CD1 . 28014 1 953 . 1 . 1 85 85 LEU CD2 C 13 24.413 0.038 . 2 . . . . . 85 LEU CD2 . 28014 1 954 . 1 . 1 85 85 LEU N N 15 117.969 0.106 . 1 . . . . . 85 LEU N . 28014 1 955 . 1 . 1 86 86 PHE HA H 1 4.875 0.007 . 1 . . . . . 86 PHE HA . 28014 1 956 . 1 . 1 86 86 PHE HB2 H 1 3.418 0.009 . 2 . . . . . 86 PHE HB2 . 28014 1 957 . 1 . 1 86 86 PHE HB3 H 1 3.032 0.017 . 2 . . . . . 86 PHE HB3 . 28014 1 958 . 1 . 1 86 86 PHE C C 13 175.581 0.000 . 1 . . . . . 86 PHE C . 28014 1 959 . 1 . 1 86 86 PHE CA C 13 59.567 0.057 . 1 . . . . . 86 PHE CA . 28014 1 960 . 1 . 1 86 86 PHE CB C 13 43.758 0.035 . 1 . . . . . 86 PHE CB . 28014 1 961 . 1 . 1 87 87 THR H H 1 7.582 0.005 . 1 . . . . . 87 THR H . 28014 1 962 . 1 . 1 87 87 THR HA H 1 4.723 0.007 . 1 . . . . . 87 THR HA . 28014 1 963 . 1 . 1 87 87 THR HB H 1 4.420 0.002 . 1 . . . . . 87 THR HB . 28014 1 964 . 1 . 1 87 87 THR HG21 H 1 1.011 0.006 . 1 . . . . . 87 THR HG21 . 28014 1 965 . 1 . 1 87 87 THR HG22 H 1 1.011 0.006 . 1 . . . . . 87 THR HG22 . 28014 1 966 . 1 . 1 87 87 THR HG23 H 1 1.011 0.006 . 1 . . . . . 87 THR HG23 . 28014 1 967 . 1 . 1 87 87 THR C C 13 174.830 0.002 . 1 . . . . . 87 THR C . 28014 1 968 . 1 . 1 87 87 THR CA C 13 59.017 0.082 . 1 . . . . . 87 THR CA . 28014 1 969 . 1 . 1 87 87 THR CB C 13 71.408 0.045 . 1 . . . . . 87 THR CB . 28014 1 970 . 1 . 1 87 87 THR CG2 C 13 21.368 0.042 . 1 . . . . . 87 THR CG2 . 28014 1 971 . 1 . 1 87 87 THR N N 15 110.201 0.098 . 1 . . . . . 87 THR N . 28014 1 972 . 1 . 1 88 88 ALA H H 1 9.088 0.005 . 1 . . . . . 88 ALA H . 28014 1 973 . 1 . 1 88 88 ALA HA H 1 3.959 0.007 . 1 . . . . . 88 ALA HA . 28014 1 974 . 1 . 1 88 88 ALA HB1 H 1 1.335 0.006 . 1 . . . . . 88 ALA HB1 . 28014 1 975 . 1 . 1 88 88 ALA HB2 H 1 1.335 0.006 . 1 . . . . . 88 ALA HB2 . 28014 1 976 . 1 . 1 88 88 ALA HB3 H 1 1.335 0.006 . 1 . . . . . 88 ALA HB3 . 28014 1 977 . 1 . 1 88 88 ALA C C 13 179.178 0.004 . 1 . . . . . 88 ALA C . 28014 1 978 . 1 . 1 88 88 ALA CA C 13 56.122 0.035 . 1 . . . . . 88 ALA CA . 28014 1 979 . 1 . 1 88 88 ALA CB C 13 17.991 0.031 . 1 . . . . . 88 ALA CB . 28014 1 980 . 1 . 1 88 88 ALA N N 15 123.359 0.080 . 1 . . . . . 88 ALA N . 28014 1 981 . 1 . 1 89 89 GLU H H 1 8.159 0.007 . 1 . . . . . 89 GLU H . 28014 1 982 . 1 . 1 89 89 GLU HA H 1 3.913 0.004 . 1 . . . . . 89 GLU HA . 28014 1 983 . 1 . 1 89 89 GLU HB2 H 1 1.880 0.003 . 2 . . . . . 89 GLU HB2 . 28014 1 984 . 1 . 1 89 89 GLU HB3 H 1 1.816 0.001 . 2 . . . . . 89 GLU HB3 . 28014 1 985 . 1 . 1 89 89 GLU HG2 H 1 2.230 0.001 . 1 . . . . . 89 GLU HG2 . 28014 1 986 . 1 . 1 89 89 GLU C C 13 179.216 0.000 . 1 . . . . . 89 GLU C . 28014 1 987 . 1 . 1 89 89 GLU CA C 13 59.703 0.041 . 1 . . . . . 89 GLU CA . 28014 1 988 . 1 . 1 89 89 GLU CB C 13 28.893 0.059 . 1 . . . . . 89 GLU CB . 28014 1 989 . 1 . 1 89 89 GLU CG C 13 36.816 0.028 . 1 . . . . . 89 GLU CG . 28014 1 990 . 1 . 1 89 89 GLU N N 15 115.855 0.094 . 1 . . . . . 89 GLU N . 28014 1 991 . 1 . 1 90 90 HIS H H 1 7.662 0.003 . 1 . . . . . 90 HIS H . 28014 1 992 . 1 . 1 90 90 HIS HA H 1 4.328 0.007 . 1 . . . . . 90 HIS HA . 28014 1 993 . 1 . 1 90 90 HIS HB2 H 1 3.559 0.004 . 2 . . . . . 90 HIS HB2 . 28014 1 994 . 1 . 1 90 90 HIS HB3 H 1 3.056 0.002 . 2 . . . . . 90 HIS HB3 . 28014 1 995 . 1 . 1 90 90 HIS C C 13 177.170 0.001 . 1 . . . . . 90 HIS C . 28014 1 996 . 1 . 1 90 90 HIS CA C 13 57.835 0.025 . 1 . . . . . 90 HIS CA . 28014 1 997 . 1 . 1 90 90 HIS CB C 13 31.963 0.057 . 1 . . . . . 90 HIS CB . 28014 1 998 . 1 . 1 90 90 HIS N N 15 119.776 0.045 . 1 . . . . . 90 HIS N . 28014 1 999 . 1 . 1 91 91 TYR H H 1 7.452 0.005 . 1 . . . . . 91 TYR H . 28014 1 1000 . 1 . 1 91 91 TYR HA H 1 3.818 0.010 . 1 . . . . . 91 TYR HA . 28014 1 1001 . 1 . 1 91 91 TYR HB2 H 1 2.969 0.000 . 1 . . . . . 91 TYR HB2 . 28014 1 1002 . 1 . 1 91 91 TYR C C 13 177.374 0.000 . 1 . . . . . 91 TYR C . 28014 1 1003 . 1 . 1 91 91 TYR CA C 13 62.945 0.036 . 1 . . . . . 91 TYR CA . 28014 1 1004 . 1 . 1 91 91 TYR CB C 13 38.729 0.149 . 1 . . . . . 91 TYR CB . 28014 1 1005 . 1 . 1 91 91 TYR N N 15 115.453 0.043 . 1 . . . . . 91 TYR N . 28014 1 1006 . 1 . 1 92 92 ALA H H 1 7.952 0.003 . 1 . . . . . 92 ALA H . 28014 1 1007 . 1 . 1 92 92 ALA HA H 1 3.802 0.005 . 1 . . . . . 92 ALA HA . 28014 1 1008 . 1 . 1 92 92 ALA HB1 H 1 1.358 0.012 . 1 . . . . . 92 ALA HB1 . 28014 1 1009 . 1 . 1 92 92 ALA HB2 H 1 1.358 0.012 . 1 . . . . . 92 ALA HB2 . 28014 1 1010 . 1 . 1 92 92 ALA HB3 H 1 1.358 0.012 . 1 . . . . . 92 ALA HB3 . 28014 1 1011 . 1 . 1 92 92 ALA C C 13 180.090 0.008 . 1 . . . . . 92 ALA C . 28014 1 1012 . 1 . 1 92 92 ALA CA C 13 54.545 0.064 . 1 . . . . . 92 ALA CA . 28014 1 1013 . 1 . 1 92 92 ALA CB C 13 17.954 0.072 . 1 . . . . . 92 ALA CB . 28014 1 1014 . 1 . 1 92 92 ALA N N 15 118.097 0.040 . 1 . . . . . 92 ALA N . 28014 1 1015 . 1 . 1 93 93 ARG H H 1 7.615 0.008 . 1 . . . . . 93 ARG H . 28014 1 1016 . 1 . 1 93 93 ARG HA H 1 3.804 0.004 . 1 . . . . . 93 ARG HA . 28014 1 1017 . 1 . 1 93 93 ARG HB2 H 1 1.570 0.006 . 2 . . . . . 93 ARG HB2 . 28014 1 1018 . 1 . 1 93 93 ARG HB3 H 1 1.346 0.008 . 2 . . . . . 93 ARG HB3 . 28014 1 1019 . 1 . 1 93 93 ARG HG2 H 1 1.202 0.001 . 2 . . . . . 93 ARG HG2 . 28014 1 1020 . 1 . 1 93 93 ARG HG3 H 1 0.633 0.005 . 2 . . . . . 93 ARG HG3 . 28014 1 1021 . 1 . 1 93 93 ARG HD2 H 1 2.811 0.000 . 2 . . . . . 93 ARG HD2 . 28014 1 1022 . 1 . 1 93 93 ARG HD3 H 1 2.638 0.000 . 2 . . . . . 93 ARG HD3 . 28014 1 1023 . 1 . 1 93 93 ARG C C 13 177.120 0.012 . 1 . . . . . 93 ARG C . 28014 1 1024 . 1 . 1 93 93 ARG CA C 13 57.883 0.023 . 1 . . . . . 93 ARG CA . 28014 1 1025 . 1 . 1 93 93 ARG CB C 13 30.107 0.059 . 1 . . . . . 93 ARG CB . 28014 1 1026 . 1 . 1 93 93 ARG CG C 13 26.110 0.044 . 1 . . . . . 93 ARG CG . 28014 1 1027 . 1 . 1 93 93 ARG CD C 13 43.820 0.069 . 1 . . . . . 93 ARG CD . 28014 1 1028 . 1 . 1 93 93 ARG N N 15 117.715 0.057 . 1 . . . . . 93 ARG N . 28014 1 1029 . 1 . 1 94 94 PHE H H 1 7.221 0.008 . 1 . . . . . 94 PHE H . 28014 1 1030 . 1 . 1 94 94 PHE HA H 1 4.713 0.008 . 1 . . . . . 94 PHE HA . 28014 1 1031 . 1 . 1 94 94 PHE HB2 H 1 3.337 0.005 . 2 . . . . . 94 PHE HB2 . 28014 1 1032 . 1 . 1 94 94 PHE HB3 H 1 2.253 0.010 . 2 . . . . . 94 PHE HB3 . 28014 1 1033 . 1 . 1 94 94 PHE HD1 H 1 6.977 0.000 . 1 . . . . . 94 PHE HD1 . 28014 1 1034 . 1 . 1 94 94 PHE HD2 H 1 6.977 0.000 . 1 . . . . . 94 PHE HD2 . 28014 1 1035 . 1 . 1 94 94 PHE C C 13 173.513 0.000 . 1 . . . . . 94 PHE C . 28014 1 1036 . 1 . 1 94 94 PHE CA C 13 57.291 0.143 . 1 . . . . . 94 PHE CA . 28014 1 1037 . 1 . 1 94 94 PHE CB C 13 38.771 0.041 . 1 . . . . . 94 PHE CB . 28014 1 1038 . 1 . 1 94 94 PHE N N 15 115.755 0.069 . 1 . . . . . 94 PHE N . 28014 1 1039 . 1 . 1 95 95 VAL H H 1 6.671 0.005 . 1 . . . . . 95 VAL H . 28014 1 1040 . 1 . 1 95 95 VAL HA H 1 3.407 0.004 . 1 . . . . . 95 VAL HA . 28014 1 1041 . 1 . 1 95 95 VAL HB H 1 1.842 0.007 . 1 . . . . . 95 VAL HB . 28014 1 1042 . 1 . 1 95 95 VAL HG11 H 1 0.959 0.003 . 2 . . . . . 95 VAL HG11 . 28014 1 1043 . 1 . 1 95 95 VAL HG12 H 1 0.959 0.003 . 2 . . . . . 95 VAL HG12 . 28014 1 1044 . 1 . 1 95 95 VAL HG13 H 1 0.959 0.003 . 2 . . . . . 95 VAL HG13 . 28014 1 1045 . 1 . 1 95 95 VAL HG21 H 1 0.854 0.010 . 2 . . . . . 95 VAL HG21 . 28014 1 1046 . 1 . 1 95 95 VAL HG22 H 1 0.854 0.010 . 2 . . . . . 95 VAL HG22 . 28014 1 1047 . 1 . 1 95 95 VAL HG23 H 1 0.854 0.010 . 2 . . . . . 95 VAL HG23 . 28014 1 1048 . 1 . 1 95 95 VAL C C 13 177.400 0.009 . 1 . . . . . 95 VAL C . 28014 1 1049 . 1 . 1 95 95 VAL CA C 13 65.452 0.041 . 1 . . . . . 95 VAL CA . 28014 1 1050 . 1 . 1 95 95 VAL CB C 13 31.769 0.051 . 1 . . . . . 95 VAL CB . 28014 1 1051 . 1 . 1 95 95 VAL CG1 C 13 22.333 0.037 . 2 . . . . . 95 VAL CG1 . 28014 1 1052 . 1 . 1 95 95 VAL CG2 C 13 21.400 0.157 . 2 . . . . . 95 VAL CG2 . 28014 1 1053 . 1 . 1 95 95 VAL N N 15 118.836 0.069 . 1 . . . . . 95 VAL N . 28014 1 1054 . 1 . 1 96 96 GLY H H 1 9.285 0.003 . 1 . . . . . 96 GLY H . 28014 1 1055 . 1 . 1 96 96 GLY HA2 H 1 4.429 0.012 . 2 . . . . . 96 GLY HA2 . 28014 1 1056 . 1 . 1 96 96 GLY HA3 H 1 3.466 0.006 . 2 . . . . . 96 GLY HA3 . 28014 1 1057 . 1 . 1 96 96 GLY C C 13 174.350 0.000 . 