data_30195 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 30195 _Entry.Title ; Solution structure of the calcium deficient mutant calmodulin CaM1234 ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2016-10-19 _Entry.Accession_date 2016-10-19 _Entry.Last_release_date 2016-11-28 _Entry.Original_release_date 2016-11-28 _Entry.Origination author _Entry.Format_name . _Entry.NMR_STAR_version 3.2.0.16 _Entry.Original_NMR_STAR_version 3.1.2.6 _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 . 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 M. Piazza M. . . . 30195 2 T. Dieckmann T. . . . 30195 3 J. Guillemette J. G. . . 30195 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID 'Calcium deficient' . 30195 calmodulin . 30195 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 30195 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 266 30195 '15N chemical shifts' 142 30195 '1H chemical shifts' 731 30195 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 . . 2017-12-12 2016-10-19 update BMRB 'update entry citation' 30195 1 . . 2017-09-25 2016-10-19 original author 'original release' 30195 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID BMRB 30196 'Solution structure of the CaM34 with the iNOS CaM binding domain peptide' 30195 PDB 5TP5 'BMRB Entry Tracking System' 30195 stop_ save_ ############### # Citations # ############### save_citation_1 _Citation.Sf_category citations _Citation.Sf_framecode citation_1 _Citation.Entry_ID 30195 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI 10.1021/acs.biochem.6b01296 _Citation.PubMed_ID 28121131 _Citation.Full_citation . _Citation.Title ; Structural Consequences of Calmodulin EF Hand Mutations. ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev Biochemistry _Citation.Journal_name_full Biochemistry _Citation.Journal_volume 56 _Citation.Journal_issue 7 _Citation.Journal_ASTM . _Citation.Journal_ISSN 1520-4995 _Citation.Journal_CSD 0353 _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 944 _Citation.Page_last 956 _Citation.Year 2017 _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 Michael Piazza M. . . . 30195 1 2 Valentina Taiakina V. . . . 30195 1 3 Thorsten Dieckmann T. . . . 30195 1 4 'J Guy' Guillemette J. G. . . 30195 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 30195 _Assembly.ID 1 _Assembly.Name Calmodulin _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 entity_1 1 $entity_1 A A yes . . . . . . 30195 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 30195 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name Calmodulin _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID A _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; ADQLTEEQIAEFKEAFSLFA KDGDGTITTKELGTVMRSLG QNPTEAELQDMINEVAADGN GTIDFPEFLTMMARKMKDTD SEEEIREAFRVFAKDGNGYI SAAELRHVMTNLGEKLTDEE VDEMIREAAIDGDGQVNYEE FVQMMTAK ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states . _Entity.Ambiguous_chem_comp_sites . _Entity.Nstd_monomer no _Entity.Nstd_chirality . _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 148 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method man _Entity.Parent_entity_ID 1 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 16545.311 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID CaM na 30195 1 stop_ loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 1 ALA . 30195 1 2 2 ASP . 30195 1 3 3 GLN . 30195 1 4 4 LEU . 30195 1 5 5 THR . 30195 1 6 6 GLU . 30195 1 7 7 GLU . 30195 1 8 8 GLN . 30195 1 9 9 ILE . 30195 1 10 10 ALA . 30195 1 11 11 GLU . 30195 1 12 12 PHE . 30195 1 13 13 LYS . 30195 1 14 14 GLU . 30195 1 15 15 ALA . 30195 1 16 16 PHE . 30195 1 17 17 SER . 30195 1 18 18 LEU . 30195 1 19 19 PHE . 30195 1 20 20 ALA . 30195 1 21 21 LYS . 30195 1 22 22 ASP . 30195 1 23 23 GLY . 30195 1 24 24 ASP . 30195 1 25 25 GLY . 30195 1 26 26 THR . 30195 1 27 27 ILE . 30195 1 28 28 THR . 30195 1 29 29 THR . 30195 1 30 30 LYS . 30195 1 31 31 GLU . 30195 1 32 32 LEU . 30195 1 33 33 GLY . 30195 1 34 34 THR . 30195 1 35 35 VAL . 30195 1 36 36 MET . 30195 1 37 37 ARG . 30195 1 38 38 SER . 30195 1 39 39 LEU . 30195 1 40 40 GLY . 30195 1 41 41 GLN . 30195 1 42 42 ASN . 30195 1 43 43 PRO . 30195 1 44 44 THR . 30195 1 45 45 GLU . 30195 1 46 46 ALA . 30195 1 47 47 GLU . 30195 1 48 48 LEU . 30195 1 49 49 GLN . 30195 1 50 50 ASP . 30195 1 51 51 MET . 30195 1 52 52 ILE . 30195 1 53 53 ASN . 30195 1 54 54 GLU . 30195 1 55 55 VAL . 30195 1 56 56 ALA . 30195 1 57 57 ALA . 30195 1 58 58 ASP . 30195 1 59 59 GLY . 30195 1 60 60 ASN . 30195 1 61 61 GLY . 30195 1 62 62 THR . 30195 1 63 63 ILE . 30195 1 64 64 ASP . 30195 1 65 65 PHE . 30195 1 66 66 PRO . 30195 1 67 67 GLU . 30195 1 68 68 PHE . 30195 1 69 69 LEU . 30195 1 70 70 THR . 30195 1 71 71 MET . 30195 1 72 72 MET . 30195 1 73 73 ALA . 30195 1 74 74 ARG . 30195 1 75 75 LYS . 30195 1 76 76 MET . 30195 1 77 77 LYS . 30195 1 78 78 ASP . 30195 1 79 79 THR . 30195 1 80 80 ASP . 30195 1 81 81 SER . 30195 1 82 82 GLU . 30195 1 83 83 GLU . 30195 1 84 84 GLU . 30195 1 85 85 ILE . 30195 1 86 86 ARG . 30195 1 87 87 GLU . 30195 1 88 88 ALA . 30195 1 89 89 PHE . 30195 1 90 90 ARG . 30195 1 91 91 VAL . 30195 1 92 92 PHE . 30195 1 93 93 ALA . 30195 1 94 94 LYS . 30195 1 95 95 ASP . 30195 1 96 96 GLY . 30195 1 97 97 ASN . 30195 1 98 98 GLY . 30195 1 99 99 TYR . 30195 1 100 100 ILE . 30195 1 101 101 SER . 30195 1 102 102 ALA . 30195 1 103 103 ALA . 30195 1 104 104 GLU . 30195 1 105 105 LEU . 30195 1 106 106 ARG . 30195 1 107 107 HIS . 30195 1 108 108 VAL . 30195 1 109 109 MET . 30195 1 110 110 THR . 30195 1 111 111 ASN . 30195 1 112 112 LEU . 30195 1 113 113 GLY . 30195 1 114 114 GLU . 