1 . . . . . 96 GLY C . 28014 1 1058 . 1 . 1 96 96 GLY CA C 13 44.765 0.036 . 1 . . . . . 96 GLY CA . 28014 1 1059 . 1 . 1 96 96 GLY N N 15 116.146 0.041 . 1 . . . . . 96 GLY N . 28014 1 1060 . 1 . 1 97 97 GLU H H 1 8.331 0.004 . 1 . . . . . 97 GLU H . 28014 1 1061 . 1 . 1 97 97 GLU HA H 1 4.625 0.008 . 1 . . . . . 97 GLU HA . 28014 1 1062 . 1 . 1 97 97 GLU HB2 H 1 2.241 0.003 . 2 . . . . . 97 GLU HB2 . 28014 1 1063 . 1 . 1 97 97 GLU HB3 H 1 2.096 0.007 . 2 . . . . . 97 GLU HB3 . 28014 1 1064 . 1 . 1 97 97 GLU HG2 H 1 2.194 0.008 . 1 . . . . . 97 GLU HG2 . 28014 1 1065 . 1 . 1 97 97 GLU C C 13 175.154 0.005 . 1 . . . . . 97 GLU C . 28014 1 1066 . 1 . 1 97 97 GLU CA C 13 54.324 0.067 . 1 . . . . . 97 GLU CA . 28014 1 1067 . 1 . 1 97 97 GLU CB C 13 30.850 0.088 . 1 . . . . . 97 GLU CB . 28014 1 1068 . 1 . 1 97 97 GLU CG C 13 35.946 0.039 . 1 . . . . . 97 GLU CG . 28014 1 1069 . 1 . 1 97 97 GLU N N 15 119.171 0.104 . 1 . . . . . 97 GLU N . 28014 1 1070 . 1 . 1 98 98 GLU H H 1 8.697 0.003 . 1 . . . . . 98 GLU H . 28014 1 1071 . 1 . 1 98 98 GLU HA H 1 4.740 0.005 . 1 . . . . . 98 GLU HA . 28014 1 1072 . 1 . 1 98 98 GLU HB2 H 1 1.929 0.003 . 2 . . . . . 98 GLU HB2 . 28014 1 1073 . 1 . 1 98 98 GLU HB3 H 1 1.853 0.003 . 2 . . . . . 98 GLU HB3 . 28014 1 1074 . 1 . 1 98 98 GLU HG2 H 1 2.145 0.010 . 2 . . . . . 98 GLU HG2 . 28014 1 1075 . 1 . 1 98 98 GLU HG3 H 1 2.009 0.005 . 2 . . . . . 98 GLU HG3 . 28014 1 1076 . 1 . 1 98 98 GLU C C 13 174.849 0.007 . 1 . . . . . 98 GLU C . 28014 1 1077 . 1 . 1 98 98 GLU CA C 13 55.857 0.054 . 1 . . . . . 98 GLU CA . 28014 1 1078 . 1 . 1 98 98 GLU CB C 13 31.117 0.041 . 1 . . . . . 98 GLU CB . 28014 1 1079 . 1 . 1 98 98 GLU CG C 13 36.972 0.069 . 1 . . . . . 98 GLU CG . 28014 1 1080 . 1 . 1 98 98 GLU N N 15 122.189 0.050 . 1 . . . . . 98 GLU N . 28014 1 1081 . 1 . 1 99 99 VAL H H 1 9.411 0.006 . 1 . . . . . 99 VAL H . 28014 1 1082 . 1 . 1 99 99 VAL HA H 1 4.955 0.008 . 1 . . . . . 99 VAL HA . 28014 1 1083 . 1 . 1 99 99 VAL HB H 1 1.698 0.003 . 1 . . . . . 99 VAL HB . 28014 1 1084 . 1 . 1 99 99 VAL HG11 H 1 0.685 0.016 . 2 . . . . . 99 VAL HG11 . 28014 1 1085 . 1 . 1 99 99 VAL HG12 H 1 0.685 0.016 . 2 . . . . . 99 VAL HG12 . 28014 1 1086 . 1 . 1 99 99 VAL HG13 H 1 0.685 0.016 . 2 . . . . . 99 VAL HG13 . 28014 1 1087 . 1 . 1 99 99 VAL HG21 H 1 0.726 0.010 . 2 . . . . . 99 VAL HG21 . 28014 1 1088 . 1 . 1 99 99 VAL HG22 H 1 0.726 0.010 . 2 . . . . . 99 VAL HG22 . 28014 1 1089 . 1 . 1 99 99 VAL HG23 H 1 0.726 0.010 . 2 . . . . . 99 VAL HG23 . 28014 1 1090 . 1 . 1 99 99 VAL C C 13 172.276 0.004 . 1 . . . . . 99 VAL C . 28014 1 1091 . 1 . 1 99 99 VAL CA C 13 58.736 0.062 . 1 . . . . . 99 VAL CA . 28014 1 1092 . 1 . 1 99 99 VAL CB C 13 37.083 0.047 . 1 . . . . . 99 VAL CB . 28014 1 1093 . 1 . 1 99 99 VAL CG1 C 13 22.383 0.048 . 2 . . . . . 99 VAL CG1 . 28014 1 1094 . 1 . 1 99 99 VAL CG2 C 13 20.804 0.084 . 2 . . . . . 99 VAL CG2 . 28014 1 1095 . 1 . 1 99 99 VAL N N 15 123.274 0.069 . 1 . . . . . 99 VAL N . 28014 1 1096 . 1 . 1 100 100 THR H H 1 8.727 0.008 . 1 . . . . . 100 THR H . 28014 1 1097 . 1 . 1 100 100 THR HA H 1 4.967 0.004 . 1 . . . . . 100 THR HA . 28014 1 1098 . 1 . 1 100 100 THR HB H 1 3.811 0.005 . 1 . . . . . 100 THR HB . 28014 1 1099 . 1 . 1 100 100 THR HG21 H 1 1.048 0.004 . 1 . . . . . 100 THR HG21 . 28014 1 1100 . 1 . 1 100 100 THR HG22 H 1 1.048 0.004 . 1 . . . . . 100 THR HG22 . 28014 1 1101 . 1 . 1 100 100 THR HG23 H 1 1.048 0.004 . 1 . . . . . 100 THR HG23 . 28014 1 1102 . 1 . 1 100 100 THR C C 13 173.734 0.000 . 1 . . . . . 100 THR C . 28014 1 1103 . 1 . 1 100 100 THR CA C 13 60.090 0.058 . 1 . . . . . 100 THR CA . 28014 1 1104 . 1 . 1 100 100 THR CB C 13 70.312 0.060 . 1 . . . . . 100 THR CB . 28014 1 1105 . 1 . 1 100 100 THR CG2 C 13 21.522 0.038 . 1 . . . . . 100 THR CG2 . 28014 1 1106 . 1 . 1 100 100 THR N N 15 119.016 0.038 . 1 . . . . . 100 THR N . 28014 1 1107 . 1 . 1 101 101 LEU H H 1 9.354 0.005 . 1 . . . . . 101 LEU H . 28014 1 1108 . 1 . 1 101 101 LEU HA H 1 5.191 0.014 . 1 . . . . . 101 LEU HA . 28014 1 1109 . 1 . 1 101 101 LEU HB2 H 1 1.576 0.005 . 2 . . . . . 101 LEU HB2 . 28014 1 1110 . 1 . 1 101 101 LEU HB3 H 1 1.197 0.017 . 2 . . . . . 101 LEU HB3 . 28014 1 1111 . 1 . 1 101 101 LEU HG H 1 1.458 0.001 . 1 . . . . . 101 LEU HG . 28014 1 1112 . 1 . 1 101 101 LEU HD11 H 1 0.616 0.005 . 2 . . . . . 101 LEU HD11 . 28014 1 1113 . 1 . 1 101 101 LEU HD12 H 1 0.616 0.005 . 2 . . . . . 101 LEU HD12 . 28014 1 1114 . 1 . 1 101 101 LEU HD13 H 1 0.616 0.005 . 2 . . . . . 101 LEU HD13 . 28014 1 1115 . 1 . 1 101 101 LEU HD21 H 1 0.141 0.003 . 2 . . . . . 101 LEU HD21 . 28014 1 1116 . 1 . 1 101 101 LEU HD22 H 1 0.141 0.003 . 2 . . . . . 101 LEU HD22 . 28014 1 1117 . 1 . 1 101 101 LEU HD23 H 1 0.141 0.003 . 2 . . . . . 101 LEU HD23 . 28014 1 1118 . 1 . 1 101 101 LEU C C 13 175.647 0.000 . 1 . . . . . 101 LEU C . 28014 1 1119 . 1 . 1 101 101 LEU CA C 13 53.582 0.069 . 1 . . . . . 101 LEU CA . 28014 1 1120 . 1 . 1 101 101 LEU CB C 13 45.963 0.061 . 1 . . . . . 101 LEU CB . 28014 1 1121 . 1 . 1 101 101 LEU CG C 13 26.136 0.019 . 1 . . . . . 101 LEU CG . 28014 1 1122 . 1 . 1 101 101 LEU CD1 C 13 25.870 0.070 . 2 . . . . . 101 LEU CD1 . 28014 1 1123 . 1 . 1 101 101 LEU CD2 C 13 25.744 0.046 . 2 . . . . . 101 LEU CD2 . 28014 1 1124 . 1 . 1 101 101 LEU N N 15 125.743 0.039 . 1 . . . . . 101 LEU N . 28014 1 1125 . 1 . 1 102 102 VAL H H 1 8.928 0.007 . 1 . . . . . 102 VAL H . 28014 1 1126 . 1 . 1 102 102 VAL HA H 1 4.792 0.012 . 1 . . . . . 102 VAL HA . 28014 1 1127 . 1 . 1 102 102 VAL HB H 1 1.825 0.004 . 1 . . . . . 102 VAL HB . 28014 1 1128 . 1 . 1 102 102 VAL HG11 H 1 0.799 0.002 . 2 . . . . . 102 VAL HG11 . 28014 1 1129 . 1 . 1 102 102 VAL HG12 H 1 0.799 0.002 . 2 . . . . . 102 VAL HG12 . 28014 1 1130 . 1 . 1 102 102 VAL HG13 H 1 0.799 0.002 . 2 . . . . . 102 VAL HG13 . 28014 1 1131 . 1 . 1 102 102 VAL HG21 H 1 0.831 0.020 . 2 . . . . . 102 VAL HG21 . 28014 1 1132 . 1 . 1 102 102 VAL HG22 H 1 0.831 0.020 . 2 . . . . . 102 VAL HG22 . 28014 1 1133 . 1 . 1 102 102 VAL HG23 H 1 0.831 0.020 . 2 . . . . . 102 VAL HG23 . 28014 1 1134 . 1 . 1 102 102 VAL C C 13 176.094 0.017 . 1 . . . . . 102 VAL C . 28014 1 1135 . 1 . 1 102 102 VAL CA C 13 61.197 0.042 . 1 . . . . . 102 VAL CA . 28014 1 1136 . 1 . 1 102 102 VAL CB C 13 33.974 0.082 . 1 . . . . . 102 VAL CB . 28014 1 1137 . 1 . 1 102 102 VAL CG1 C 13 20.913 0.007 . 2 . . . . . 102 VAL CG1 . 28014 1 1138 . 1 . 1 102 102 VAL CG2 C 13 21.032 0.094 . 2 . . . . . 102 VAL CG2 . 28014 1 1139 . 1 . 1 102 102 VAL N N 15 122.078 0.077 . 1 . . . . . 102 VAL N . 28014 1 1140 . 1 . 1 103 103 LEU H H 1 9.211 0.004 . 1 . . . . . 103 LEU H . 28014 1 1141 . 1 . 1 103 103 LEU HA H 1 5.008 0.015 . 1 . . . . . 103 LEU HA . 28014 1 1142 . 1 . 1 103 103 LEU HB2 H 1 1.829 0.002 . 2 . . . . . 103 LEU HB2 . 28014 1 1143 . 1 . 1 103 103 LEU HB3 H 1 1.562 0.020 . 2 . . . . . 103 LEU HB3 . 28014 1 1144 . 1 . 1 103 103 LEU HG H 1 1.046 0.004 . 1 . . . . . 103 LEU HG . 28014 1 1145 . 1 . 1 103 103 LEU HD11 H 1 0.389 0.006 . 2 . . . . . 103 LEU HD11 . 28014 1 1146 . 1 . 1 103 103 LEU HD12 H 1 0.389 0.006 . 2 . . . . . 103 LEU HD12 . 28014 1 1147 . 1 . 1 103 103 LEU HD13 H 1 0.389 0.006 . 2 . . . . . 103 LEU HD13 . 28014 1 1148 . 1 . 1 103 103 LEU HD21 H 1 0.386 0.005 . 2 . . . . . 103 LEU HD21 . 28014 1 1149 . 1 . 1 103 103 LEU HD22 H 1 0.386 0.005 . 2 . . . . . 103 LEU HD22 . 28014 1 1150 . 1 . 1 103 103 LEU HD23 H 1 0.386 0.005 . 2 . . . . . 103 LEU HD23 . 28014 1 1151 . 1 . 1 103 103 LEU C C 13 177.395 0.000 . 1 . . . . . 103 LEU C . 28014 1 1152 . 1 . 1 103 103 LEU CA C 13 53.580 0.055 . 1 . . . . . 103 LEU CA . 28014 1 1153 . 1 . 1 103 103 LEU CB C 13 43.590 0.055 . 1 . . . . . 103 LEU CB . 28014 1 1154 . 1 . 1 103 103 LEU CG C 13 27.330 0.039 . 1 . . . . . 103 LEU CG . 28014 1 1155 . 1 . 1 103 103 LEU CD1 C 13 22.130 0.000 . 2 . . . . . 103 LEU CD1 . 28014 1 1156 . 1 . 1 103 103 LEU CD2 C 13 22.119 0.015 . 2 . . . . . 103 LEU CD2 . 28014 1 1157 . 1 . 1 103 103 LEU N N 15 126.385 0.066 . 1 . . . . . 103 LEU N . 28014 1 1158 . 1 . 1 104 104 ARG H H 1 8.636 0.004 . 1 . . . . . 104 ARG H . 28014 1 1159 . 1 . 1 104 104 ARG HA H 1 4.090 0.007 . 1 . . . . . 104 ARG HA . 28014 1 1160 . 1 . 1 104 104 ARG HB2 H 1 1.906 0.000 . 2 . . . . . 104 ARG HB2 . 28014 1 1161 . 1 . 1 104 104 ARG HB3 H 1 1.901 0.000 . 2 . . . . . 104 ARG HB3 . 28014 1 1162 . 1 . 1 104 104 ARG HG2 H 1 1.321 0.017 . 2 . . . . . 104 ARG HG2 . 28014 1 1163 . 1 . 1 104 104 ARG HG3 H 1 1.343 0.003 . 2 . . . . . 104 ARG HG3 . 28014 1 1164 . 1 . 1 104 104 ARG HD2 H 1 3.278 0.000 . 2 . . . . . 104 ARG HD2 . 28014 1 1165 . 1 . 1 104 104 ARG HD3 H 1 3.275 0.000 . 2 . . . . . 104 ARG HD3 . 28014 1 1166 . 1 . 1 104 104 ARG C C 13 176.478 0.000 . 1 . . . . . 104 ARG C . 28014 1 1167 . 1 . 1 104 104 ARG CA C 13 59.245 0.062 . 1 . . . . . 104 ARG CA . 28014 1 1168 . 1 . 1 104 104 ARG CB C 13 29.829 0.053 . 1 . . . . . 104 ARG CB . 28014 1 1169 . 1 . 1 104 104 ARG CG C 13 29.265 0.042 . 1 . . . . . 104 ARG CG . 28014 1 1170 . 1 . 1 104 104 ARG CD C 13 43.239 0.062 . 1 . . . . . 104 ARG CD . 28014 1 1171 . 1 . 1 104 104 ARG N N 15 121.332 0.053 . 1 . . . . . 104 ARG N . 28014 1 1172 . 1 . 1 105 105 MET H H 1 8.737 0.004 . 1 . . . . . 105 MET H . 28014 1 1173 . 1 . 1 105 105 MET HA H 1 4.586 0.007 . 1 . . . . . 105 MET HA . 28014 1 1174 . 1 . 1 105 105 MET HB2 H 1 2.025 0.007 . 2 . . . . . 105 MET HB2 . 28014 1 1175 . 1 . 1 105 105 MET HB3 H 1 1.980 0.000 . 2 . . . . . 105 MET HB3 . 28014 1 1176 . 1 . 1 105 105 MET HG2 H 1 2.542 0.002 . 2 . . . . . 105 MET HG2 . 28014 1 1177 . 1 . 1 105 105 MET HG3 H 1 2.472 0.003 . 2 . . . . . 105 MET HG3 . 28014 1 1178 . 1 . 1 105 105 MET HE1 H 1 2.030 0.012 . 1 . . . . . 105 MET HE1 . 28014 1 1179 . 1 . 1 105 105 MET HE2 H 1 2.030 0.012 . 1 . . . . . 105 MET HE2 . 28014 1 1180 . 1 . 1 105 105 MET HE3 H 1 2.030 0.012 . 1 . . . . . 105 MET HE3 . 28014 1 1181 . 1 . 1 105 105 MET C C 13 174.650 0.005 . 1 . . . . . 105 MET C . 28014 1 1182 . 1 . 1 105 105 MET CA C 13 53.640 0.094 . 1 . . . . . 105 MET CA . 28014 1 1183 . 1 . 1 105 105 MET CB C 13 33.747 0.050 . 1 . . . . . 105 MET CB . 28014 1 1184 . 1 . 1 105 105 MET CG C 13 31.879 0.017 . 1 . . . . . 105 MET CG . 28014 1 1185 . 1 . 1 105 105 MET CE C 13 16.969 0.155 . 1 . . . . . 105 MET CE . 28014 1 1186 . 1 . 1 105 105 MET N N 15 118.769 0.084 . 1 . . . . . 105 MET N . 28014 1 1187 . 1 . 1 106 106 ALA H H 1 8.437 0.004 . 1 . . . . . 106 ALA H . 28014 1 1188 . 1 . 1 106 106 ALA HA H 1 3.840 0.004 . 1 . . . . . 106 ALA HA . 28014 1 1189 . 1 . 1 106 106 ALA HB1 H 1 1.122 0.003 . 1 . . . . . 106 ALA HB1 . 28014 1 1190 . 1 . 1 106 106 ALA HB2 H 1 1.122 0.003 . 1 . . . . . 106 ALA HB2 . 28014 1 1191 . 1 . 1 106 106 ALA HB3 H 1 1.122 0.003 . 1 . . . . . 106 ALA HB3 . 28014 1 1192 . 1 . 1 106 106 ALA C C 13 176.799 0.008 . 1 . . . . . 106 ALA C . 28014 1 1193 . 1 . 1 106 106 ALA CA C 13 53.211 0.048 . 1 . . . . . 106 ALA CA . 28014 1 1194 . 1 . 1 106 106 ALA CB C 13 19.040 0.051 . 1 . . . . . 106 ALA CB . 28014 1 1195 . 1 . 1 106 106 ALA N N 15 123.310 0.094 . 1 . . . . . 106 ALA N . 28014 1 1196 . 1 . 1 107 107 VAL H H 1 7.969 0.014 . 1 . . . . . 107 VAL H . 28014 1 1197 . 1 . 1 107 107 VAL HA H 1 4.266 0.003 . 1 . . . . . 107 VAL HA . 28014 1 1198 . 1 . 1 107 107 VAL HB H 1 1.969 0.002 . 1 . . . . . 107 VAL HB . 28014 1 1199 . 1 . 1 107 107 VAL HG11 H 1 1.039 0.011 . 2 . . . . . 107 VAL HG11 . 28014 1 1200 . 1 . 1 107 107 VAL HG12 H 1 1.039 0.011 . 2 . . . . . 107 VAL HG12 . 28014 1 1201 . 1 . 1 107 107 VAL HG13 H 1 1.039 0.011 . 2 . . . . . 107 VAL HG13 . 28014 1 1202 . 1 . 1 107 107 VAL HG21 H 1 0.991 0.002 . 2 . . . . . 107 VAL HG21 . 28014 1 1203 . 1 . 1 107 107 VAL HG22 H 1 0.991 0.002 . 2 . . . . . 107 VAL HG22 . 28014 1 1204 . 1 . 1 107 107 VAL HG23 H 1 0.991 0.002 . 2 . . . . . 107 VAL HG23 . 28014 1 1205 . 1 . 1 107 107 VAL C C 13 176.091 0.000 . 1 . . . . . 107 VAL C . 28014 1 1206 . 1 . 1 107 107 VAL CA C 13 61.468 0.054 . 1 . . . . . 107 VAL CA . 28014 1 1207 . 1 . 1 107 107 VAL CB C 13 35.319 0.048 . 1 . . . . . 107 VAL CB . 28014 1 1208 . 1 . 1 107 107 VAL CG1 C 13 21.332 0.142 . 2 . . . . . 107 VAL CG1 . 28014 1 1209 . 1 . 1 107 107 VAL CG2 C 13 21.028 0.043 . 2 . . . . . 107 VAL CG2 . 28014 1 1210 . 1 . 1 107 107 VAL N N 15 120.538 0.131 . 1 . . . . . 107 VAL N . 28014 1 1211 . 1 . 1 108 108 GLN H H 1 9.444 0.005 . 1 . . . . . 108 GLN H . 28014 1 1212 . 1 . 1 108 108 GLN HA H 1 3.865 0.008 . 1 . . . . . 108 GLN HA . 28014 1 1213 . 1 . 1 108 108 GLN HB2 H 1 2.396 0.005 . 2 . . . . . 108 GLN HB2 . 28014 1 1214 . 1 . 1 108 108 GLN HB3 H 1 2.343 0.022 . 2 . . . . . 108 GLN HB3 . 28014 1 1215 . 1 . 1 108 108 GLN HG2 H 1 2.370 0.018 . 2 . . . . . 108 GLN HG2 . 28014 1 1216 . 1 . 1 108 108 GLN HG3 H 1 2.312 0.000 . 2 . . . . . 108 GLN HG3 . 28014 1 1217 . 1 . 1 108 108 GLN HE21 H 1 7.325 0.004 . 1 . . . . . 108 GLN HE21 . 28014 1 1218 . 1 . 1 108 108 GLN HE22 H 1 7.067 0.002 . 1 . . . . . 108 GLN HE22 . 28014 1 1219 . 1 . 1 108 108 GLN C C 13 175.699 0.010 . 1 . . . . . 108 GLN C . 28014 1 1220 . 1 . 1 108 108 GLN CA C 13 57.134 0.049 . 1 . . . . . 108 GLN CA . 28014 1 1221 . 1 . 1 108 108 GLN CB C 13 27.285 0.069 . 1 . . . . . 108 GLN CB . 28014 1 1222 . 1 . 1 108 108 GLN CG C 13 34.502 0.073 . 1 . . . . . 108 GLN CG . 28014 1 1223 . 1 . 1 108 108 GLN CD C 13 180.993 0.000 . 1 . . . . . 108 GLN CD . 28014 1 1224 . 1 . 1 108 108 GLN N N 15 124.498 0.046 . 1 . . . . . 108 GLN N . 28014 1 1225 . 1 . 1 108 108 GLN NE2 N 15 113.077 0.021 . 1 . . . . . 108 GLN NE2 . 28014 1 1226 . 1 . 1 109 109 ASN H H 1 8.809 0.008 . 1 . . . . . 109 ASN H . 28014 1 1227 . 1 . 1 109 109 ASN HA H 1 4.048 0.019 . 1 . . . . . 109 ASN HA . 28014 1 1228 . 1 . 1 109 109 ASN HB2 H 1 3.026 0.002 . 2 . . . . . 109 ASN HB2 . 28014 1 1229 . 1 . 1 109 109 ASN HB3 H 1 2.826 0.002 . 2 . . . . . 109 ASN HB3 . 28014 1 1230 . 1 . 1 109 109 ASN HD21 H 1 7.477 0.004 . 1 . . . . . 109 ASN HD21 . 28014 1 1231 . 1 . 1 109 109 ASN HD22 H 1 6.807 0.004 . 1 . . . . . 109 ASN HD22 . 28014 1 1232 . 1 . 1 109 109 ASN C C 13 174.421 0.000 . 1 . . . . . 109 ASN C . 28014 1 1233 . 1 . 1 109 109 ASN CA C 13 54.658 0.088 . 1 . . . . . 109 ASN CA . 28014 1 1234 . 1 . 1 109 109 ASN CB C 13 38.048 0.040 . 1 . . . . . 109 ASN CB . 28014 1 1235 . 1 . 1 109 109 ASN CG C 13 178.603 0.000 . 1 . . . . . 109 ASN CG . 28014 1 1236 . 1 . 1 109 109 ASN N N 15 132.029 0.151 . 1 . . . . . 109 ASN N . 28014 1 1237 . 1 . 1 109 109 ASN ND2 N 15 113.059 0.108 . 1 . . . . . 109 ASN ND2 . 28014 1 1238 . 1 . 1 110 110 ARG H H 1 8.070 0.005 . 1 . . . . . 110 ARG H . 28014 1 1239 . 1 . 1 110 110 ARG HA H 1 4.529 0.007 . 1 . . . . . 110 ARG HA . 28014 1 1240 . 1 . 1 110 110 ARG HB2 H 1 1.517 0.008 . 2 . . . . . 110 ARG HB2 . 28014 1 1241 . 1 . 1 110 110 ARG HB3 H 1 1.368 0.006 . 2 . . . . . 110 ARG HB3 . 28014 1 1242 . 1 . 1 110 110 ARG HG2 H 1 1.213 0.010 . 2 . . . . . 110 ARG HG2 . 28014 1 1243 . 1 . 1 110 110 ARG HG3 H 1 0.517 0.007 . 2 . . . . . 110 ARG HG3 . 28014 1 1244 . 1 . 1 110 110 ARG HD2 H 1 2.125 0.002 . 2 . . . . . 110 ARG HD2 . 28014 1 1245 . 1 . 1 110 110 ARG HD3 H 1 1.548 0.000 . 2 . . . . . 110 ARG HD3 . 28014 1 1246 . 1 . 1 110 110 ARG C C 13 175.963 0.000 . 1 . . . . . 110 ARG C . 28014 1 1247 . 1 . 1 110 110 ARG CA C 13 56.276 0.065 . 1 . . . . . 110 ARG CA . 28014 1 1248 . 1 . 1 110 110 ARG CB C 13 33.274 0.063 . 1 . . . . . 110 ARG CB . 28014 1 1249 . 1 . 1 110 110 ARG CG C 13 25.997 0.079 . 1 . . . . . 110 ARG CG . 28014 1 1250 . 1 . 1 110 110 ARG CD C 13 43.033 0.050 . 1 . . . . . 110 ARG CD . 28014 1 1251 . 1 . 1 110 110 ARG N N 15 120.246 0.102 . 1 . . . . . 110 ARG N . 28014 1 1252 . 1 . 1 111 111 ARG H H 1 8.767 0.003 . 1 . . . . . 111 ARG H . 28014 1 1253 . 1 . 1 111 111 ARG HA H 1 4.539 0.008 . 1 . . . . . 111 ARG HA . 28014 1 1254 . 1 . 1 111 111 ARG HB2 H 1 2.000 0.022 . 2 . . . . . 111 ARG HB2 . 28014 1 1255 . 1 . 1 111 111 ARG HB3 H 1 1.693 0.005 . 2 . . . . . 111 ARG HB3 . 28014 1 1256 . 1 . 1 111 111 ARG HG2 H 1 1.691 0.003 . 2 . . . . . 111 ARG HG2 . 28014 1 1257 . 1 . 1 111 111 ARG HG3 H 1 1.303 0.009 . 2 . . . . . 111 ARG HG3 . 