30195 1 115 115 LYS . 30195 1 116 116 LEU . 30195 1 117 117 THR . 30195 1 118 118 ASP . 30195 1 119 119 GLU . 30195 1 120 120 GLU . 30195 1 121 121 VAL . 30195 1 122 122 ASP . 30195 1 123 123 GLU . 30195 1 124 124 MET . 30195 1 125 125 ILE . 30195 1 126 126 ARG . 30195 1 127 127 GLU . 30195 1 128 128 ALA . 30195 1 129 129 ALA . 30195 1 130 130 ILE . 30195 1 131 131 ASP . 30195 1 132 132 GLY . 30195 1 133 133 ASP . 30195 1 134 134 GLY . 30195 1 135 135 GLN . 30195 1 136 136 VAL . 30195 1 137 137 ASN . 30195 1 138 138 TYR . 30195 1 139 139 GLU . 30195 1 140 140 GLU . 30195 1 141 141 PHE . 30195 1 142 142 VAL . 30195 1 143 143 GLN . 30195 1 144 144 MET . 30195 1 145 145 MET . 30195 1 146 146 THR . 30195 1 147 147 ALA . 30195 1 148 148 LYS . 30195 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 . ALA 1 1 30195 1 . ASP 2 2 30195 1 . GLN 3 3 30195 1 . LEU 4 4 30195 1 . THR 5 5 30195 1 . GLU 6 6 30195 1 . GLU 7 7 30195 1 . GLN 8 8 30195 1 . ILE 9 9 30195 1 . ALA 10 10 30195 1 . GLU 11 11 30195 1 . PHE 12 12 30195 1 . LYS 13 13 30195 1 . GLU 14 14 30195 1 . ALA 15 15 30195 1 . PHE 16 16 30195 1 . SER 17 17 30195 1 . LEU 18 18 30195 1 . PHE 19 19 30195 1 . ALA 20 20 30195 1 . LYS 21 21 30195 1 . ASP 22 22 30195 1 . GLY 23 23 30195 1 . ASP 24 24 30195 1 . GLY 25 25 30195 1 . THR 26 26 30195 1 . ILE 27 27 30195 1 . THR 28 28 30195 1 . THR 29 29 30195 1 . LYS 30 30 30195 1 . GLU 31 31 30195 1 . LEU 32 32 30195 1 . GLY 33 33 30195 1 . THR 34 34 30195 1 . VAL 35 35 30195 1 . MET 36 36 30195 1 . ARG 37 37 30195 1 . SER 38 38 30195 1 . LEU 39 39 30195 1 . GLY 40 40 30195 1 . GLN 41 41 30195 1 . ASN 42 42 30195 1 . PRO 43 43 30195 1 . THR 44 44 30195 1 . GLU 45 45 30195 1 . ALA 46 46 30195 1 . GLU 47 47 30195 1 . LEU 48 48 30195 1 . GLN 49 49 30195 1 . ASP 50 50 30195 1 . MET 51 51 30195 1 . ILE 52 52 30195 1 . ASN 53 53 30195 1 . GLU 54 54 30195 1 . VAL 55 55 30195 1 . ALA 56 56 30195 1 . ALA 57 57 30195 1 . ASP 58 58 30195 1 . GLY 59 59 30195 1 . ASN 60 60 30195 1 . GLY 61 61 30195 1 . THR 62 62 30195 1 . ILE 63 63 30195 1 . ASP 64 64 30195 1 . PHE 65 65 30195 1 . PRO 66 66 30195 1 . GLU 67 67 30195 1 . PHE 68 68 30195 1 . LEU 69 69 30195 1 . THR 70 70 30195 1 . MET 71 71 30195 1 . MET 72 72 30195 1 . ALA 73 73 30195 1 . ARG 74 74 30195 1 . LYS 75 75 30195 1 . MET 76 76 30195 1 . LYS 77 77 30195 1 . ASP 78 78 30195 1 . THR 79 79 30195 1 . ASP 80 80 30195 1 . SER 81 81 30195 1 . GLU 82 82 30195 1 . GLU 83 83 30195 1 . GLU 84 84 30195 1 . ILE 85 85 30195 1 . ARG 86 86 30195 1 . GLU 87 87 30195 1 . ALA 88 88 30195 1 . PHE 89 89 30195 1 . ARG 90 90 30195 1 . VAL 91 91 30195 1 . PHE 92 92 30195 1 . ALA 93 93 30195 1 . LYS 94 94 30195 1 . ASP 95 95 30195 1 . GLY 96 96 30195 1 . ASN 97 97 30195 1 . GLY 98 98 30195 1 . TYR 99 99 30195 1 . ILE 100 100 30195 1 . SER 101 101 30195 1 . ALA 102 102 30195 1 . ALA 103 103 30195 1 . GLU 104 104 30195 1 . LEU 105 105 30195 1 . ARG 106 106 30195 1 . HIS 107 107 30195 1 . VAL 108 108 30195 1 . MET 109 109 30195 1 . THR 110 110 30195 1 . ASN 111 111 30195 1 . LEU 112 112 30195 1 . GLY 113 113 30195 1 . GLU 114 114 30195 1 . LYS 115 115 30195 1 . LEU 116 116 30195 1 . THR 117 117 30195 1 . ASP 118 118 30195 1 . GLU 119 119 30195 1 . GLU 120 120 30195 1 . VAL 121 121 30195 1 . ASP 122 122 30195 1 . GLU 123 123 30195 1 . MET 124 124 30195 1 . ILE 125 125 30195 1 . ARG 126 126 30195 1 . GLU 127 127 30195 1 . ALA 128 128 30195 1 . ALA 129 129 30195 1 . ILE 130 130 30195 1 . ASP 131 131 30195 1 . GLY 132 132 30195 1 . ASP 133 133 30195 1 . GLY 134 134 30195 1 . GLN 135 135 30195 1 . VAL 136 136 30195 1 . ASN 137 137 30195 1 . TYR 138 138 30195 1 . GLU 139 139 30195 1 . GLU 140 140 30195 1 . PHE 141 141 30195 1 . VAL 142 142 30195 1 . GLN 143 143 30195 1 . MET 144 144 30195 1 . MET 145 145 30195 1 . THR 146 146 30195 1 . ALA 147 147 30195 1 . LYS 148 148 30195 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 30195 _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 $entity_1 . 9606 organism . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . 'CALM1, CALM, CAM, CAM1, CALM2, CAM2, CAMB, CALM3, CALML2, CAM3, CAMC, CAMIII' . 30195 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 30195 _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 $entity_1 . 'recombinant technology' 'Escherichia coli' . . 562 Escherichia coli . . . . . . . . . . 30195 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 30195 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details ; 100 mM potassium chloride, 1 mM [U-99% 13C; U-99% 15N] CaM1234, 0.2 mM sodium azide, 0.2 mM EDTA, 90% H2O/10% D2O ; _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 CaM1234 '[U-99% 13C; U-99% 15N]' . . 1 $entity_1 . . 1 . . mM . . . . 30195 1 2 EDTA 'natural abundance' . . . . . . 0.2 . . mM . . . . 30195 1 3 'potassium chloride' 'natural abundance' . . . . . . 100 . . mM . . . . 30195 1 4 'sodium azide' 'natural abundance' . . . . . . 0.2 . . mM . . . . 30195 1 5 H2O 'natural abundance' . . . . . . 90 . . % . . . . 30195 1 6 D2O 'natural abundance' . . . . . . 10 . . % . . . . 30195 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 30195 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 150 . mM 30195 1 pH 6.0 . pH 30195 1 pressure 1 . atm 30195 1 temperature 298 . K 30195 1 stop_ save_ ############################ # Computer software used # ############################ save_software_2 _Software.Sf_category software _Software.Sf_framecode software_2 _Software.Entry_ID 30195 _Software.ID 2 _Software.Type . _Software.Name CNS _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Brunger, Adams, Clore, Gros, Nilges and Read' . . 