28014 1 1258 . 1 . 1 111 111 ARG HD2 H 1 3.174 0.000 . 2 . . . . . 111 ARG HD2 . 28014 1 1259 . 1 . 1 111 111 ARG HD3 H 1 3.168 0.000 . 2 . . . . . 111 ARG HD3 . 28014 1 1260 . 1 . 1 111 111 ARG C C 13 174.667 0.000 . 1 . . . . . 111 ARG C . 28014 1 1261 . 1 . 1 111 111 ARG CA C 13 57.092 0.035 . 1 . . . . . 111 ARG CA . 28014 1 1262 . 1 . 1 111 111 ARG CB C 13 32.462 0.082 . 1 . . . . . 111 ARG CB . 28014 1 1263 . 1 . 1 111 111 ARG CG C 13 29.165 0.022 . 1 . . . . . 111 ARG CG . 28014 1 1264 . 1 . 1 111 111 ARG CD C 13 43.322 0.032 . 1 . . . . . 111 ARG CD . 28014 1 1265 . 1 . 1 111 111 ARG N N 15 127.803 0.043 . 1 . . . . . 111 ARG N . 28014 1 1266 . 1 . 1 112 112 LYS H H 1 7.609 0.004 . 1 . . . . . 112 LYS H . 28014 1 1267 . 1 . 1 112 112 LYS HA H 1 5.315 0.008 . 1 . . . . . 112 LYS HA . 28014 1 1268 . 1 . 1 112 112 LYS HB2 H 1 1.704 0.001 . 2 . . . . . 112 LYS HB2 . 28014 1 1269 . 1 . 1 112 112 LYS HB3 H 1 1.581 0.000 . 2 . . . . . 112 LYS HB3 . 28014 1 1270 . 1 . 1 112 112 LYS HG2 H 1 1.325 0.003 . 2 . . . . . 112 LYS HG2 . 28014 1 1271 . 1 . 1 112 112 LYS HG3 H 1 1.188 0.005 . 2 . . . . . 112 LYS HG3 . 28014 1 1272 . 1 . 1 112 112 LYS HD2 H 1 1.556 0.000 . 2 . . . . . 112 LYS HD2 . 28014 1 1273 . 1 . 1 112 112 LYS HD3 H 1 1.555 0.000 . 2 . . . . . 112 LYS HD3 . 28014 1 1274 . 1 . 1 112 112 LYS HE2 H 1 2.796 0.000 . 2 . . . . . 112 LYS HE2 . 28014 1 1275 . 1 . 1 112 112 LYS HE3 H 1 2.790 0.000 . 2 . . . . . 112 LYS HE3 . 28014 1 1276 . 1 . 1 112 112 LYS C C 13 174.751 0.000 . 1 . . . . . 112 LYS C . 28014 1 1277 . 1 . 1 112 112 LYS CA C 13 55.636 0.058 . 1 . . . . . 112 LYS CA . 28014 1 1278 . 1 . 1 112 112 LYS CB C 13 33.509 0.039 . 1 . . . . . 112 LYS CB . 28014 1 1279 . 1 . 1 112 112 LYS CG C 13 25.240 0.039 . 1 . . . . . 112 LYS CG . 28014 1 1280 . 1 . 1 112 112 LYS CD C 13 29.408 0.056 . 1 . . . . . 112 LYS CD . 28014 1 1281 . 1 . 1 112 112 LYS CE C 13 41.915 0.003 . 1 . . . . . 112 LYS CE . 28014 1 1282 . 1 . 1 112 112 LYS N N 15 120.982 0.051 . 1 . . . . . 112 LYS N . 28014 1 1283 . 1 . 1 113 113 TRP H H 1 8.743 0.007 . 1 . . . . . 113 TRP H . 28014 1 1284 . 1 . 1 113 113 TRP HA H 1 4.555 0.017 . 1 . . . . . 113 TRP HA . 28014 1 1285 . 1 . 1 113 113 TRP HB2 H 1 2.394 0.006 . 2 . . . . . 113 TRP HB2 . 28014 1 1286 . 1 . 1 113 113 TRP HB3 H 1 2.857 0.004 . 2 . . . . . 113 TRP HB3 . 28014 1 1287 . 1 . 1 113 113 TRP C C 13 173.648 0.000 . 1 . . . . . 113 TRP C . 28014 1 1288 . 1 . 1 113 113 TRP CA C 13 56.099 0.039 . 1 . . . . . 113 TRP CA . 28014 1 1289 . 1 . 1 113 113 TRP CB C 13 33.393 0.073 . 1 . . . . . 113 TRP CB . 28014 1 1290 . 1 . 1 113 113 TRP N N 15 125.189 0.048 . 1 . . . . . 113 TRP N . 28014 1 1291 . 1 . 1 114 114 GLN H H 1 7.844 0.008 . 1 . . . . . 114 GLN H . 28014 1 1292 . 1 . 1 114 114 GLN HA H 1 5.594 0.006 . 1 . . . . . 114 GLN HA . 28014 1 1293 . 1 . 1 114 114 GLN HB2 H 1 2.049 0.005 . 2 . . . . . 114 GLN HB2 . 28014 1 1294 . 1 . 1 114 114 GLN HB3 H 1 1.858 0.001 . 2 . . . . . 114 GLN HB3 . 28014 1 1295 . 1 . 1 114 114 GLN HG2 H 1 2.299 0.010 . 2 . . . . . 114 GLN HG2 . 28014 1 1296 . 1 . 1 114 114 GLN HG3 H 1 2.265 0.000 . 2 . . . . . 114 GLN HG3 . 28014 1 1297 . 1 . 1 114 114 GLN HE21 H 1 7.807 0.008 . 1 . . . . . 114 GLN HE21 . 28014 1 1298 . 1 . 1 114 114 GLN HE22 H 1 6.765 0.006 . 1 . . . . . 114 GLN HE22 . 28014 1 1299 . 1 . 1 114 114 GLN C C 13 174.984 0.000 . 1 . . . . . 114 GLN C . 28014 1 1300 . 1 . 1 114 114 GLN CA C 13 54.189 0.038 . 1 . . . . . 114 GLN CA . 28014 1 1301 . 1 . 1 114 114 GLN CB C 13 31.658 0.031 . 1 . . . . . 114 GLN CB . 28014 1 1302 . 1 . 1 114 114 GLN CG C 13 33.269 0.049 . 1 . . . . . 114 GLN CG . 28014 1 1303 . 1 . 1 114 114 GLN CD C 13 180.151 0.000 . 1 . . . . . 114 GLN CD . 28014 1 1304 . 1 . 1 114 114 GLN N N 15 121.459 0.072 . 1 . . . . . 114 GLN N . 28014 1 1305 . 1 . 1 114 114 GLN NE2 N 15 113.352 0.040 . 1 . . . . . 114 GLN NE2 . 28014 1 1306 . 1 . 1 115 115 GLY H H 1 8.484 0.010 . 1 . . . . . 115 GLY H . 28014 1 1307 . 1 . 1 115 115 GLY HA2 H 1 4.419 0.009 . 2 . . . . . 115 GLY HA2 . 28014 1 1308 . 1 . 1 115 115 GLY HA3 H 1 4.220 0.003 . 2 . . . . . 115 GLY HA3 . 28014 1 1309 . 1 . 1 115 115 GLY C C 13 171.029 0.000 . 1 . . . . . 115 GLY C . 28014 1 1310 . 1 . 1 115 115 GLY CA C 13 46.045 0.077 . 1 . . . . . 115 GLY CA . 28014 1 1311 . 1 . 1 115 115 GLY N N 15 111.320 0.147 . 1 . . . . . 115 GLY N . 28014 1 1312 . 1 . 1 116 116 VAL H H 1 8.181 0.004 . 1 . . . . . 116 VAL H . 28014 1 1313 . 1 . 1 116 116 VAL HA H 1 4.422 0.007 . 1 . . . . . 116 VAL HA . 28014 1 1314 . 1 . 1 116 116 VAL HB H 1 1.751 0.006 . 1 . . . . . 116 VAL HB . 28014 1 1315 . 1 . 1 116 116 VAL HG11 H 1 0.883 0.005 . 2 . . . . . 116 VAL HG11 . 28014 1 1316 . 1 . 1 116 116 VAL HG12 H 1 0.883 0.005 . 2 . . . . . 116 VAL HG12 . 28014 1 1317 . 1 . 1 116 116 VAL HG13 H 1 0.883 0.005 . 2 . . . . . 116 VAL HG13 . 28014 1 1318 . 1 . 1 116 116 VAL HG21 H 1 0.684 0.005 . 2 . . . . . 116 VAL HG21 . 28014 1 1319 . 1 . 1 116 116 VAL HG22 H 1 0.684 0.005 . 2 . . . . . 116 VAL HG22 . 28014 1 1320 . 1 . 1 116 116 VAL HG23 H 1 0.684 0.005 . 2 . . . . . 116 VAL HG23 . 28014 1 1321 . 1 . 1 116 116 VAL C C 13 176.437 0.009 . 1 . . . . . 116 VAL C . 28014 1 1322 . 1 . 1 116 116 VAL CA C 13 61.444 0.048 . 1 . . . . . 116 VAL CA . 28014 1 1323 . 1 . 1 116 116 VAL CB C 13 34.676 0.138 . 1 . . . . . 116 VAL CB . 28014 1 1324 . 1 . 1 116 116 VAL CG1 C 13 21.977 0.027 . 2 . . . . . 116 VAL CG1 . 28014 1 1325 . 1 . 1 116 116 VAL CG2 C 13 21.007 0.044 . 2 . . . . . 116 VAL CG2 . 28014 1 1326 . 1 . 1 116 116 VAL N N 15 119.924 0.172 . 1 . . . . . 116 VAL N . 28014 1 1327 . 1 . 1 117 117 ILE H H 1 8.769 0.005 . 1 . . . . . 117 ILE H . 28014 1 1328 . 1 . 1 117 117 ILE HA H 1 3.630 0.004 . 1 . . . . . 117 ILE HA . 28014 1 1329 . 1 . 1 117 117 ILE HB H 1 2.036 0.007 . 1 . . . . . 117 ILE HB . 28014 1 1330 . 1 . 1 117 117 ILE HG12 H 1 1.932 0.007 . 2 . . . . . 117 ILE HG12 . 28014 1 1331 . 1 . 1 117 117 ILE HG13 H 1 0.684 0.009 . 2 . . . . . 117 ILE HG13 . 28014 1 1332 . 1 . 1 117 117 ILE HG21 H 1 0.849 0.009 . 1 . . . . . 117 ILE HG21 . 28014 1 1333 . 1 . 1 117 117 ILE HG22 H 1 0.849 0.009 . 1 . . . . . 117 ILE HG22 . 28014 1 1334 . 1 . 1 117 117 ILE HG23 H 1 0.849 0.009 . 1 . . . . . 117 ILE HG23 . 28014 1 1335 . 1 . 1 117 117 ILE HD11 H 1 0.797 0.011 . 1 . . . . . 117 ILE HD11 . 28014 1 1336 . 1 . 1 117 117 ILE HD12 H 1 0.797 0.011 . 1 . . . . . 117 ILE HD12 . 28014 1 1337 . 1 . 1 117 117 ILE HD13 H 1 0.797 0.011 . 1 . . . . . 117 ILE HD13 . 28014 1 1338 . 1 . 1 117 117 ILE C C 13 175.022 0.004 . 1 . . . . . 117 ILE C . 28014 1 1339 . 1 . 1 117 117 ILE CA C 13 64.763 0.055 . 1 . . . . . 117 ILE CA . 28014 1 1340 . 1 . 1 117 117 ILE CB C 13 37.674 0.075 . 1 . . . . . 117 ILE CB . 28014 1 1341 . 1 . 1 117 117 ILE CG1 C 13 29.455 0.067 . 1 . . . . . 117 ILE CG1 . 28014 1 1342 . 1 . 1 117 117 ILE CG2 C 13 17.949 0.033 . 1 . . . . . 117 ILE CG2 . 28014 1 1343 . 1 . 1 117 117 ILE CD1 C 13 13.963 0.056 . 1 . . . . . 117 ILE CD1 . 28014 1 1344 . 1 . 1 117 117 ILE N N 15 126.973 0.047 . 1 . . . . . 117 ILE N . 28014 1 1345 . 1 . 1 118 118 LYS H H 1 9.335 0.010 . 1 . . . . . 118 LYS H . 28014 1 1346 . 1 . 1 118 118 LYS HA H 1 4.493 0.021 . 1 . . . . . 118 LYS HA . 28014 1 1347 . 1 . 1 118 118 LYS HB2 H 1 1.651 0.000 . 2 . . . . . 118 LYS HB2 . 28014 1 1348 . 1 . 1 118 118 LYS HB3 H 1 1.647 0.000 . 2 . . . . . 118 LYS HB3 . 28014 1 1349 . 1 . 1 118 118 LYS HG2 H 1 1.283 0.050 . 2 . . . . . 118 LYS HG2 . 28014 1 1350 . 1 . 1 118 118 LYS HG3 H 1 1.209 0.061 . 2 . . . . . 118 LYS HG3 . 28014 1 1351 . 1 . 1 118 118 LYS HD2 H 1 1.448 0.000 . 2 . . . . . 118 LYS HD2 . 28014 1 1352 . 1 . 1 118 118 LYS HD3 H 1 1.343 0.000 . 2 . . . . . 118 LYS HD3 . 28014 1 1353 . 1 . 1 118 118 LYS HE2 H 1 2.806 0.000 . 2 . . . . . 118 LYS HE2 . 28014 1 1354 . 1 . 1 118 118 LYS HE3 H 1 2.793 0.000 . 2 . . . . . 118 LYS HE3 . 28014 1 1355 . 1 . 1 118 118 LYS C C 13 175.483 0.020 . 1 . . . . . 118 LYS C . 28014 1 1356 . 1 . 1 118 118 LYS CA C 13 56.979 0.052 . 1 . . . . . 118 LYS CA . 28014 1 1357 . 1 . 1 118 118 LYS CB C 13 35.119 0.091 . 1 . . . . . 118 LYS CB . 28014 1 1358 . 1 . 1 118 118 LYS CG C 13 25.225 0.042 . 1 . . . . . 118 LYS CG . 28014 1 1359 . 1 . 1 118 118 LYS CD C 13 29.492 0.043 . 1 . . . . . 118 LYS CD . 28014 1 1360 . 1 . 1 118 118 LYS CE C 13 42.013 0.075 . 1 . . . . . 118 LYS CE . 28014 1 1361 . 1 . 1 118 118 LYS N N 15 132.825 0.022 . 1 . . . . . 118 LYS N . 28014 1 1362 . 1 . 1 119 119 ALA H H 1 7.824 0.008 . 1 . . . . . 119 ALA H . 28014 1 1363 . 1 . 1 119 119 ALA HA H 1 4.411 0.007 . 1 . . . . . 119 ALA HA . 28014 1 1364 . 1 . 1 119 119 ALA HB1 H 1 1.223 0.006 . 1 . . . . . 119 ALA HB1 . 28014 1 1365 . 1 . 1 119 119 ALA HB2 H 1 1.223 0.006 . 1 . . . . . 119 ALA HB2 . 28014 1 1366 . 1 . 1 119 119 ALA HB3 H 1 1.223 0.006 . 1 . . . . . 119 ALA HB3 . 28014 1 1367 . 1 . 1 119 119 ALA C C 13 173.993 0.000 . 1 . . . . . 119 ALA C . 28014 1 1368 . 1 . 1 119 119 ALA CA C 13 51.926 0.045 . 1 . . . . . 119 ALA CA . 28014 1 1369 . 1 . 1 119 119 ALA CB C 13 22.323 0.094 . 1 . . . . . 119 ALA CB . 28014 1 1370 . 1 . 1 119 119 ALA N N 15 117.906 0.118 . 1 . . . . . 119 ALA N . 28014 1 1371 . 1 . 1 120 120 VAL H H 1 8.340 0.004 . 1 . . . . . 120 VAL H . 28014 1 1372 . 1 . 1 120 120 VAL HA H 1 4.349 0.009 . 1 . . . . . 120 VAL HA . 28014 1 1373 . 1 . 1 120 120 VAL HB H 1 1.749 0.001 . 1 . . . . . 120 VAL HB . 28014 1 1374 . 1 . 1 120 120 VAL HG11 H 1 0.688 0.015 . 2 . . . . . 120 VAL HG11 . 28014 1 1375 . 1 . 1 120 120 VAL HG12 H 1 0.688 0.015 . 2 . . . . . 120 VAL HG12 . 28014 1 1376 . 1 . 1 120 120 VAL HG13 H 1 0.688 0.015 . 2 . . . . . 120 VAL HG13 . 28014 1 1377 . 1 . 1 120 120 VAL HG21 H 1 0.759 0.009 . 2 . . . . . 120 VAL HG21 . 28014 1 1378 . 1 . 1 120 120 VAL HG22 H 1 0.759 0.009 . 2 . . . . . 120 VAL HG22 . 28014 1 1379 . 1 . 1 120 120 VAL HG23 H 1 0.759 0.009 . 2 . . . . . 120 VAL HG23 . 28014 1 1380 . 1 . 1 120 120 VAL C C 13 174.195 0.000 . 1 . . . . . 120 VAL C . 28014 1 1381 . 1 . 1 120 120 VAL CA C 13 61.651 0.068 . 1 . . . . . 120 VAL CA . 28014 1 1382 . 1 . 1 120 120 VAL CB C 13 34.834 0.069 . 1 . . . . . 120 VAL CB . 28014 1 1383 . 1 . 1 120 120 VAL CG1 C 13 21.106 0.036 . 2 . . . . . 120 VAL CG1 . 28014 1 1384 . 1 . 1 120 120 VAL CG2 C 13 20.551 0.065 . 2 . . . . . 120 VAL CG2 . 28014 1 1385 . 1 . 1 120 120 VAL N N 15 119.064 0.051 . 1 . . . . . 120 VAL N . 28014 1 1386 . 1 . 1 121 121 ASP H H 1 8.438 0.004 . 1 . . . . . 121 ASP H . 28014 1 1387 . 1 . 1 121 121 ASP HA H 1 4.748 0.005 . 1 . . . . . 121 ASP HA . 28014 1 1388 . 1 . 1 121 121 ASP HB2 H 1 2.483 0.001 . 2 . . . . . 121 ASP HB2 . 28014 1 1389 . 1 . 1 121 121 ASP HB3 H 1 2.384 0.010 . 2 . . . . . 121 ASP HB3 . 28014 1 1390 . 1 . 1 121 121 ASP C C 13 175.940 0.004 . 1 . . . . . 121 ASP C . 28014 1 1391 . 1 . 1 121 121 ASP CA C 13 52.901 0.041 . 1 . . . . . 121 ASP CA . 28014 1 1392 . 1 . 1 121 121 ASP CB C 13 42.361 0.047 . 1 . . . . . 121 ASP CB . 28014 1 1393 . 1 . 1 121 121 ASP N N 15 127.029 0.058 . 1 . . . . . 121 ASP N . 28014 1 1394 . 1 . 1 122 122 GLY H H 1 8.762 0.004 . 1 . . . . . 122 GLY H . 28014 1 1395 . 1 . 1 122 122 GLY HA2 H 1 3.868 0.004 . 2 . . . . . 122 GLY HA2 . 28014 1 1396 . 1 . 1 122 122 GLY HA3 H 1 3.469 0.002 . 2 . . . . . 122 GLY HA3 . 28014 1 1397 . 1 . 1 122 122 GLY C C 13 173.842 0.000 . 1 . . . . . 122 GLY C . 28014 1 1398 . 1 . 1 122 122 GLY CA C 13 47.232 0.045 . 1 . . . . . 122 GLY CA . 28014 1 1399 . 1 . 1 122 122 GLY N N 15 115.875 0.023 . 1 . . . . . 122 GLY N . 28014 1 1400 . 1 . 1 123 123 GLU H H 1 8.649 0.004 . 1 . . . . . 123 GLU H . 28014 1 1401 . 1 . 1 123 123 GLU HA H 1 4.286 0.006 . 1 . . . . . 123 GLU HA . 28014 1 1402 . 1 . 1 123 123 GLU HB2 H 1 2.209 0.003 . 2 . . . . . 123 GLU HB2 . 28014 1 1403 . 1 . 1 123 123 GLU HB3 H 1 1.957 0.006 . 2 . . . . . 123 GLU HB3 . 28014 1 1404 . 1 . 1 123 123 GLU HG2 H 1 2.185 0.000 . 2 . . . . . 123 GLU HG2 . 28014 1 1405 . 1 . 1 123 123 GLU HG3 H 1 2.116 0.000 . 2 . . . . . 123 GLU HG3 . 28014 1 1406 . 1 . 1 123 123 GLU C C 13 174.425 0.004 . 1 . . . . . 123 GLU C . 28014 1 1407 . 1 . 1 123 123 GLU CA C 13 55.541 0.047 . 1 . . . . . 123 GLU CA . 28014 1 1408 . 1 . 1 123 123 GLU CB C 13 30.052 0.072 . 1 . . . . . 123 GLU CB . 28014 1 1409 . 1 . 1 123 123 GLU CG C 13 36.202 0.085 . 1 . . . . . 123 GLU CG . 28014 1 1410 . 1 . 1 123 123 GLU N N 15 124.486 0.039 . 1 . . . . . 123 GLU N . 28014 1 1411 . 1 . 1 124 124 MET H H 1 7.998 0.010 . 1 . . . . . 124 MET H . 28014 1 1412 . 1 . 1 124 124 MET HA H 1 4.888 0.006 . 1 . . . . . 124 MET HA . 28014 1 1413 . 1 . 1 124 124 MET HB2 H 1 2.571 0.016 . 2 . . . . . 124 MET HB2 . 28014 1 1414 . 1 . 1 124 124 MET HB3 H 1 2.463 0.005 . 2 . . . . . 124 MET HB3 . 28014 1 1415 . 1 . 1 124 124 MET HG2 H 1 2.019 0.000 . 2 . . . . . 124 MET HG2 . 28014 1 1416 . 1 . 1 124 124 MET HG3 H 1 1.976 0.015 . 2 . . . . . 124 MET HG3 . 28014 1 1417 . 1 . 1 124 124 MET HE1 H 1 1.856 0.003 . 1 . . . . . 124 MET HE1 . 28014 1 1418 . 1 . 1 124 124 MET HE2 H 1 1.856 0.003 . 1 . . . . . 124 MET HE2 . 28014 1 1419 . 1 . 1 124 124 MET HE3 H 1 1.856 0.003 . 1 . . . . . 124 MET HE3 . 28014 1 1420 . 1 . 1 124 124 MET C C 13 175.450 0.004 . 1 . . . . . 124 MET C . 28014 1 1421 . 1 . 1 124 124 MET CA C 13 53.547 0.044 . 1 . . . . . 124 MET CA . 28014 1 1422 . 1 . 1 124 124 MET CB C 13 31.845 0.065 . 1 . . . . . 124 MET CB . 28014 1 1423 . 1 . 1 124 124 MET CG C 13 33.627 0.186 . 1 . . . . . 124 MET CG . 28014 1 1424 . 1 . 1 124 124 MET CE C 13 16.916 0.041 . 1 . . . . . 124 MET CE . 28014 1 1425 . 1 . 1 124 124 MET N N 15 117.921 0.073 . 1 . . . . . 124 MET N . 28014 1 1426 . 1 . 1 125 125 ILE H H 1 9.301 0.004 . 1 . . . . . 125 ILE H . 28014 1 1427 . 1 . 1 125 125 ILE HA H 1 4.384 0.006 . 1 . . . . . 125 ILE HA . 28014 1 1428 . 1 . 1 125 125 ILE HB H 1 1.640 0.008 . 1 . . . . . 125 ILE HB . 28014 1 1429 . 1 . 1 125 125 ILE HG12 H 1 0.844 0.004 . 2 . . . . . 125 ILE HG12 . 28014 1 1430 . 1 . 1 125 125 ILE HG13 H 1 0.612 0.002 . 2 . . . . . 125 ILE HG13 . 28014 1 1431 . 1 . 1 125 125 ILE HG21 H 1 0.491 0.004 . 1 . . . . . 125 ILE HG21 . 28014 1 1432 . 1 . 1 125 125 ILE HG22 H 1 0.491 0.004 . 1 . . . . . 125 ILE HG22 . 28014 1 1433 . 1 . 1 125 125 ILE HG23 H 1 0.491 0.004 . 1 . . . . . 125 ILE HG23 . 28014 1 1434 . 1 . 1 125 125 ILE HD11 H 1 0.030 0.004 . 1 . . . . . 125 ILE HD11 . 28014 1 1435 . 1 . 1 125 125 ILE HD12 H 1 0.030 0.004 . 1 . . . . . 125 ILE HD12 . 28014 1 1436 . 1 . 1 125 125 ILE HD13 H 1 0.030 0.004 . 1 . . . . . 125 ILE HD13 . 28014 1 1437 . 1 . 1 125 125 ILE C C 13 175.122 0.007 . 1 . . . . . 125 ILE C . 28014 1 1438 . 1 . 1 125 125 ILE CA C 13 59.135 0.049 . 1 . . . . . 125 ILE CA . 28014 1 1439 . 1 . 1 125 125 ILE CB C 13 39.280 0.084 . 1 . . . . . 125 ILE CB . 28014 1 1440 . 1 . 1 125 125 ILE CG1 C 13 26.816 0.034 . 1 . . . . . 125 ILE CG1 . 28014 1 1441 . 1 . 1 125 125 ILE CG2 C 13 17.774 0.024 . 1 . . . . . 125 ILE CG2 . 28014 1 1442 . 1 . 1 125 125 ILE CD1 C 13 12.407 0.042 . 1 . . . . . 125 ILE CD1 . 28014 1 1443 . 1 . 1 125 125 ILE N N 15 127.514 0.051 . 1 . . . . . 125 ILE N . 28014 1 1444 . 1 . 1 126 126 THR H H 1 8.999 0.004 . 1 . . . . . 126 THR H . 28014 1 1445 . 1 . 1 126 126 THR HA H 1 5.032 0.005 . 1 . . . . . 126 THR HA . 28014 1 1446 . 1 . 1 126 126 THR HB H 1 3.781 0.008 . 1 . . . . . 126 THR HB . 28014 1 1447 . 1 . 1 126 126 THR HG21 H 1 0.843 0.004 . 1 . . . . . 126 THR HG21 . 28014 1 1448 . 1 . 1 126 126 THR HG22 H 1 0.843 0.004 . 1 . . . . . 126 THR HG22 . 28014 1 1449 . 1 . 1 126 126 THR HG23 H 1 0.843 0.004 . 1 . . . . . 126 THR HG23 . 28014 1 1450 . 1 . 1 126 126 THR C C 13 173.967 0.000 . 1 . . . . . 126 THR C . 28014 1 1451 . 1 . 1 126 126 THR CA C 13 61.965 0.038 . 1 . . . . . 126 THR CA . 28014 1 1452 . 1 . 1 126 126 THR CB C 13 68.429 0.000 . 1 . . . . . 126 THR CB . 28014 1 1453 . 1 . 1 126 126 THR CG2 C 13 21.113 0.042 . 1 . . . . . 126 THR CG2 . 28014 1 1454 . 1 . 1 126 126 THR N N 15 123.267 0.121 . 1 . . . . . 126 THR N . 28014 1 1455 . 1 . 1 127 127 VAL H H 1 9.410 0.005 . 1 . . . . . 127 VAL H . 28014 1 1456 . 1 . 1 127 127 VAL HA H 1 4.702 0.004 . 1 . . . . . 127 VAL HA . 28014 1 1457 . 1 . 