30195 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID refinement 30195 2 'structure calculation' 30195 2 stop_ save_ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID 30195 _Software.ID 1 _Software.Type . _Software.Name CARA _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Keller and Wuthrich' . . 30195 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 30195 1 'peak picking' 30195 1 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_NMR_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_1 _NMR_spectrometer.Entry_ID 30195 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model DRX _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 30195 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 NMR_spectrometer_1 Bruker DRX . 600 . . . 30195 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 30195 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N HSQC' no . . . . . . . . . . 1 $sample_1 anisotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 30195 1 2 '3D HNCA' no . . . . . . . . . . 1 $sample_1 anisotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 30195 1 3 '3D CBCA(CO)NH' no . . . . . . . . . . 1 $sample_1 anisotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 30195 1 4 '3D HCCH-TOCSY' no . . . . . . . . . . 1 $sample_1 anisotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 30195 1 5 '3D 1H-15N NOESY' no . . . . . . . . . . 1 $sample_1 anisotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 30195 1 6 '3D 1H-13C NOESY' no . . . . . . . . . . 1 $sample_1 anisotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 30195 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chem_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chem_shift_reference_1 _Chem_shift_reference.Entry_ID 30195 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.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 0.000 internal indirect 0.25144953 . . . . . 30195 1 H 1 DSS 'methyl protons' . . . . ppm 0.000 internal direct 1.0 . . . . . 30195 1 N 15 DSS 'methyl protons' . . . . ppm 0.000 internal indirect 0.10132912 . . . . . 30195 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_chemical_shifts_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1 _Assigned_chem_shift_list.Entry_ID 30195 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chem_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 1H-15N HSQC' . . . 30195 1 2 '3D HNCA' . . . 30195 1 3 '3D CBCA(CO)NH' . . . 30195 1 4 '3D HCCH-TOCSY' . . . 30195 1 5 '3D 1H-15N NOESY' . . . 30195 1 6 '3D 1H-13C NOESY' . . . 30195 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.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 3 3 GLN H H 1 8.115 0.020 . 1 . . . . A 3 GLN H . 30195 1 2 . 1 1 3 3 GLN HA H 1 4.369 0.020 . 1 . . . . A 3 GLN HA . 30195 1 3 . 1 1 3 3 GLN HB2 H 1 1.894 0.020 . 1 . . . . A 3 GLN HB2 . 30195 1 4 . 1 1 3 3 GLN HB3 H 1 1.894 0.020 . 1 . . . . A 3 GLN HB3 . 30195 1 5 . 1 1 3 3 GLN CA C 13 52.566 0.3 . 1 . . . . A 3 GLN CA . 30195 1 6 . 1 1 3 3 GLN CB C 13 27.393 0.3 . 1 . . . . A 3 GLN CB . 30195 1 7 . 1 1 3 3 GLN N N 15 118.296 0.3 . 1 . . . . A 3 GLN N . 30195 1 8 . 1 1 4 4 LEU H H 1 8.231 0.020 . 1 . . . . A 4 LEU H . 30195 1 9 . 1 1 4 4 LEU HA H 1 4.492 0.020 . 1 . . . . A 4 LEU HA . 30195 1 10 . 1 1 4 4 LEU HB2 H 1 1.665 0.020 . 1 . . . . A 4 LEU HB2 . 30195 1 11 . 1 1 4 4 LEU HB3 H 1 1.665 0.020 . 1 . . . . A 4 LEU HB3 . 30195 1 12 . 1 1 4 4 LEU HG H 1 1.279 0.020 . 1 . . . . A 4 LEU HG . 30195 1 13 . 1 1 4 4 LEU HD11 H 1 0.805 0.020 . 1 . . . . A 4 LEU HD11 . 30195 1 14 . 1 1 4 4 LEU HD12 H 1 0.805 0.020 . 1 . . . . A 4 LEU HD12 . 30195 1 15 . 1 1 4 4 LEU HD13 H 1 0.805 0.020 . 1 . . . . A 4 LEU HD13 . 30195 1 16 . 1 1 4 4 LEU HD21 H 1 0.805 0.020 . 1 . . . . A 4 LEU HD21 . 30195 1 17 . 1 1 4 4 LEU HD22 H 1 0.805 0.020 . 1 . . . . A 4 LEU HD22 . 30195 1 18 . 1 1 4 4 LEU HD23 H 1 0.805 0.020 . 1 . . . . A 4 LEU HD23 . 30195 1 19 . 1 1 4 4 LEU CA C 13 51.624 0.3 . 1 . . . . A 4 LEU CA . 30195 1 20 . 1 1 4 4 LEU CB C 13 40.532 0.3 . 1 . . . . A 4 LEU CB . 30195 1 21 . 1 1 4 4 LEU N N 15 121.564 0.3 . 1 . . . . A 4 LEU N . 30195 1 22 . 1 1 5 5 THR H H 1 8.672 0.020 . 1 . . . . A 5 THR H . 30195 1 23 . 1 1 5 5 THR HA H 1 4.439 0.020 . 1 . . . . A 5 THR HA . 30195 1 24 . 1 1 5 5 THR HB H 1 4.580 0.020 . 1 . . . . A 5 THR HB . 30195 1 25 . 1 1 5 5 THR HG21 H 1 1.139 0.020 . 1 . . . . A 5 THR HG21 . 30195 1 26 . 1 1 5 5 THR HG22 H 1 1.139 0.020 . 1 . . . . A 5 THR HG22 . 30195 1 27 . 1 1 5 5 THR HG23 H 1 1.139 0.020 . 1 . . . . A 5 THR HG23 . 30195 1 28 . 1 1 5 5 THR CA C 13 57.548 0.3 . 1 . . . . A 5 THR CA . 30195 1 29 . 1 1 5 5 THR CB C 13 68.371 0.3 . 1 . . . . A 5 THR CB . 30195 1 30 . 1 1 5 5 THR N N 15 112.706 0.3 . 1 . . . . A 5 THR N . 30195 1 31 . 1 1 6 6 GLU H H 1 8.952 0.020 . 1 . . . . A 6 GLU H . 30195 1 32 . 1 1 6 6 GLU HA H 1 3.913 0.020 . 1 . . . . A 6 GLU HA . 30195 1 33 . 1 1 6 6 GLU HB2 H 1 1.999 0.020 . 1 . . . . A 6 GLU HB2 . 30195 1 34 . 1 1 6 6 GLU HB3 H 1 1.999 0.020 . 1 . . . . A 6 GLU HB3 . 30195 1 35 . 1 1 6 6 GLU CA C 13 57.414 0.3 . 1 . . . . A 6 GLU CA . 30195 1 36 . 1 1 6 6 GLU CB C 13 26.291 0.3 . 1 . . . . A 6 GLU CB . 30195 1 37 . 1 1 6 6 GLU N N 15 120.025 0.3 . 1 . . . . A 6 GLU N . 30195 1 38 . 1 1 7 7 GLU H H 1 8.652 0.020 . 1 . . . . A 7 GLU H . 30195 1 39 . 1 1 7 7 GLU HA H 1 3.930 0.020 . 1 . . . . A 7 GLU HA . 30195 1 40 . 1 1 7 7 GLU HB2 H 1 1.964 0.020 . 1 . . . . A 7 GLU HB2 . 30195 1 41 . 1 1 7 7 GLU HB3 H 1 1.964 0.020 . 1 . . . . A 7 GLU HB3 . 30195 1 42 . 1 1 7 7 GLU CA C 13 57.380 0.3 . 1 . . . . A 7 GLU CA . 30195 1 43 . 1 1 7 7 GLU CB C 13 26.055 0.3 . 1 . . . . A 7 GLU CB . 30195 1 44 . 1 1 7 7 GLU N N 15 119.114 0.3 . 1 . . . . A 7 GLU N . 30195 1 45 . 1 1 8 8 GLN H H 1 7.657 0.020 . 1 . . . . A 8 GLN H . 30195 1 46 . 1 1 8 8 GLN HA H 1 3.860 0.020 . 1 . . . . A 8 GLN HA . 30195 1 47 . 1 1 8 8 GLN HB2 H 1 2.139 0.020 . 1 . . . . A 8 GLN HB2 . 30195 1 48 . 1 1 8 8 GLN HB3 H 1 2.139 0.020 . 1 . . . . A 8 GLN HB3 . 30195 1 49 . 1 1 8 8 GLN CA C 13 55.899 0.3 . 1 . . . . A 8 GLN CA . 30195 1 50 . 1 1 8 8 GLN CB C 13 26.213 0.3 . 1 . . . . A 8 GLN CB . 30195 1 51 . 1 1 8 8 GLN N N 15 120.294 0.3 . 1 . . . . A 8 GLN N . 30195 1 52 . 1 1 9 9 ILE H H 1 8.180 0.020 . 1 . . . . A 9 ILE H . 30195 1 53 . 1 1 9 9 ILE HA H 1 3.386 0.020 . 1 . . . . A 9 ILE HA . 30195 1 54 . 1 1 9 9 ILE HB H 1 1.736 0.020 . 1 . . . . A 9 ILE HB . 30195 1 55 . 1 1 9 9 ILE HG12 H 1 0.928 0.020 . 1 . . . . A 9 ILE HG12 . 30195 1 56 . 1 1 9 9 ILE HG13 H 1 0.928 0.020 . 1 . . . . A 9 ILE HG13 . 30195 1 57 . 1 1 9 9 ILE HG21 H 1 0.787 0.020 . 1 . . . . A 9 ILE HG21 . 30195 1 58 . 1 1 9 9 ILE HG22 H 1 0.787 0.020 . 1 . . . . A 9 ILE HG22 . 30195 1 59 . 1 1 9 9 ILE HG23 H 1 0.787 0.020 . 1 . . . . A 9 ILE HG23 . 30195 1 60 . 1 1 9 9 ILE HD11 H 1 0.682 0.020 . 1 . . . . A 9 ILE HD11 . 30195 1 61 . 1 1 9 9 ILE HD12 H 1 0.682 0.020 . 1 . . . . A 9 ILE HD12 . 30195 1 62 . 1 1 9 9 ILE HD13 H 1 0.682 0.020 . 1 . . . . A 9 ILE HD13 . 30195 1 63 . 1 1 9 9 ILE CA C 13 64.012 0.3 . 1 . . . . A 9 ILE CA . 30195 1 64 . 1 1 9 9 ILE CB C 13 35.181 0.3 . 1 . . . . A 9 ILE CB . 30195 1 65 . 1 1 9 9 ILE N N 15 118.311 0.3 . 1 . . . . A 9 ILE N . 30195 1 66 . 1 1 10 10 ALA H H 1 7.850 0.020 . 1 . . . . A 10 ALA H . 30195 1 67 . 1 1 10 10 ALA HA H 1 4.141 0.020 . 1 . . . . A 10 ALA HA . 30195 1 68 . 1 1 10 10 ALA HB1 H 1 1.455 0.020 . 1 . . . . A 10 ALA HB1 . 30195 1 69 . 1 1 10 10 ALA HB2 H 1 1.455 0.020 . 1 . . . . A 10 ALA HB2 . 30195 1 70 . 1 1 10 10 ALA HB3 H 1 1.455 0.020 . 1 . . . . A 10 ALA HB3 . 30195 1 71 . 1 1 10 10 ALA CA C 13 52.634 0.3 . 1 . . . . A 10 ALA CA . 30195 1 72 . 1 1 10 10 ALA CB C 13 15.041 0.3 . 1 . . . . A 10 ALA CB . 30195 1 73 . 1 1 10 10 ALA N N 15 120.211 0.3 . 1 . . . . A 10 ALA N . 30195 1 74 . 1 1 11 11 GLU H H 1 7.714 0.020 . 1 . . . . A 11 GLU H . 30195 1 75 . 1 1 11 11 GLU HA H 1 4.141 0.020 . 1 . . . . A 11 GLU HA . 30195 1 76 . 1 1 11 11 GLU HB2 H 1 2.016 0.020 . 1 . . . . A 11 GLU HB2 . 30195 1 77 . 1 1 11 11 GLU HB3 H 1 2.016 0.020 . 1 . . . . A 11 GLU HB3 . 30195 1 78 . 1 1 11 11 GLU CA C 13 56.640 0.3 . 1 . . . . A 11 GLU CA . 30195 1 79 . 1 1 11 11 GLU CB C 13 26.449 0.3 . 1 . . . . A 11 GLU CB . 30195 1 80 . 1 1 11 11 GLU N N 15 119.943 0.3 . 1 . . . . A 11 GLU N . 30195 1 81 . 1 1 12 12 PHE H H 1 8.736 0.020 . 1 . . . . A 12 PHE H . 30195 1 82 . 1 1 12 12 PHE HA H 1 4.738 0.020 . 1 . . . . A 12 PHE HA . 30195 1 83 . 1 1 12 12 PHE HB2 H 1 3.491 0.020 . 1 . . . . A 12 PHE HB2 . 30195 1 84 . 1 1 12 12 PHE HB3 H 1 3.491 0.020 . 1 . . . . A 12 PHE HB3 . 30195 1 85 . 1 1 12 12 PHE CA C 13 55.663 0.3 . 1 . . . . A 12 PHE CA . 30195 1 86 . 1 1 12 12 PHE CB C 13 34.080 0.3 . 1 . . . . A 12 PHE CB . 30195 1 87 . 1 1 12 12 PHE N N 15 119.942 0.3 . 1 . . . . A 12 PHE N . 30195 1 88 . 1 1 13 13 LYS H H 1 9.187 0.020 . 1 . . . . A 13 LYS H . 30195 1 89 . 1 1 13 13 LYS HA H 1 3.737 0.020 . 1 . . . . A 13 LYS HA . 30195 1 90 . 1 1 13 13 LYS HB2 H 1 1.964 0.020 . 1 . . . . A 13 LYS HB2 . 30195 1 91 . 1 1 13 13 LYS HB3 H 1 1.964 0.020 . 1 . . . . A 13 LYS HB3 . 30195 1 92 . 1 1 13 13 LYS HG2 H 1 1.718 0.020 . 1 . . . . A 13 LYS HG2 . 30195 1 93 . 1 1 13 13 LYS HG3 H 1 1.718 0.020 . 1 . . . . A 13 LYS HG3 . 30195 1 94 . 1 1 13 13 LYS CA C 13 57.144 0.3 . 1 . . . . A 13 LYS CA . 30195 1 95 . 1 1 13 13 LYS CB C 13 29.281 0.3 . 1 . . . . A 13 LYS CB . 30195 1 96 . 1 1 13 13 LYS N N 15 121.350 0.3 . 1 . . . . A 13 LYS N . 30195 1 97 . 1 1 14 14 GLU H H 1 7.986 0.020 . 1 . . . . A 14 GLU H . 30195 1 98 . 1 1 14 14 GLU HA H 1 4.018 0.020 . 1 . . . . A 14 GLU HA . 30195 1 99 . 1 1 14 14 GLU HB2 H 1 2.210 0.020 . 1 . . . . A 14 GLU HB2 . 30195 1 100 . 1 1 14 14 GLU HB3 H 1 2.210 0.020 . 1 . . . . A 14 GLU HB3 . 30195 1 101 . 1 1 14 14 GLU CA C 13 56.774 0.3 . 1 . . . . A 14 GLU CA . 30195 1 102 . 1 1 14 14 GLU CB C 13 26.370 0.3 . 1 . . . . A 14 GLU CB . 30195 1 103 . 1 1 14 14 GLU N N 15 120.528 0.3 . 1 . . . . A 14 GLU N . 30195 1 104 . 1 1 15 15 ALA H H 1 7.582 0.020 . 1 . . . . A 15 ALA H . 30195 1 105 . 1 1 15 15 ALA HA H 1 4.088 0.020 . 1 . . . . A 15 ALA HA . 30195 1 106 . 1 1 15 15 ALA HB1 H 1 1.613 0.020 . 1 . . . . A 15 ALA HB1 . 30195 1 107 . 1 1 15 15 ALA HB2 H 1 1.613 0.020 . 1 . . . . A 15 ALA HB2 . 30195 1 108 . 1 1 15 15 ALA HB3 H 1 1.613 0.020 . 1 . . . . A 15 ALA HB3 . 30195 1 109 . 1 1 15 15 ALA CA C 13 52.364 0.3 . 1 . . . . A 15 ALA CA . 30195 1 110 . 1 1 15 15 ALA CB C 13 16.379 0.3 . 1 . . . . A 15 ALA CB . 30195 1 111 . 1 1 15 15 ALA N N 15 120.583 0.3 . 1 . . . . A 15 ALA N . 30195 1 112 . 1 1 16 16 PHE H H 1 8.581 0.020 . 1 . . . . A 16 PHE H . 30195 1 113 . 1 1 16 16 PHE HA H 1 3.702 0.020 . 1 . . . . A 16 PHE HA . 30195 1 114 . 1 1 16 16 PHE HB2 H 1 2.982 0.020 . 1 . . . . A 16 PHE HB2 . 30195 1 115 . 1 1 16 16 PHE HB3 H 1 2.982 0.020 . 1 . . . . A 16 PHE HB3 . 30195 1 116 . 1 1 16 16 PHE CA C 13 59.400 0.3 . 1 . . . . A 16 PHE CA . 30195 1 117 . 1 1 16 16 PHE CB C 13 37.935 0.3 . 1 . . . . A 16 PHE CB . 30195 1 118 . 1 1 16 16 PHE N N 15 117.456 0.3 . 1 . . . . A 16 PHE N . 30195 1 119 . 1 1 17 17 SER H H 1 8.345 0.020 . 1 . . . . A 17 SER H . 30195 1 120 . 1 1 17 17 SER HA H 1 4.018 0.020 . 1 . . . . A 17 SER HA . 30195 1 121 . 1 1 17 17 SER CA C 13 58.895 0.3 . 1 . . . . A 17 SER CA . 