1 127 127 VAL HB H 1 1.728 0.005 . 1 . . . . . 127 VAL HB . 28014 1 1458 . 1 . 1 127 127 VAL HG11 H 1 0.481 0.005 . 2 . . . . . 127 VAL HG11 . 28014 1 1459 . 1 . 1 127 127 VAL HG12 H 1 0.481 0.005 . 2 . . . . . 127 VAL HG12 . 28014 1 1460 . 1 . 1 127 127 VAL HG13 H 1 0.481 0.005 . 2 . . . . . 127 VAL HG13 . 28014 1 1461 . 1 . 1 127 127 VAL HG21 H 1 0.692 0.006 . 2 . . . . . 127 VAL HG21 . 28014 1 1462 . 1 . 1 127 127 VAL HG22 H 1 0.692 0.006 . 2 . . . . . 127 VAL HG22 . 28014 1 1463 . 1 . 1 127 127 VAL HG23 H 1 0.692 0.006 . 2 . . . . . 127 VAL HG23 . 28014 1 1464 . 1 . 1 127 127 VAL C C 13 174.421 0.005 . 1 . . . . . 127 VAL C . 28014 1 1465 . 1 . 1 127 127 VAL CA C 13 59.765 0.067 . 1 . . . . . 127 VAL CA . 28014 1 1466 . 1 . 1 127 127 VAL CB C 13 35.395 0.066 . 1 . . . . . 127 VAL CB . 28014 1 1467 . 1 . 1 127 127 VAL CG1 C 13 20.701 0.109 . 2 . . . . . 127 VAL CG1 . 28014 1 1468 . 1 . 1 127 127 VAL CG2 C 13 21.583 0.090 . 2 . . . . . 127 VAL CG2 . 28014 1 1469 . 1 . 1 127 127 VAL N N 15 129.528 0.064 . 1 . . . . . 127 VAL N . 28014 1 1470 . 1 . 1 128 128 THR H H 1 9.611 0.004 . 1 . . . . . 128 THR H . 28014 1 1471 . 1 . 1 128 128 THR HA H 1 4.717 0.012 . 1 . . . . . 128 THR HA . 28014 1 1472 . 1 . 1 128 128 THR HB H 1 3.769 0.004 . 1 . . . . . 128 THR HB . 28014 1 1473 . 1 . 1 128 128 THR HG21 H 1 0.995 0.005 . 1 . . . . . 128 THR HG21 . 28014 1 1474 . 1 . 1 128 128 THR HG22 H 1 0.995 0.005 . 1 . . . . . 128 THR HG22 . 28014 1 1475 . 1 . 1 128 128 THR HG23 H 1 0.995 0.005 . 1 . . . . . 128 THR HG23 . 28014 1 1476 . 1 . 1 128 128 THR C C 13 174.957 0.014 . 1 . . . . . 128 THR C . 28014 1 1477 . 1 . 1 128 128 THR CA C 13 63.065 0.036 . 1 . . . . . 128 THR CA . 28014 1 1478 . 1 . 1 128 128 THR CB C 13 68.707 0.049 . 1 . . . . . 128 THR CB . 28014 1 1479 . 1 . 1 128 128 THR CG2 C 13 22.168 0.028 . 1 . . . . . 128 THR CG2 . 28014 1 1480 . 1 . 1 128 128 THR N N 15 126.029 0.049 . 1 . . . . . 128 THR N . 28014 1 1481 . 1 . 1 129 129 VAL H H 1 9.458 0.015 . 1 . . . . . 129 VAL H . 28014 1 1482 . 1 . 1 129 129 VAL HA H 1 4.505 0.008 . 1 . . . . . 129 VAL HA . 28014 1 1483 . 1 . 1 129 129 VAL HB H 1 2.410 0.007 . 1 . . . . . 129 VAL HB . 28014 1 1484 . 1 . 1 129 129 VAL HG11 H 1 1.353 0.008 . 2 . . . . . 129 VAL HG11 . 28014 1 1485 . 1 . 1 129 129 VAL HG12 H 1 1.353 0.008 . 2 . . . . . 129 VAL HG12 . 28014 1 1486 . 1 . 1 129 129 VAL HG13 H 1 1.353 0.008 . 2 . . . . . 129 VAL HG13 . 28014 1 1487 . 1 . 1 129 129 VAL HG21 H 1 1.079 0.009 . 2 . . . . . 129 VAL HG21 . 28014 1 1488 . 1 . 1 129 129 VAL HG22 H 1 1.079 0.009 . 2 . . . . . 129 VAL HG22 . 28014 1 1489 . 1 . 1 129 129 VAL HG23 H 1 1.079 0.009 . 2 . . . . . 129 VAL HG23 . 28014 1 1490 . 1 . 1 129 129 VAL C C 13 175.666 0.007 . 1 . . . . . 129 VAL C . 28014 1 1491 . 1 . 1 129 129 VAL CA C 13 61.509 0.036 . 1 . . . . . 129 VAL CA . 28014 1 1492 . 1 . 1 129 129 VAL CB C 13 33.856 0.060 . 1 . . . . . 129 VAL CB . 28014 1 1493 . 1 . 1 129 129 VAL CG1 C 13 20.637 0.132 . 2 . . . . . 129 VAL CG1 . 28014 1 1494 . 1 . 1 129 129 VAL CG2 C 13 19.930 0.091 . 2 . . . . . 129 VAL CG2 . 28014 1 1495 . 1 . 1 129 129 VAL N N 15 132.200 0.063 . 1 . . . . . 129 VAL N . 28014 1 1496 . 1 . 1 130 130 GLU H H 1 9.658 0.007 . 1 . . . . . 130 GLU H . 28014 1 1497 . 1 . 1 130 130 GLU HA H 1 3.859 0.007 . 1 . . . . . 130 GLU HA . 28014 1 1498 . 1 . 1 130 130 GLU HB2 H 1 2.234 0.004 . 2 . . . . . 130 GLU HB2 . 28014 1 1499 . 1 . 1 130 130 GLU HB3 H 1 2.039 0.003 . 2 . . . . . 130 GLU HB3 . 28014 1 1500 . 1 . 1 130 130 GLU HG2 H 1 2.330 0.005 . 2 . . . . . 130 GLU HG2 . 28014 1 1501 . 1 . 1 130 130 GLU HG3 H 1 2.312 0.000 . 2 . . . . . 130 GLU HG3 . 28014 1 1502 . 1 . 1 130 130 GLU C C 13 176.802 0.016 . 1 . . . . . 130 GLU C . 28014 1 1503 . 1 . 1 130 130 GLU CA C 13 57.151 0.067 . 1 . . . . . 130 GLU CA . 28014 1 1504 . 1 . 1 130 130 GLU CB C 13 27.335 0.048 . 1 . . . . . 130 GLU CB . 28014 1 1505 . 1 . 1 130 130 GLU CG C 13 36.694 0.051 . 1 . . . . . 130 GLU CG . 28014 1 1506 . 1 . 1 130 130 GLU N N 15 128.312 0.053 . 1 . . . . . 130 GLU N . 28014 1 1507 . 1 . 1 131 131 GLY H H 1 8.365 0.003 . 1 . . . . . 131 GLY H . 28014 1 1508 . 1 . 1 131 131 GLY HA2 H 1 4.078 0.002 . 2 . . . . . 131 GLY HA2 . 28014 1 1509 . 1 . 1 131 131 GLY HA3 H 1 3.441 0.005 . 2 . . . . . 131 GLY HA3 . 28014 1 1510 . 1 . 1 131 131 GLY C C 13 173.329 0.009 . 1 . . . . . 131 GLY C . 28014 1 1511 . 1 . 1 131 131 GLY CA C 13 45.404 0.019 . 1 . . . . . 131 GLY CA . 28014 1 1512 . 1 . 1 131 131 GLY N N 15 102.624 0.087 . 1 . . . . . 131 GLY N . 28014 1 1513 . 1 . 1 132 132 LYS H H 1 7.911 0.004 . 1 . . . . . 132 LYS H . 28014 1 1514 . 1 . 1 132 132 LYS HA H 1 4.552 0.022 . 1 . . . . . 132 LYS HA . 28014 1 1515 . 1 . 1 132 132 LYS HB2 H 1 1.835 0.002 . 2 . . . . . 132 LYS HB2 . 28014 1 1516 . 1 . 1 132 132 LYS HB3 H 1 1.712 0.006 . 2 . . . . . 132 LYS HB3 . 28014 1 1517 . 1 . 1 132 132 LYS HG2 H 1 1.305 0.000 . 2 . . . . . 132 LYS HG2 . 28014 1 1518 . 1 . 1 132 132 LYS HG3 H 1 1.291 0.004 . 2 . . . . . 132 LYS HG3 . 28014 1 1519 . 1 . 1 132 132 LYS HD2 H 1 1.656 0.000 . 2 . . . . . 132 LYS HD2 . 28014 1 1520 . 1 . 1 132 132 LYS HD3 H 1 1.648 0.000 . 2 . . . . . 132 LYS HD3 . 28014 1 1521 . 1 . 1 132 132 LYS HE2 H 1 2.994 0.000 . 2 . . . . . 132 LYS HE2 . 28014 1 1522 . 1 . 1 132 132 LYS HE3 H 1 2.990 0.000 . 2 . . . . . 132 LYS HE3 . 28014 1 1523 . 1 . 1 132 132 LYS C C 13 174.465 0.017 . 1 . . . . . 132 LYS C . 28014 1 1524 . 1 . 1 132 132 LYS CA C 13 54.604 0.061 . 1 . . . . . 132 LYS CA . 28014 1 1525 . 1 . 1 132 132 LYS CB C 13 35.196 0.049 . 1 . . . . . 132 LYS CB . 28014 1 1526 . 1 . 1 132 132 LYS CG C 13 24.844 0.000 . 1 . . . . . 132 LYS CG . 28014 1 1527 . 1 . 1 132 132 LYS CD C 13 29.175 0.037 . 1 . . . . . 132 LYS CD . 28014 1 1528 . 1 . 1 132 132 LYS CE C 13 42.227 0.035 . 1 . . . . . 132 LYS CE . 28014 1 1529 . 1 . 1 132 132 LYS N N 15 122.555 0.103 . 1 . . . . . 132 LYS N . 28014 1 1530 . 1 . 1 133 133 ASP H H 1 8.588 0.004 . 1 . . . . . 133 ASP H . 28014 1 1531 . 1 . 1 133 133 ASP HA H 1 4.617 0.002 . 1 . . . . . 133 ASP HA . 28014 1 1532 . 1 . 1 133 133 ASP HB2 H 1 2.393 0.009 . 2 . . . . . 133 ASP HB2 . 28014 1 1533 . 1 . 1 133 133 ASP HB3 H 1 1.973 0.000 . 2 . . . . . 133 ASP HB3 . 28014 1 1534 . 1 . 1 133 133 ASP C C 13 175.147 0.001 . 1 . . . . . 133 ASP C . 28014 1 1535 . 1 . 1 133 133 ASP CA C 13 54.863 0.089 . 1 . . . . . 133 ASP CA . 28014 1 1536 . 1 . 1 133 133 ASP CB C 13 39.892 0.062 . 1 . . . . . 133 ASP CB . 28014 1 1537 . 1 . 1 133 133 ASP N N 15 126.131 0.061 . 1 . . . . . 133 ASP N . 28014 1 1538 . 1 . 1 134 134 GLU H H 1 8.787 0.003 . 1 . . . . . 134 GLU H . 28014 1 1539 . 1 . 1 134 134 GLU HA H 1 4.330 0.005 . 1 . . . . . 134 GLU HA . 28014 1 1540 . 1 . 1 134 134 GLU HB2 H 1 2.540 0.000 . 2 . . . . . 134 GLU HB2 . 28014 1 1541 . 1 . 1 134 134 GLU HB3 H 1 2.469 0.000 . 2 . . . . . 134 GLU HB3 . 28014 1 1542 . 1 . 1 134 134 GLU HG2 H 1 2.029 0.000 . 2 . . . . . 134 GLU HG2 . 28014 1 1543 . 1 . 1 134 134 GLU HG3 H 1 1.976 0.000 . 2 . . . . . 134 GLU HG3 . 28014 1 1544 . 1 . 1 134 134 GLU C C 13 173.895 0.014 . 1 . . . . . 134 GLU C . 28014 1 1545 . 1 . 1 134 134 GLU CA C 13 53.706 0.036 . 1 . . . . . 134 GLU CA . 28014 1 1546 . 1 . 1 134 134 GLU CB C 13 32.050 0.062 . 1 . . . . . 134 GLU CB . 28014 1 1547 . 1 . 1 134 134 GLU CG C 13 33.893 0.010 . 1 . . . . . 134 GLU CG . 28014 1 1548 . 1 . 1 134 134 GLU N N 15 126.143 0.041 . 1 . . . . . 134 GLU N . 28014 1 1549 . 1 . 1 135 135 VAL H H 1 7.683 0.008 . 1 . . . . . 135 VAL H . 28014 1 1550 . 1 . 1 135 135 VAL HA H 1 4.576 0.007 . 1 . . . . . 135 VAL HA . 28014 1 1551 . 1 . 1 135 135 VAL HB H 1 1.469 0.001 . 1 . . . . . 135 VAL HB . 28014 1 1552 . 1 . 1 135 135 VAL HG11 H 1 0.540 0.011 . 2 . . . . . 135 VAL HG11 . 28014 1 1553 . 1 . 1 135 135 VAL HG12 H 1 0.540 0.011 . 2 . . . . . 135 VAL HG12 . 28014 1 1554 . 1 . 1 135 135 VAL HG13 H 1 0.540 0.011 . 2 . . . . . 135 VAL HG13 . 28014 1 1555 . 1 . 1 135 135 VAL HG21 H 1 0.608 0.004 . 2 . . . . . 135 VAL HG21 . 28014 1 1556 . 1 . 1 135 135 VAL HG22 H 1 0.608 0.004 . 2 . . . . . 