30195 1 122 . 1 1 17 17 SER CB C 13 60.309 0.3 . 1 . . . . A 17 SER CB . 30195 1 123 . 1 1 17 17 SER N N 15 111.656 0.3 . 1 . . . . A 17 SER N . 30195 1 124 . 1 1 18 18 LEU H H 1 7.261 0.020 . 1 . . . . A 18 LEU H . 30195 1 125 . 1 1 18 18 LEU HA H 1 3.913 0.020 . 1 . . . . A 18 LEU HA . 30195 1 126 . 1 1 18 18 LEU HB2 H 1 1.700 0.020 . 1 . . . . A 18 LEU HB2 . 30195 1 127 . 1 1 18 18 LEU HB3 H 1 1.700 0.020 . 1 . . . . A 18 LEU HB3 . 30195 1 128 . 1 1 18 18 LEU HG H 1 1.490 0.020 . 1 . . . . A 18 LEU HG . 30195 1 129 . 1 1 18 18 LEU HD11 H 1 0.752 0.020 . 1 . . . . A 18 LEU HD11 . 30195 1 130 . 1 1 18 18 LEU HD12 H 1 0.752 0.020 . 1 . . . . A 18 LEU HD12 . 30195 1 131 . 1 1 18 18 LEU HD13 H 1 0.752 0.020 . 1 . . . . A 18 LEU HD13 . 30195 1 132 . 1 1 18 18 LEU HD21 H 1 0.752 0.020 . 1 . . . . A 18 LEU HD21 . 30195 1 133 . 1 1 18 18 LEU HD22 H 1 0.752 0.020 . 1 . . . . A 18 LEU HD22 . 30195 1 134 . 1 1 18 18 LEU HD23 H 1 0.752 0.020 . 1 . . . . A 18 LEU HD23 . 30195 1 135 . 1 1 18 18 LEU CA C 13 54.418 0.3 . 1 . . . . A 18 LEU CA . 30195 1 136 . 1 1 18 18 LEU CB C 13 38.879 0.3 . 1 . . . . A 18 LEU CB . 30195 1 137 . 1 1 18 18 LEU N N 15 120.546 0.3 . 1 . . . . A 18 LEU N . 30195 1 138 . 1 1 19 19 PHE H H 1 7.056 0.020 . 1 . . . . A 19 PHE H . 30195 1 139 . 1 1 19 19 PHE HA H 1 4.123 0.020 . 1 . . . . A 19 PHE HA . 30195 1 140 . 1 1 19 19 PHE HB2 H 1 2.912 0.020 . 1 . . . . A 19 PHE HB2 . 30195 1 141 . 1 1 19 19 PHE HB3 H 1 2.912 0.020 . 1 . . . . A 19 PHE HB3 . 30195 1 142 . 1 1 19 19 PHE CA C 13 55.764 0.3 . 1 . . . . A 19 PHE CA . 30195 1 143 . 1 1 19 19 PHE CB C 13 38.171 0.3 . 1 . . . . A 19 PHE CB . 30195 1 144 . 1 1 19 19 PHE N N 15 113.968 0.3 . 1 . . . . A 19 PHE N . 30195 1 145 . 1 1 20 20 ALA H H 1 7.453 0.020 . 1 . . . . A 20 ALA H . 30195 1 146 . 1 1 20 20 ALA HA H 1 4.088 0.020 . 1 . . . . A 20 ALA HA . 30195 1 147 . 1 1 20 20 ALA CA C 13 49.368 0.3 . 1 . . . . A 20 ALA CA . 30195 1 148 . 1 1 20 20 ALA CB C 13 16.615 0.3 . 1 . . . . A 20 ALA CB . 30195 1 149 . 1 1 20 20 ALA N N 15 123.025 0.3 . 1 . . . . A 20 ALA N . 30195 1 150 . 1 1 21 21 LYS H H 1 8.363 0.020 . 1 . . . . A 21 LYS H . 30195 1 151 . 1 1 21 21 LYS HA H 1 4.053 0.020 . 1 . . . . A 21 LYS HA . 30195 1 152 . 1 1 21 21 LYS HB2 H 1 1.753 0.020 . 1 . . . . A 21 LYS HB2 . 30195 1 153 . 1 1 21 21 LYS HB3 H 1 1.753 0.020 . 1 . . . . A 21 LYS HB3 . 30195 1 154 . 1 1 21 21 LYS CA C 13 54.485 0.3 . 1 . . . . A 21 LYS CA . 30195 1 155 . 1 1 21 21 LYS CB C 13 29.910 0.3 . 1 . . . . A 21 LYS CB . 30195 1 156 . 1 1 21 21 LYS N N 15 121.213 0.3 . 1 . . . . A 21 LYS N . 30195 1 157 . 1 1 22 22 ASP H H 1 8.494 0.020 . 1 . . . . A 22 ASP H . 30195 1 158 . 1 1 22 22 ASP HA H 1 4.633 0.020 . 1 . . . . A 22 ASP HA . 30195 1 159 . 1 1 22 22 ASP HB2 H 1 2.561 0.020 . 1 . . . . A 22 ASP HB2 . 30195 1 160 . 1 1 22 22 ASP HB3 H 1 2.561 0.020 . 1 . . . . A 22 ASP HB3 . 30195 1 161 . 1 1 22 22 ASP CA C 13 52.701 0.3 . 1 . . . . A 22 ASP CA . 30195 1 162 . 1 1 22 22 ASP CB C 13 38.221 0.3 . 1 . . . . A 22 ASP CB . 30195 1 163 . 1 1 22 22 ASP N N 15 122.069 0.3 . 1 . . . . A 22 ASP N . 30195 1 164 . 1 1 23 23 GLY H H 1 8.351 0.020 . 1 . . . . A 23 GLY H . 30195 1 165 . 1 1 23 23 GLY HA2 H 1 3.895 0.020 . 1 . . . . A 23 GLY HA2 . 30195 1 166 . 1 1 23 23 GLY HA3 H 1 3.895 0.020 . 1 . . . . A 23 GLY HA3 . 30195 1 167 . 1 1 23 23 GLY CA C 13 43.517 0.3 . 1 . . . . A 23 GLY CA . 30195 1 168 . 1 1 23 23 GLY N N 15 109.345 0.3 . 1 . . . . A 23 GLY N . 30195 1 169 . 1 1 24 24 ASP H H 1 7.985 0.020 . 1 . . . . A 24 ASP H . 30195 1 170 . 1 1 24 24 ASP HA H 1 4.685 0.020 . 1 . . . . A 24 ASP HA . 30195 1 171 . 1 1 24 24 ASP HB2 H 1 2.701 0.020 . 1 . . . . A 24 ASP HB2 . 30195 1 172 . 1 1 24 24 ASP HB3 H 1 2.701 0.020 . 1 . . . . A 24 ASP HB3 . 30195 1 173 . 1 1 24 24 ASP CA C 13 51.624 0.3 . 1 . . . . A 24 ASP CA . 30195 1 174 . 1 1 24 24 ASP CB C 13 38.596 0.3 . 1 . . . . A 24 ASP CB . 30195 1 175 . 1 1 24 24 ASP N N 15 119.784 0.3 . 1 . . . . A 24 ASP N . 30195 1 176 . 1 1 25 25 GLY H H 1 8.322 0.020 . 1 . . . . A 25 GLY H . 30195 1 177 . 1 1 25 25 GLY HA2 H 1 3.983 0.020 . 1 . . . . A 25 GLY HA2 . 30195 1 178 . 1 1 25 25 GLY HA3 H 1 3.983 0.020 . 1 . . . . A 25 GLY HA3 . 30195 1 179 . 1 1 25 25 GLY CA C 13 43.570 0.3 . 1 . . . . A 25 GLY CA . 30195 1 180 . 1 1 25 25 GLY N N 15 106.551 0.3 . 1 . . . . A 25 GLY N . 30195 1 181 . 1 1 26 26 THR H H 1 7.523 0.020 . 1 . . . . A 26 THR H . 30195 1 182 . 1 1 26 26 THR HA H 1 5.230 0.020 . 1 . . . . A 26 THR HA . 30195 1 183 . 1 1 26 26 THR HB H 1 4.018 0.020 . 1 . . . . A 26 THR HB . 30195 1 184 . 1 1 26 26 THR HG21 H 1 0.963 0.020 . 1 . . . . A 26 THR HG21 . 30195 1 185 . 1 1 26 26 THR HG22 H 1 0.963 0.020 . 1 . . . . A 26 THR HG22 . 30195 1 186 . 1 1 26 26 THR HG23 H 1 0.963 0.020 . 1 . . . . A 26 THR HG23 . 30195 1 187 . 1 1 26 26 THR CA C 13 57.043 0.3 . 1 . . . . A 26 THR CA . 30195 1 188 . 1 1 26 26 THR CB C 13 70.033 0.3 . 1 . . . . A 26 THR CB . 30195 1 189 . 1 1 26 26 THR N N 15 107.782 0.3 . 1 . . . . A 26 THR N . 30195 1 190 . 1 1 27 27 ILE H H 1 8.432 0.020 . 1 . . . . A 27 ILE H . 30195 1 191 . 1 1 27 27 ILE HA H 1 4.720 0.020 . 1 . . . . A 27 ILE HA . 30195 1 192 . 1 1 27 27 ILE HB H 1 1.753 0.020 . 1 . . . . A 27 ILE HB . 30195 1 193 . 1 1 27 27 ILE HG12 H 1 1.103 0.020 . 1 . . . . A 27 ILE HG12 . 30195 1 194 . 1 1 27 27 ILE HG13 H 1 1.103 0.020 . 1 . . . . A 27 ILE HG13 . 30195 1 195 . 1 1 27 27 ILE HG21 H 1 0.805 0.020 . 1 . . . . A 27 ILE HG21 . 30195 1 196 . 1 1 27 27 ILE HG22 H 1 0.805 0.020 . 1 . . . . A 27 ILE HG22 . 30195 1 197 . 1 1 27 27 ILE HG23 H 1 0.805 0.020 . 1 . . . . A 27 ILE HG23 . 30195 1 198 . 1 1 27 27 ILE HD11 H 1 0.577 0.020 . 