135 VAL HG22 . 28014 1 1557 . 1 . 1 135 135 VAL HG23 H 1 0.608 0.004 . 2 . . . . . 135 VAL HG23 . 28014 1 1558 . 1 . 1 135 135 VAL C C 13 175.001 0.010 . 1 . . . . . 135 VAL C . 28014 1 1559 . 1 . 1 135 135 VAL CA C 13 60.406 0.038 . 1 . . . . . 135 VAL CA . 28014 1 1560 . 1 . 1 135 135 VAL CB C 13 33.379 0.040 . 1 . . . . . 135 VAL CB . 28014 1 1561 . 1 . 1 135 135 VAL CG1 C 13 21.651 0.094 . 2 . . . . . 135 VAL CG1 . 28014 1 1562 . 1 . 1 135 135 VAL CG2 C 13 20.514 0.051 . 2 . . . . . 135 VAL CG2 . 28014 1 1563 . 1 . 1 135 135 VAL N N 15 119.633 0.056 . 1 . . . . . 135 VAL N . 28014 1 1564 . 1 . 1 136 136 PHE H H 1 8.882 0.005 . 1 . . . . . 136 PHE H . 28014 1 1565 . 1 . 1 136 136 PHE HA H 1 4.624 0.010 . 1 . . . . . 136 PHE HA . 28014 1 1566 . 1 . 1 136 136 PHE HB2 H 1 2.681 0.004 . 2 . . . . . 136 PHE HB2 . 28014 1 1567 . 1 . 1 136 136 PHE HB3 H 1 2.206 0.003 . 2 . . . . . 136 PHE HB3 . 28014 1 1568 . 1 . 1 136 136 PHE HD1 H 1 6.669 0.000 . 1 . . . . . 136 PHE HD1 . 28014 1 1569 . 1 . 1 136 136 PHE HD2 H 1 6.669 0.000 . 1 . . . . . 136 PHE HD2 . 28014 1 1570 . 1 . 1 136 136 PHE C C 13 173.664 0.013 . 1 . . . . . 136 PHE C . 28014 1 1571 . 1 . 1 136 136 PHE CA C 13 55.424 0.061 . 1 . . . . . 136 PHE CA . 28014 1 1572 . 1 . 1 136 136 PHE CB C 13 42.299 0.055 . 1 . . . . . 136 PHE CB . 28014 1 1573 . 1 . 1 136 136 PHE N N 15 124.952 0.053 . 1 . . . . . 136 PHE N . 28014 1 1574 . 1 . 1 137 137 ALA H H 1 8.511 0.010 . 1 . . . . . 137 ALA H . 28014 1 1575 . 1 . 1 137 137 ALA HA H 1 4.876 0.003 . 1 . . . . . 137 ALA HA . 28014 1 1576 . 1 . 1 137 137 ALA HB1 H 1 1.256 0.014 . 1 . . . . . 137 ALA HB1 . 28014 1 1577 . 1 . 1 137 137 ALA HB2 H 1 1.256 0.014 . 1 . . . . . 137 ALA HB2 . 28014 1 1578 . 1 . 1 137 137 ALA HB3 H 1 1.256 0.014 . 1 . . . . . 137 ALA HB3 . 28014 1 1579 . 1 . 1 137 137 ALA C C 13 179.339 0.014 . 1 . . . . . 137 ALA C . 28014 1 1580 . 1 . 1 137 137 ALA CA C 13 50.938 0.100 . 1 . . . . . 137 ALA CA . 28014 1 1581 . 1 . 1 137 137 ALA CB C 13 19.424 0.120 . 1 . . . . . 137 ALA CB . 28014 1 1582 . 1 . 1 137 137 ALA N N 15 125.734 0.077 . 1 . . . . . 137 ALA N . 28014 1 1583 . 1 . 1 138 138 LEU H H 1 9.059 0.003 . 1 . . . . . 138 LEU H . 28014 1 1584 . 1 . 1 138 138 LEU HA H 1 3.818 0.006 . 1 . . . . . 138 LEU HA . 28014 1 1585 . 1 . 1 138 138 LEU HB2 H 1 1.746 0.001 . 2 . . . . . 138 LEU HB2 . 28014 1 1586 . 1 . 1 138 138 LEU HB3 H 1 1.489 0.000 . 2 . . . . . 138 LEU HB3 . 28014 1 1587 . 1 . 1 138 138 LEU HG H 1 1.506 0.018 . 1 . . . . . 138 LEU HG . 28014 1 1588 . 1 . 1 138 138 LEU HD11 H 1 0.761 0.005 . 2 . . . . . 138 LEU HD11 . 28014 1 1589 . 1 . 1 138 138 LEU HD12 H 1 0.761 0.005 . 2 . . . . . 138 LEU HD12 . 28014 1 1590 . 1 . 1 138 138 LEU HD13 H 1 0.761 0.005 . 2 . . . . . 138 LEU HD13 . 28014 1 1591 . 1 . 1 138 138 LEU HD21 H 1 0.749 0.011 . 2 . . . . . 138 LEU HD21 . 28014 1 1592 . 1 . 1 138 138 LEU HD22 H 1 0.749 0.011 . 2 . . . . . 138 LEU HD22 . 28014 1 1593 . 1 . 1 138 138 LEU HD23 H 1 0.749 0.011 . 2 . . . . . 138 LEU HD23 . 28014 1 1594 . 1 . 1 138 138 LEU C C 13 179.828 0.005 . 1 . . . . . 138 LEU C . 28014 1 1595 . 1 . 1 138 138 LEU CA C 13 58.458 0.050 . 1 . . . . . 138 LEU CA . 28014 1 1596 . 1 . 1 138 138 LEU CB C 13 42.135 0.054 . 1 . . . . . 138 LEU CB . 28014 1 1597 . 1 . 1 138 138 LEU CG C 13 27.119 0.028 . 1 . . . . . 138 LEU CG . 28014 1 1598 . 1 . 1 138 138 LEU CD1 C 13 26.141 0.027 . 2 . . . . . 138 LEU CD1 . 28014 1 1599 . 1 . 1 138 138 LEU CD2 C 13 24.749 0.069 . 2 . . . . . 138 LEU CD2 . 28014 1 1600 . 1 . 1 138 138 LEU N N 15 125.750 0.061 . 1 . . . . . 138 LEU N . 28014 1 1601 . 1 . 1 139 139 SER H H 1 8.476 0.004 . 1 . . . . . 139 SER H . 28014 1 1602 . 1 . 1 139 139 SER HA H 1 4.141 0.004 . 1 . . . . . 139 SER HA . 28014 1 1603 . 1 . 1 139 139 SER HB2 H 1 3.916 0.001 . 2 . . . . . 139 SER HB2 . 28014 1 1604 . 1 . 1 139 139 SER HB3 H 1 3.908 0.000 . 2 . . . . . 139 SER HB3 . 28014 1 1605 . 1 . 1 139 139 SER C C 13 175.020 0.000 . 1 . . . . . 139 SER C . 28014 1 1606 . 1 . 1 139 139 SER CA C 13 60.453 0.009 . 1 . . . . . 139 SER CA . 28014 1 1607 . 1 . 1 139 139 SER CB C 13 62.439 0.041 . 1 . . . . . 139 SER CB . 28014 1 1608 . 1 . 1 139 139 SER N N 15 111.431 0.036 . 1 . . . . . 139 SER N . 28014 1 1609 . 1 . 1 140 140 ASN H H 1 8.211 0.005 . 1 . . . . . 140 ASN H . 28014 1 1610 . 1 . 1 140 140 ASN HA H 1 5.126 0.006 . 1 . . . . . 140 ASN HA . 28014 1 1611 . 1 . 1 140 140 ASN HB2 H 1 3.064 0.005 . 2 . . . . . 140 ASN HB2 . 28014 1 1612 . 1 . 1 140 140 ASN HB3 H 1 2.628 0.005 . 2 . . . . . 140 ASN HB3 . 28014 1 1613 . 1 . 1 140 140 ASN C C 13 174.139 0.008 . 1 . . . . . 140 ASN C . 28014 1 1614 . 1 . 1 140 140 ASN CA C 13 51.743 0.048 . 1 . . . . . 140 ASN CA . 28014 1 1615 . 1 . 1 140 140 ASN CB C 13 40.548 0.030 . 1 . . . . . 140 ASN CB . 28014 1 1616 . 1 . 1 140 140 ASN N N 15 118.768 0.082 . 1 . . . . . 140 ASN N . 28014 1 1617 . 1 . 1 141 141 ILE H H 1 7.799 0.005 . 1 . . . . . 141 ILE H . 28014 1 1618 . 1 . 1 141 141 ILE HA H 1 4.015 0.005 . 1 . . . . . 141 ILE HA . 28014 1 1619 . 1 . 1 141 141 ILE HB H 1 1.866 0.004 . 1 . . . . . 141 ILE HB . 28014 1 1620 . 1 . 1 141 141 ILE HG12 H 1 1.734 0.008 . 2 . . . . . 141 ILE HG12 . 28014 1 1621 . 1 . 1 141 141 ILE HG13 H 1 0.404 0.007 . 2 . . . . . 141 ILE HG13 . 28014 1 1622 . 1 . 1 141 141 ILE HG21 H 1 0.740 0.004 . 1 . . . . . 141 ILE HG21 . 28014 1 1623 . 1 . 1 141 141 ILE HG22 H 1 0.740 0.004 . 1 . . . . . 141 ILE HG22 . 28014 1 1624 . 1 . 1 141 141 ILE HG23 H 1 0.740 0.004 . 1 . . . . . 141 ILE HG23 . 28014 1 1625 . 1 . 1 141 141 ILE HD11 H 1 0.489 0.003 . 1 . . . . . 141 ILE HD11 . 28014 1 1626 . 1 . 1 141 141 ILE HD12 H 1 0.489 0.003 . 1 . . . . . 141 ILE HD12 . 28014 1 1627 . 1 . 1 141 141 ILE HD13 H 1 0.489 0.003 . 1 . . . . . 141 ILE HD13 . 28014 1 1628 . 1 . 1 141 141 ILE C C 13 175.351 0.000 . 1 . . . . . 141 ILE C . 28014 1 1629 . 1 . 1 141 141 ILE CA C 13 62.583 0.042 . 1 . . . . . 141 ILE CA . 28014 1 1630 . 1 . 1 141 141 ILE CB C 13 38.365 0.078 . 1 . . . . . 141 ILE CB . 28014 1 1631 . 1 . 1 141 141 ILE CG1 C 13 26.978 0.073 . 1 . . . . . 141 ILE CG1 . 28014 1 1632 . 1 . 1 141 141 ILE CG2 C 13 18.697 0.078 . 1 . . . . . 141 ILE CG2 . 28014 1 1633 . 1 . 1 141 141 ILE CD1 C 13 13.351 0.035 . 1 . . . . . 141 ILE CD1 . 28014 1 1634 . 1 . 1 141 141 ILE N N 15 122.469 0.067 . 1 . . . . . 141 ILE N . 28014 1 1635 . 1 . 1 142 142 GLN H H 1 9.413 0.007 . 1 . . . . . 142 GLN H . 28014 1 1636 . 1 . 1 142 142 GLN HA H 1 4.059 0.009 . 1 . . . . . 142 GLN HA . 28014 1 1637 . 1 . 1 142 142 GLN HB2 H 1 1.749 0.008 . 2 . . . . . 142 GLN HB2 . 28014 1 1638 . 1 . 1 142 142 GLN HB3 H 1 1.726 0.003 . 2 . . . . . 142 GLN HB3 . 28014 1 1639 . 1 . 1 142 142 GLN HG2 H 1 2.185 0.007 . 2 . . . . . 142 GLN HG2 . 28014 1 1640 . 1 . 1 142 142 GLN HG3 H 1 2.154 0.003 . 2 . . . . . 142 GLN HG3 . 28014 1 1641 . 1 . 1 142 142 GLN HE21 H 1 7.436 0.002 . 1 . . . . . 142 GLN HE21 . 28014 1 1642 . 1 . 1 142 142 GLN HE22 H 1 6.724 0.002 . 1 . . . . . 142 GLN HE22 . 28014 1 1643 . 1 . 1 142 142 GLN C C 13 176.018 0.000 . 1 . . . . . 142 GLN C . 28014 1 1644 . 1 . 1 142 142 GLN CA C 13 57.564 0.024 . 1 . . . . . 142 GLN CA . 28014 1 1645 . 1 . 1 142 142 GLN CB C 13 30.429 0.082 . 1 . . . . . 142 GLN CB . 28014 1 1646 . 1 . 1 142 142 GLN CG C 13 33.843 0.049 . 1 . . . . . 142 GLN CG . 28014 1 1647 . 1 . 1 142 142 GLN CD C 13 179.038 0.000 . 1 . . . . . 142 GLN CD . 28014 1 1648 . 1 . 1 142 142 GLN N N 15 130.524 0.150 . 1 . . . . . 142 GLN N . 28014 1 1649 . 1 . 1 142 142 GLN NE2 N 15 111.213 0.017 . 1 . . . . . 142 GLN NE2 . 28014 1 1650 . 1 . 1 143 143 LYS H H 1 7.833 0.005 . 1 . . . . . 143 LYS H . 28014 1 1651 . 1 . 1 143 143 LYS HA H 1 4.334 0.006 . 1 . . . . . 143 LYS HA . 28014 1 1652 . 1 . 1 143 143 LYS HB2 H 1 1.670 0.009 . 2 . . . . . 143 LYS HB2 . 28014 1 1653 . 1 . 1 143 143 LYS HB3 H 1 1.585 0.006 . 2 . . . . . 143 LYS HB3 . 28014 1 1654 . 1 . 1 143 143 LYS HG2 H 1 1.300 0.004 . 2 . . . . . 143 LYS HG2 . 28014 1 1655 . 1 . 1 143 143 LYS HG3 H 1 1.243 0.001 . 2 . . . . . 143 LYS HG3 . 28014 1 1656 . 1 . 1 143 143 LYS HD2 H 1 1.573 0.000 . 