1 . . . . A 27 ILE HD11 . 30195 1 199 . 1 1 27 27 ILE HD12 H 1 0.577 0.020 . 1 . . . . A 27 ILE HD12 . 30195 1 200 . 1 1 27 27 ILE HD13 H 1 0.577 0.020 . 1 . . . . A 27 ILE HD13 . 30195 1 201 . 1 1 27 27 ILE CA C 13 56.808 0.3 . 1 . . . . A 27 ILE CA . 30195 1 202 . 1 1 27 27 ILE CB C 13 37.847 0.3 . 1 . . . . A 27 ILE CB . 30195 1 203 . 1 1 27 27 ILE N N 15 111.325 0.3 . 1 . . . . A 27 ILE N . 30195 1 204 . 1 1 28 28 THR H H 1 8.538 0.020 . 1 . . . . A 28 THR H . 30195 1 205 . 1 1 28 28 THR HA H 1 4.896 0.020 . 1 . . . . A 28 THR HA . 30195 1 206 . 1 1 28 28 THR HB H 1 3.948 0.020 . 1 . . . . A 28 THR HB . 30195 1 207 . 1 1 28 28 THR HG21 H 1 1.121 0.020 . 1 . . . . A 28 THR HG21 . 30195 1 208 . 1 1 28 28 THR HG22 H 1 1.121 0.020 . 1 . . . . A 28 THR HG22 . 30195 1 209 . 1 1 28 28 THR HG23 H 1 1.121 0.020 . 1 . . . . A 28 THR HG23 . 30195 1 210 . 1 1 28 28 THR CA C 13 57.785 0.3 . 1 . . . . A 28 THR CA . 30195 1 211 . 1 1 28 28 THR CB C 13 68.629 0.3 . 1 . . . . A 28 THR CB . 30195 1 212 . 1 1 28 28 THR N N 15 110.566 0.3 . 1 . . . . A 28 THR N . 30195 1 213 . 1 1 29 29 THR H H 1 8.215 0.020 . 1 . . . . A 29 THR H . 30195 1 214 . 1 1 29 29 THR HA H 1 3.720 0.020 . 1 . . . . A 29 THR HA . 30195 1 215 . 1 1 29 29 THR HB H 1 4.720 0.020 . 1 . . . . A 29 THR HB . 30195 1 216 . 1 1 29 29 THR HG21 H 1 1.209 0.020 . 1 . . . . A 29 THR HG21 . 30195 1 217 . 1 1 29 29 THR HG22 H 1 1.209 0.020 . 1 . . . . A 29 THR HG22 . 30195 1 218 . 1 1 29 29 THR HG23 H 1 1.209 0.020 . 1 . . . . A 29 THR HG23 . 30195 1 219 . 1 1 29 29 THR CA C 13 62.770 0.3 . 1 . . . . A 29 THR CA . 30195 1 220 . 1 1 29 29 THR CB C 13 64.887 0.3 . 1 . . . . A 29 THR CB . 30195 1 221 . 1 1 29 29 THR N N 15 110.671 0.3 . 1 . . . . A 29 THR N . 30195 1 222 . 1 1 30 30 LYS H H 1 7.571 0.020 . 1 . . . . A 30 LYS H . 30195 1 223 . 1 1 30 30 LYS HA H 1 4.123 0.020 . 1 . . . . A 30 LYS HA . 30195 1 224 . 1 1 30 30 LYS HB2 H 1 1.841 0.020 . 1 . . . . A 30 LYS HB2 . 30195 1 225 . 1 1 30 30 LYS HB3 H 1 1.841 0.020 . 1 . . . . A 30 LYS HB3 . 30195 1 226 . 1 1 30 30 LYS HG2 H 1 1.542 0.020 . 1 . . . . A 30 LYS HG2 . 30195 1 227 . 1 1 30 30 LYS HG3 H 1 1.542 0.020 . 1 . . . . A 30 LYS HG3 . 30195 1 228 . 1 1 30 30 LYS CA C 13 55.697 0.3 . 1 . . . . A 30 LYS CA . 30195 1 229 . 1 1 30 30 LYS CB C 13 29.360 0.3 . 1 . . . . A 30 LYS CB . 30195 1 230 . 1 1 30 30 LYS N N 15 119.083 0.3 . 1 . . . . A 30 LYS N . 30195 1 231 . 1 1 31 31 GLU H H 1 7.478 0.020 . 1 . . . . A 31 GLU H . 30195 1 232 . 1 1 31 31 GLU HA H 1 4.018 0.020 . 1 . . . . A 31 GLU HA . 30195 1 233 . 1 1 31 31 GLU HB2 H 1 1.911 0.020 . 1 . . . . A 31 GLU HB2 . 30195 1 234 . 1 1 31 31 GLU HB3 H 1 1.911 0.020 . 1 . . . . A 31 GLU HB3 . 30195 1 235 . 1 1 31 31 GLU HG2 H 1 2.157 0.020 . 1 . . . . A 31 GLU HG2 . 30195 1 236 . 1 1 31 31 GLU HG3 H 1 2.157 0.020 . 1 . . . . A 31 GLU HG3 . 30195 1 237 . 1 1 31 31 GLU CA C 13 54.115 0.3 . 1 . . . . A 31 GLU CA . 30195 1 238 . 1 1 31 31 GLU CB C 13 27.235 0.3 . 1 . . . . A 31 GLU CB . 30195 1 239 . 1 1 31 31 GLU N N 15 118.126 0.3 . 1 . . . . A 31 GLU N . 30195 1 240 . 1 1 32 32 LEU H H 1 7.370 0.020 . 1 . . . . A 32 LEU H . 30195 1 241 . 1 1 32 32 LEU HA H 1 3.807 0.020 . 1 . . . . A 32 LEU HA . 30195 1 242 . 1 1 32 32 LEU HB2 H 1 1.771 0.020 . 1 . . . . A 32 LEU HB2 . 30195 1 243 . 1 1 32 32 LEU HB3 H 1 1.771 0.020 . 1 . . . . A 32 LEU HB3 . 30195 1 244 . 1 1 32 32 LEU HG H 1 1.244 0.020 . 1 . . . . A 32 LEU HG . 30195 1 245 . 1 1 32 32 LEU HD11 H 1 0.735 0.020 . 1 . . . . A 32 LEU HD11 . 30195 1 246 . 1 1 32 32 LEU HD12 H 1 0.735 0.020 . 1 . . . . A 32 LEU HD12 . 30195 1 247 . 1 1 32 32 LEU HD13 H 1 0.735 0.020 . 1 . . . . A 32 LEU HD13 . 30195 1 248 . 1 1 32 32 LEU CA C 13 55.865 0.3 . 1 . . . . A 32 LEU CA . 30195 1 249 . 1 1 32 32 LEU CB C 13 39.033 0.3 . 1 . . . . A 32 LEU CB . 30195 1 250 . 1 1 32 32 LEU N N 15 120.459 0.3 . 1 . . . . A 32 LEU N . 30195 1 251 . 1 1 33 33 GLY H H 1 8.523 0.020 . 1 . . . . A 33 GLY H . 30195 1 252 . 1 1 33 33 GLY HA2 H 1 3.737 0.020 . 2 . . . . A 33 GLY HA2 . 30195 1 253 . 1 1 33 33 GLY HA3 H 1 3.351 0.020 . 2 . . . . A 33 GLY HA3 . 30195 1 254 . 1 1 33 33 GLY CA C 13 45.320 0.3 . 1 . . . . A 33 GLY CA . 30195 1 255 . 1 1 33 33 GLY N N 15 104.903 0.3 . 1 . . . . A 33 GLY N . 30195 1 256 . 1 1 34 34 THR H H 1 7.385 0.020 . 1 . . . . A 34 THR H . 30195 1 257 . 1 1 34 34 THR HA H 1 3.737 0.020 . 1 . . . . A 34 THR HA . 30195 1 258 . 1 1 34 34 THR HB H 1 4.001 0.020 . 1 . . . . A 34 THR HB . 30195 1 259 . 1 1 34 34 THR HG21 H 1 1.068 0.020 . 1 . . . . A 34 THR HG21 . 30195 1 260 . 1 1 34 34 THR HG22 H 1 1.068 0.020 . 1 . . . . A 34 THR HG22 . 30195 1 261 . 1 1 34 34 THR HG23 H 1 1.068 0.020 . 1 . . . . A 34 THR HG23 . 30195 1 262 . 1 1 34 34 THR CA C 13 63.608 0.3 . 1 . . . . A 34 THR CA . 30195 1 263 . 1 1 34 34 THR CB C 13 65.526 0.3 . 1 . . . . A 34 THR CB . 30195 1 264 . 1 1 34 34 THR N N 15 118.195 0.3 . 1 . . . . A 34 THR N . 30195 1 265 . 1 1 35 35 VAL H H 1 7.930 0.020 . 1 . . . . A 35 VAL H . 30195 1 266 . 1 1 35 35 VAL HA H 1 3.175 0.020 . 1 . . . . A 35 VAL HA . 30195 1 267 . 1 1 35 35 VAL HB H 1 1.876 0.020 . 1 . . . . A 35 VAL HB . 30195 1 268 . 1 1 35 35 VAL HG11 H 1 0.700 0.020 . 2 . . . . A 35 VAL HG11 . 30195 1 269 . 1 1 35 35 VAL HG12 H 1 0.700 0.020 . 2 . . . . A 35 VAL HG12 . 30195 1 270 . 1 1 35 35 VAL HG13 H 1 0.700 0.020 . 2 . . . . A 35 VAL HG13 . 30195 1 271 . 1 1 35 35 VAL HG21 H 1 0.471 0.020 . 2 . . . . A 35 VAL HG21 . 30195 1 272 . 1 1 35 35 VAL HG22 H 1 0.471 0.020 . 2 . . . . A 35 VAL HG22 . 30195 1 273 . 1 1 35 35 VAL HG23 H 1 0.471 0.020 . 2 . . . . A 35 VAL HG23 . 30195 1 274 . 1 1 35 35 VAL CA C 13 63.709 0.3 . 1 . . . . A 35 VAL CA . 30195 1 275 . 1 1 35 35 VAL CB C 13 28.415 0.3 . 1 . . . . A 35 VAL CB . 30195 1 276 . 1 1 35 35 VAL N N 15 122.390 0.3 . 1 . . . . A 35 VAL N . 30195 1 277 . 1 1 36 36 MET H H 1 8.353 0.020 . 1 . . . . A 36 MET H . 30195 1 278 . 1 1 36 36 MET HA H 1 3.913 0.020 . 1 . . . . A 36 MET HA . 30195 1 279 . 1 1 36 36 MET HB2 H 1 1.929 0.020 . 1 . . . . A 36 MET HB2 . 30195 1 280 . 1 1 36 36 MET HB3 H 1 1.929 0.020 . 1 . . . . A 36 MET HB3 . 30195 1 281 . 1 1 36 36 MET HG2 H 1 2.052 0.020 . 1 . . . . A 36 MET HG2 . 30195 1 282 . 1 1 36 36 MET HG3 H 1 2.052 0.020 . 1 . . . . A 36 MET HG3 . 30195 1 283 . 1 1 36 36 MET CA C 13 57.515 0.3 . 1 . . . . A 36 MET CA . 30195 1 284 . 1 1 36 36 MET CB C 13 29.045 0.3 . 1 . . . . A 36 MET CB . 30195 1 285 . 1 1 36 36 MET N N 15 118.092 0.3 . 1 . . . . A 36 MET N . 30195 1 286 . 1 1 37 37 ARG H H 1 8.422 0.020 . 1 . . . . A 37 ARG H . 30195 1 287 . 1 1 37 37 ARG HA H 1 4.633 0.020 . 1 . . . . A 37 ARG HA . 30195 1 288 . 1 1 37 37 ARG HB2 H 1 1.823 0.020 . 1 . . . . A 37 ARG HB2 . 30195 1 289 . 1 1 37 37 ARG HB3 H 1 1.823 0.020 . 1 . . . . A 37 ARG HB3 . 30195 1 290 . 1 1 37 37 ARG HG2 H 1 1.595 0.020 . 1 . . . . A 37 ARG HG2 . 30195 1 291 . 1 1 37 37 ARG HG3 H 1 1.595 0.020 . 1 . . . . A 37 ARG HG3 . 30195 1 292 . 1 1 37 37 ARG CA C 13 56.505 0.3 . 1 . . . . A 37 ARG CA . 30195 1 293 . 1 1 37 37 ARG CB C 13 27.078 0.3 . 1 . . . . A 37 ARG CB . 30195 1 294 . 1 1 37 37 ARG N N 15 119.169 0.3 . 1 . . . . A 37 ARG N . 30195 1 295 . 1 1 38 38 SER H H 1 8.001 0.020 . 1 . . . . A 38 SER H . 30195 1 296 . 1 1 38 38 SER HA H 1 4.176 0.020 . 1 . . . . A 38 SER HA . 30195 1 297 . 1 1 38 38 SER CA C 13 59.030 0.3 . 1 . . . . A 38 SER CA . 30195 1 298 . 1 1 38 38 SER CB C 13 60.208 0.3 . 1 . . . . A 38 SER CB . 30195 1 299 . 1 1 38 38 SER N N 15 118.814 0.3 . 1 . . . . A 38 SER N . 30195 1 300 . 1 1 39 39 LEU H H 1 7.261 0.020 . 1 . . . . A 39 LEU H . 30195 1 301 . 1 1 39 39 LEU HA H 1 4.650 0.020 . 1 . . . . A 39 LEU HA . 30195 1 302 . 1 1 39 39 LEU HB2 H 1 1.858 0.020 . 1 . . . . A 39 LEU HB2 . 30195 1 303 . 1 1 39 39 LEU HB3 H 1 1.858 0.020 . 1 . . . . A 39 LEU HB3 . 30195 1 304 . 1 1 39 39 LEU HG H 1 1.700 0.020 . 1 . . . . A 39 LEU HG . 30195 1 305 . 1 1 39 39 LEU HD11 H 1 0.928 0.020 . 1 . . . . A 39 LEU HD11 . 30195 1 306 . 1 1 39 39 LEU HD12 H 1 0.928 0.020 . 1 . . . . A 39 LEU HD12 . 30195 1 307 . 1 1 39 39 LEU HD13 H 1 0.928 0.020 . 1 . . . . A 39 LEU HD13 . 30195 1 308 . 1 1 39 39 LEU CA C 13 51.826 0.3 . 1 . . . . A 39 LEU CA . 30195 1 309 . 1 1 39 39 LEU CB C 13 39.970 0.3 . 1 . . . . A 39 LEU CB . 30195 1 310 . 1 1 39 39 LEU N N 15 120.675 0.3 . 1 . . . . A 39 LEU N . 30195 1 311 . 1 1 40 40 GLY H H 1 7.859 0.020 . 1 . . . . A 40 GLY H . 30195 1 312 . 1 1 40 40 GLY HA2 H 1 4.334 0.020 . 2 . . . . A 40 GLY HA2 . 30195 1 313 . 1 1 40 40 GLY HA3 H 1 3.755 0.020 . 2 . . . . A 40 GLY HA3 . 30195 1 314 . 1 1 40 40 GLY CA C 13 42.969 0.3 . 1 . . . . A 40 GLY CA . 30195 1 315 . 1 1 40 40 GLY N N 15 106.965 0.3 . 1 . . . . A 40 GLY N . 30195 1 316 . 1 1 41 41 GLN H H 1 7.673 0.020 . 1 . . . . A 41 GLN H . 30195 1 317 . 1 1 41 41 GLN HA H 1 4.334 0.020 . 1 . . . . A 41 GLN HA . 30195 1 318 . 1 1 41 41 GLN HB2 H 1 1.718 0.020 . 1 . . . . A 41 GLN HB2 . 30195 1 319 . 1 1 41 41 GLN HB3 H 1 1.718 0.020 . 1 . . . . A 41 GLN HB3 . 30195 1 320 . 1 1 41 41 GLN HG2 H 1 1.981 0.020 . 1 . . . . A 41 GLN HG2 . 30195 1 321 . 1 1 41 41 GLN HG3 H 1 1.981 0.020 . 1 . . . . A 41 GLN HG3 . 30195 1 322 . 1 1 41 41 GLN CA C 13 51.355 0.3 . 1 . . . . A 41 GLN CA . 30195 1 323 . 1 1 41 41 GLN CB C 13 27.235 0.3 . 1 . . . . A 41 GLN CB . 30195 1 324 . 1 1 41 41 GLN N N 15 117.583 0.3 . 1 . . . . A 41 GLN N . 30195 1 325 . 1 1 42 42 ASN H H 1 8.605 0.020 . 1 . . . . A 42 ASN H . 30195 1 326 . 1 1 42 42 ASN HA H 1 5.107 0.020 . 1 . . . . A 42 ASN HA . 30195 1 327 . 1 1 42 42 ASN HB2 H 1 2.631 0.020 . 1 . . . . A 42 ASN HB2 . 30195 1 328 . 1 1 42 42 ASN HB3 H 1 2.631 0.020 . 1 . . . . A 42 ASN HB3 . 30195 1 329 . 1 1 42 42 ASN CA C 13 48.325 0.3 . 1 . . . . A 42 ASN CA . 30195 1 330 . 1 1 42 42 ASN N N 15 116.352 0.3 . 1 . . . . A 42 ASN N . 30195 1 331 . 1 1 44 44 THR H H 1 8.680 0.020 . 1 . . . . A 44 THR H . 30195 1 332 . 1 1 44 44 THR HA H 1 4.290 0.020 . 1 . . . . A 44 THR HA . 30195 1 333 . 1 1 44 44 THR HB H 1 4.613 0.020 . 1 . . . . A 44 THR HB . 30195 1 334 . 1 1 44 44 THR HG21 H 1 1.287 0.020 . 1 . . . . A 44 THR HG21 . 30195 1 335 . 1 1 44 44 THR HG22 H 1 1.287 0.020 . 1 . . . . A 44 THR HG22 . 30195 1 336 . 1 1 44 44 THR HG23 H 1 1.287 0.020 . 1 . . . . A 44 THR HG23 . 30195 1 337 . 1 1 44 44 THR CA C 13 57.851 0.3 . 1 . . . . A 44 THR CA . 30195 1 338 . 1 1 44 44 THR CB C 13 68.145 0.3 . 1 . . . . A 44 THR CB . 30195 1 339 . 1 1 44 44 THR N N 15 112.844 0.3 . 1 . . . . A 44 THR N . 30195 1 340 . 1 1 45 45 GLU H H 1 8.777 0.020 . 1 . . . . A 45 GLU H . 30195 1 341 . 1 1 45 45 GLU HA H 1 3.817 0.020 . 1 . . . . A 45 GLU HA . 30195 1 342 . 1 1 45 45 GLU HB2 H 1 1.977 0.020 . 1 . . . . A 45 GLU HB2 . 30195 1 343 . 1 1 45 45 GLU HB3 H 1 1.977 0.020 . 1 . . . . A 45 GLU HB3 . 30195 1 344 . 1 1 45 45 GLU HG2 H 1 2.200 0.020 . 1 . . . . A 45 GLU HG2 . 30195 1 345 . 1 1 45 45 GLU HG3 H 1 2.200 0.020 . 1 . . . . A 45 GLU HG3 . 30195 1 346 . 1 1 45 45 GLU CA C 13 57.212 0.3 . 1 . . . . A 45 GLU CA . 30195 1 347 . 1 1 45 45 GLU CB C 13 26.134 0.3 . 1 . . . . A 45 GLU CB . 30195 1 348 . 1 1 45 45 GLU N N 15 120.218 0.3 . 1 . . . . A 45 GLU N . 30195 1 349 . 1 1 46 46 ALA H H 1 8.245 0.020 . 1 . . . . A 46 ALA H . 30195 1 350 . 1 1 46 46 ALA HA H 1 4.016 0.020 . 1 . . . . A 46 ALA HA . 30195 1 351 . 