2 . . . . . 143 LYS HD2 . 28014 1 1657 . 1 . 1 143 143 LYS HD3 H 1 1.490 0.014 . 2 . . . . . 143 LYS HD3 . 28014 1 1658 . 1 . 1 143 143 LYS HE2 H 1 2.890 0.000 . 2 . . . . . 143 LYS HE2 . 28014 1 1659 . 1 . 1 143 143 LYS HE3 H 1 2.842 0.000 . 2 . . . . . 143 LYS HE3 . 28014 1 1660 . 1 . 1 143 143 LYS C C 13 172.422 0.005 . 1 . . . . . 143 LYS C . 28014 1 1661 . 1 . 1 143 143 LYS CA C 13 55.835 0.026 . 1 . . . . . 143 LYS CA . 28014 1 1662 . 1 . 1 143 143 LYS CB C 13 36.061 0.045 . 1 . . . . . 143 LYS CB . 28014 1 1663 . 1 . 1 143 143 LYS CG C 13 24.254 0.035 . 1 . . . . . 143 LYS CG . 28014 1 1664 . 1 . 1 143 143 LYS CD C 13 29.281 0.025 . 1 . . . . . 143 LYS CD . 28014 1 1665 . 1 . 1 143 143 LYS CE C 13 42.023 0.062 . 1 . . . . . 143 LYS CE . 28014 1 1666 . 1 . 1 143 143 LYS N N 15 118.149 0.146 . 1 . . . . . 143 LYS N . 28014 1 1667 . 1 . 1 144 144 ALA H H 1 8.297 0.004 . 1 . . . . . 144 ALA H . 28014 1 1668 . 1 . 1 144 144 ALA HA H 1 5.136 0.009 . 1 . . . . . 144 ALA HA . 28014 1 1669 . 1 . 1 144 144 ALA HB1 H 1 1.173 0.014 . 1 . . . . . 144 ALA HB1 . 28014 1 1670 . 1 . 1 144 144 ALA HB2 H 1 1.173 0.014 . 1 . . . . . 144 ALA HB2 . 28014 1 1671 . 1 . 1 144 144 ALA HB3 H 1 1.173 0.014 . 1 . . . . . 144 ALA HB3 . 28014 1 1672 . 1 . 1 144 144 ALA C C 13 176.178 0.004 . 1 . . . . . 144 ALA C . 28014 1 1673 . 1 . 1 144 144 ALA CA C 13 51.523 0.086 . 1 . . . . . 144 ALA CA . 28014 1 1674 . 1 . 1 144 144 ALA CB C 13 24.969 0.096 . 1 . . . . . 144 ALA CB . 28014 1 1675 . 1 . 1 144 144 ALA N N 15 125.815 0.092 . 1 . . . . . 144 ALA N . 28014 1 1676 . 1 . 1 145 145 ASN H H 1 8.150 0.010 . 1 . . . . . 145 ASN H . 28014 1 1677 . 1 . 1 145 145 ASN HA H 1 5.205 0.008 . 1 . . . . . 145 ASN HA . 28014 1 1678 . 1 . 1 145 145 ASN HB2 H 1 2.147 0.007 . 2 . . . . . 145 ASN HB2 . 28014 1 1679 . 1 . 1 145 145 ASN HB3 H 1 1.872 0.002 . 2 . . . . . 145 ASN HB3 . 28014 1 1680 . 1 . 1 145 145 ASN C C 13 173.975 0.011 . 1 . . . . . 145 ASN C . 28014 1 1681 . 1 . 1 145 145 ASN CA C 13 52.468 0.039 . 1 . . . . . 145 ASN CA . 28014 1 1682 . 1 . 1 145 145 ASN CB C 13 42.785 0.033 . 1 . . . . . 145 ASN CB . 28014 1 1683 . 1 . 1 145 145 ASN N N 15 115.901 0.062 . 1 . . . . . 145 ASN N . 28014 1 1684 . 1 . 1 146 146 LEU H H 1 8.229 0.008 . 1 . . . . . 146 LEU H . 28014 1 1685 . 1 . 1 146 146 LEU HA H 1 4.380 0.007 . 1 . . . . . 146 LEU HA . 28014 1 1686 . 1 . 1 146 146 LEU HB2 H 1 1.358 0.013 . 2 . . . . . 146 LEU HB2 . 28014 1 1687 . 1 . 1 146 146 LEU HB3 H 1 1.289 0.005 . 2 . . . . . 146 LEU HB3 . 28014 1 1688 . 1 . 1 146 146 LEU HG H 1 1.111 0.002 . 1 . . . . . 146 LEU HG . 28014 1 1689 . 1 . 1 146 146 LEU HD11 H 1 -0.125 0.003 . 2 . . . . . 146 LEU HD11 . 28014 1 1690 . 1 . 1 146 146 LEU HD12 H 1 -0.125 0.003 . 2 . . . . . 146 LEU HD12 . 28014 1 1691 . 1 . 1 146 146 LEU HD13 H 1 -0.125 0.003 . 2 . . . . . 146 LEU HD13 . 28014 1 1692 . 1 . 1 146 146 LEU HD21 H 1 0.360 0.005 . 2 . . . . . 146 LEU HD21 . 28014 1 1693 . 1 . 1 146 146 LEU HD22 H 1 0.360 0.005 . 2 . . . . . 146 LEU HD22 . 28014 1 1694 . 1 . 1 146 146 LEU HD23 H 1 0.360 0.005 . 2 . . . . . 146 LEU HD23 . 28014 1 1695 . 1 . 1 146 146 LEU C C 13 176.874 0.000 . 1 . . . . . 146 LEU C . 28014 1 1696 . 1 . 1 146 146 LEU CA C 13 55.061 0.070 . 1 . . . . . 146 LEU CA . 28014 1 1697 . 1 . 1 146 146 LEU CB C 13 41.696 0.078 . 1 . . . . . 146 LEU CB . 28014 1 1698 . 1 . 1 146 146 LEU CG C 13 25.988 0.112 . 1 . . . . . 146 LEU CG . 28014 1 1699 . 1 . 1 146 146 LEU CD1 C 13 22.243 0.048 . 1 . . . . . 146 LEU CD1 . 28014 1 1700 . 1 . 1 146 146 LEU CD2 C 13 24.719 0.046 . 1 . . . . . 146 LEU CD2 . 28014 1 1701 . 1 . 1 146 146 LEU N N 15 120.513 0.123 . 1 . . . . . 146 LEU N . 28014 1 1702 . 1 . 1 147 147 VAL H H 1 7.791 0.005 . 1 . . . . . 147 VAL H . 28014 1 1703 . 1 . 1 147 147 VAL HA H 1 4.078 0.002 . 1 . . . . . 147 VAL HA . 28014 1 1704 . 1 . 1 147 147 VAL HB H 1 1.596 0.003 . 1 . . . . . 147 VAL HB . 28014 1 1705 . 1 . 1 147 147 VAL HG11 H 1 0.640 0.002 . 2 . . . . . 147 VAL HG11 . 28014 1 1706 . 1 . 1 147 147 VAL HG12 H 1 0.640 0.002 . 2 . . . . . 147 VAL HG12 . 28014 1 1707 . 1 . 1 147 147 VAL HG13 H 1 0.640 0.002 . 2 . . . . . 147 VAL HG13 . 28014 1 1708 . 1 . 1 147 147 VAL HG21 H 1 0.669 0.004 . 2 . . . . . 147 VAL HG21 . 28014 1 1709 . 1 . 1 147 147 VAL HG22 H 1 0.669 0.004 . 2 . . . . . 147 VAL HG22 . 28014 1 1710 . 1 . 1 147 147 VAL HG23 H 1 0.669 0.004 . 2 . . . . . 147 VAL HG23 . 28014 1 1711 . 1 . 1 147 147 VAL C C 13 174.506 0.000 . 1 . . . . . 147 VAL C . 28014 1 1712 . 1 . 1 147 147 VAL CA C 13 59.376 0.037 . 1 . . . . . 147 VAL CA . 28014 1 1713 . 1 . 1 147 147 VAL CB C 13 32.707 0.087 . 1 . . . . . 147 VAL CB . 28014 1 1714 . 1 . 1 147 147 VAL CG1 C 13 21.478 0.036 . 2 . . . . . 147 VAL CG1 . 28014 1 1715 . 1 . 1 147 147 VAL CG2 C 13 20.337 0.027 . 2 . . . . . 147 VAL CG2 . 28014 1 1716 . 1 . 1 147 147 VAL N N 15 122.470 0.046 . 1 . . . . . 147 VAL N . 28014 1 1717 . 1 . 1 148 148 PRO HA H 1 4.103 0.008 . 1 . . . . . 148 PRO HA . 28014 1 1718 . 1 . 1 148 148 PRO HB2 H 1 1.803 0.004 . 2 . . . . . 148 PRO HB2 . 28014 1 1719 . 1 . 1 148 148 PRO HB3 H 1 1.481 0.022 . 2 . . . . . 148 PRO HB3 . 28014 1 1720 . 1 . 1 148 148 PRO HG2 H 1 1.832 0.009 . 2 . . . . . 148 PRO HG2 . 28014 1 1721 . 1 . 1 148 148 PRO HG3 H 1 1.506 0.000 . 2 . . . . . 148 PRO HG3 . 28014 1 1722 . 1 . 1 148 148 PRO HD2 H 1 3.653 0.000 . 2 . . . . . 148 PRO HD2 . 28014 1 1723 . 1 . 1 148 148 PRO HD3 H 1 3.510 0.000 . 2 . . . . . 148 PRO HD3 . 28014 1 1724 . 1 . 1 148 148 PRO C C 13 175.762 0.000 . 1 . . . . . 148 PRO C . 28014 1 1725 . 1 . 1 148 148 PRO CA C 13 62.414 0.019 . 1 . . . . . 148 PRO CA . 28014 1 1726 . 1 . 1 148 148 PRO CB C 13 32.355 0.038 . 1 . . . . . 148 PRO CB . 28014 1 1727 . 1 . 1 148 148 PRO CG C 13 27.029 0.059 . 1 . . . . . 148 PRO CG . 28014 1 1728 . 1 . 1 148 148 PRO CD C 13 50.815 0.082 . 1 . . . . . 148 PRO CD . 28014 1 1729 . 1 . 1 149 149 HIS H H 1 8.385 0.006 . 1 . . . . . 149 HIS H . 28014 1 1730 . 1 . 1 149 149 HIS HA H 1 4.513 0.007 . 1 . . . . . 149 HIS HA . 28014 1 1731 . 1 . 1 149 149 HIS HB2 H 1 2.987 0.000 . 2 . . . . . 149 HIS HB2 . 28014 1 1732 . 1 . 1 149 149 HIS HB3 H 1 2.964 0.000 . 2 . . . . . 149 HIS HB3 . 28014 1 1733 . 1 . 1 149 149 HIS C C 13 174.306 0.045 . 1 . . . . . 149 HIS C . 28014 1 1734 . 1 . 1 149 149 HIS CA C 13 55.176 0.038 . 1 . . . . . 149 HIS CA . 28014 1 1735 . 1 . 1 149 149 HIS CB C 13 30.119 0.039 . 1 . . . . . 149 HIS CB . 28014 1 1736 . 1 . 1 149 149 HIS N N 15 119.967 0.054 . 1 . . . . . 149 HIS N . 28014 1 1737 . 1 . 1 150 150 PHE H H 1 8.105 0.010 . 1 . . . . . 150 PHE H . 28014 1 1738 . 1 . 1 150 150 PHE HA H 1 4.509 0.006 . 1 . . . . . 150 PHE HA . 28014 1 1739 . 1 . 1 150 150 PHE HB2 H 1 3.058 0.000 . 2 . . . . . 150 PHE HB2 . 28014 1 1740 . 1 . 1 150 150 PHE HB3 H 1 2.831 0.002 . 2 . . . . . 150 PHE HB3 . 28014 1 1741 . 1 . 1 150 150 PHE HD1 H 1 7.143 0.000 . 1 . . . . . 150 PHE HD1 . 28014 1 1742 . 1 . 1 150 150 PHE HD2 H 1 7.143 0.000 . 1 . . . . . 150 PHE HD2 . 28014 1 1743 . 1 . 1 150 150 PHE C C 13 174.247 0.000 . 1 . . . . . 150 PHE C . 28014 1 1744 . 1 . 1 150 150 PHE CA C 13 57.447 0.057 . 1 . . . . . 150 PHE CA . 28014 1 1745 . 1 . 1 150 150 PHE CB C 13 39.742 0.024 . 1 . . . . . 150 PHE CB . 28014 1 1746 . 1 . 1 150 150 PHE N N 15 121.979 0.179 . 1 . . . . . 150 PHE N . 28014 1 1747 . 1 . 1 151 151 ALA H H 1 7.804 0.007 . 1 . . . . . 151 ALA H . 28014 1 1748 . 1 . 1 151 151 ALA HA H 1 3.997 0.006 . 1 . . . . . 151 ALA HA . 28014 1 1749 . 1 . 1 151 151 ALA HB1 H 1 1.217 0.002 . 1 . . . . . 151 ALA HB1 . 28014 1 1750 . 1 . 1 151 151 ALA HB2 H 1 1.217 0.002 . 1 . . . . . 151 ALA HB2 . 28014 1 1751 . 1 . 1 151 151 ALA HB3 H 1 1.217 0.002 . 1 . . . . . 151 ALA HB3 . 28014 1 1752 . 1 . 1 151 151 ALA C C 13 174.248 0.000 . 1 . . . . . 151 ALA C . 28014 1 1753 . 1 . 1 151 151 ALA CA C 13 53.727 0.035 . 1 . . . . . 151 ALA CA . 28014 1 1754 . 1 . 1 151 151 ALA CB C 13 20.330 0.037 . 1 . . . . . 151 ALA CB . 28014 1 1755 . 1 . 1 151 151 ALA N N 15 130.790 0.201 . 1 . . . . . 151 ALA N . 28014 1 stop_ save_