1 1 46 46 ALA HB1 H 1 1.380 0.020 . 1 . . . . A 46 ALA HB1 . 30195 1 352 . 1 1 46 46 ALA HB2 H 1 1.380 0.020 . 1 . . . . A 46 ALA HB2 . 30195 1 353 . 1 1 46 46 ALA HB3 H 1 1.380 0.020 . 1 . . . . A 46 ALA HB3 . 30195 1 354 . 1 1 46 46 ALA CA C 13 52.230 0.3 . 1 . . . . A 46 ALA CA . 30195 1 355 . 1 1 46 46 ALA CB C 13 15.356 0.3 . 1 . . . . A 46 ALA CB . 30195 1 356 . 1 1 46 46 ALA N N 15 120.747 0.3 . 1 . . . . A 46 ALA N . 30195 1 357 . 1 1 47 47 GLU H H 1 7.669 0.020 . 1 . . . . A 47 GLU H . 30195 1 358 . 1 1 47 47 GLU HA H 1 3.991 0.020 . 1 . . . . A 47 GLU HA . 30195 1 359 . 1 1 47 47 GLU HB2 H 1 1.877 0.020 . 1 . . . . A 47 GLU HB2 . 30195 1 360 . 1 1 47 47 GLU HB3 H 1 1.877 0.020 . 1 . . . . A 47 GLU HB3 . 30195 1 361 . 1 1 47 47 GLU HG2 H 1 2.176 0.020 . 1 . . . . A 47 GLU HG2 . 30195 1 362 . 1 1 47 47 GLU HG3 H 1 2.176 0.020 . 1 . . . . A 47 GLU HG3 . 30195 1 363 . 1 1 47 47 GLU CA C 13 56.168 0.3 . 1 . . . . A 47 GLU CA . 30195 1 364 . 1 1 47 47 GLU CB C 13 27.078 0.3 . 1 . . . . A 47 GLU CB . 30195 1 365 . 1 1 47 47 GLU N N 15 118.663 0.3 . 1 . . . . A 47 GLU N . 30195 1 366 . 1 1 48 48 LEU H H 1 8.175 0.020 . 1 . . . . A 48 LEU H . 30195 1 367 . 1 1 48 48 LEU HA H 1 3.966 0.020 . 1 . . . . A 48 LEU HA . 30195 1 368 . 1 1 48 48 LEU HB2 H 1 1.504 0.020 . 1 . . . . A 48 LEU HB2 . 30195 1 369 . 1 1 48 48 LEU HB3 H 1 1.504 0.020 . 1 . . . . A 48 LEU HB3 . 30195 1 370 . 1 1 48 48 LEU HG H 1 1.628 0.020 . 1 . . . . A 48 LEU HG . 30195 1 371 . 1 1 48 48 LEU HD11 H 1 0.708 0.020 . 1 . . . . A 48 LEU HD11 . 30195 1 372 . 1 1 48 48 LEU HD12 H 1 0.708 0.020 . 1 . . . . A 48 LEU HD12 . 30195 1 373 . 1 1 48 48 LEU HD13 H 1 0.708 0.020 . 1 . . . . A 48 LEU HD13 . 30195 1 374 . 1 1 48 48 LEU HD21 H 1 0.708 0.020 . 1 . . . . A 48 LEU HD21 . 30195 1 375 . 1 1 48 48 LEU HD22 H 1 0.708 0.020 . 1 . . . . A 48 LEU HD22 . 30195 1 376 . 1 1 48 48 LEU HD23 H 1 0.708 0.020 . 1 . . . . A 48 LEU HD23 . 30195 1 377 . 1 1 48 48 LEU CA C 13 55.394 0.3 . 1 . . . . A 48 LEU CA . 30195 1 378 . 1 1 48 48 LEU CB C 13 38.958 0.3 . 1 . . . . A 48 LEU CB . 30195 1 379 . 1 1 48 48 LEU N N 15 119.754 0.3 . 1 . . . . A 48 LEU N . 30195 1 380 . 1 1 49 49 GLN H H 1 7.979 0.020 . 1 . . . . A 49 GLN H . 30195 1 381 . 1 1 49 49 GLN HA H 1 3.867 0.020 . 1 . . . . A 49 GLN HA . 30195 1 382 . 1 1 49 49 GLN HB2 H 1 1.943 0.020 . 1 . . . . A 49 GLN HB2 . 30195 1 383 . 1 1 49 49 GLN HB3 H 1 1.943 0.020 . 1 . . . . A 49 GLN HB3 . 30195 1 384 . 1 1 49 49 GLN HG2 H 1 2.180 0.020 . 1 . . . . A 49 GLN HG2 . 30195 1 385 . 1 1 49 49 GLN HG3 H 1 2.180 0.020 . 1 . . . . A 49 GLN HG3 . 30195 1 386 . 1 1 49 49 GLN CA C 13 55.899 0.3 . 1 . . . . A 49 GLN CA . 30195 1 387 . 1 1 49 49 GLN CB C 13 25.269 0.3 . 1 . . . . A 49 GLN CB . 30195 1 388 . 1 1 49 49 GLN N N 15 117.263 0.3 . 1 . . . . A 49 GLN N . 30195 1 389 . 1 1 50 50 ASP H H 1 7.829 0.020 . 1 . . . . A 50 ASP H . 30195 1 390 . 1 1 50 50 ASP HA H 1 4.086 0.020 . 1 . . . . A 50 ASP HA . 30195 1 391 . 1 1 50 50 ASP HB2 H 1 2.652 0.020 . 1 . . . . A 50 ASP HB2 . 30195 1 392 . 1 1 50 50 ASP HB3 H 1 2.652 0.020 . 1 . . . . A 50 ASP HB3 . 30195 1 393 . 1 1 50 50 ASP CA C 13 54.721 0.3 . 1 . . . . A 50 ASP CA . 30195 1 394 . 1 1 50 50 ASP CB C 13 37.620 0.3 . 1 . . . . A 50 ASP CB . 30195 1 395 . 1 1 50 50 ASP N N 15 118.830 0.3 . 1 . . . . A 50 ASP N . 30195 1 396 . 1 1 51 51 MET H H 1 7.829 0.020 . 1 . . . . A 51 MET H . 30195 1 397 . 1 1 51 51 MET HA H 1 4.002 0.020 . 1 . . . . A 51 MET HA . 30195 1 398 . 1 1 51 51 MET HB2 H 1 2.146 0.020 . 1 . . . . A 51 MET HB2 . 30195 1 399 . 1 1 51 51 MET HB3 H 1 2.146 0.020 . 1 . . . . A 51 MET HB3 . 30195 1 400 . 1 1 51 51 MET HG2 H 1 1.910 0.020 . 1 . . . . A 51 MET HG2 . 30195 1 401 . 1 1 51 51 MET HG3 H 1 1.910 0.020 . 1 . . . . A 51 MET HG3 . 30195 1 402 . 1 1 51 51 MET CA C 13 57.010 0.3 . 1 . . . . A 51 MET CA . 30195 1 403 . 1 1 51 51 MET CB C 13 31.090 0.3 . 1 . . . . A 51 MET CB . 30195 1 404 . 1 1 51 51 MET N N 15 118.630 0.3 . 1 . . . . A 51 MET N . 30195 1 405 . 1 1 52 52 ILE H H 1 8.132 0.020 . 1 . . . . A 52 ILE H . 30195 1 406 . 1 1 52 52 ILE HA H 1 3.388 0.020 . 1 . . . . A 52 ILE HA . 30195 1 407 . 1 1 52 52 ILE HB H 1 1.859 0.020 . 1 . . . . A 52 ILE HB . 30195 1 408 . 1 1 52 52 ILE HG21 H 1 0.813 0.020 . 1 . . . . A 52 ILE HG21 . 30195 1 409 . 1 1 52 52 ILE HG22 H 1 0.813 0.020 . 1 . . . . A 52 ILE HG22 . 30195 1 410 . 1 1 52 52 ILE HG23 H 1 0.813 0.020 . 1 . . . . A 52 ILE HG23 . 30195 1 411 . 1 1 52 52 ILE HD11 H 1 0.728 0.020 . 1 . . . . A 52 ILE HD11 . 30195 1 412 . 1 1 52 52 ILE HD12 H 1 0.728 0.020 . 1 . . . . A 52 ILE HD12 . 30195 1 413 . 1 1 52 52 ILE HD13 H 1 0.728 0.020 . 1 . . . . A 52 ILE HD13 . 30195 1 414 . 1 1 52 52 ILE CA C 13 62.463 0.3 . 1 . . . . A 52 ILE CA . 30195 1 415 . 1 1 52 52 ILE CB C 13 35.181 0.3 . 1 . . . . A 52 ILE CB . 30195 1 416 . 1 1 52 52 ILE N N 15 118.575 0.3 . 1 . . . . A 52 ILE N . 30195 1 417 . 1 1 53 53 ASN H H 1 8.230 0.020 . 1 . . . . A 53 ASN H . 30195 1 418 . 1 1 53 53 ASN HA H 1 4.356 0.020 . 1 . . . . A 53 ASN HA . 30195 1 419 . 1 1 53 53 ASN HB2 H 1 2.821 0.020 . 1 . . . . A 53 ASN HB2 . 30195 1 420 . 1 1 53 53 ASN HB3 H 1 2.821 0.020 . 1 . . . . A 53 ASN HB3 . 30195 1 421 . 1 1 53 53 ASN CA C 13 52.600 0.3 . 1 . . . . A 53 ASN CA . 30195 1 422 . 1 1 53 53 ASN CB C 13 35.260 0.3 . 1 . . . . A 53 ASN CB . 30195 1 423 . 1 1 53 53 ASN N N 15 117.456 0.3 . 1 . . . . A 53 ASN N . 30195 1 424 . 1 1 54 54 GLU H H 1 7.656 0.020 . 1 . . . . A 54 GLU H . 30195 1 425 . 1 1 54 54 GLU HA H 1 4.103 0.020 . 1 . . . . A 54 GLU HA . 30195 1 426 . 1 1 54 54 GLU HB2 H 1 2.011 0.020 . 1 . . . . A 54 GLU HB2 . 30195 1 427 . 1 1 54 54 GLU HB3 H 1 2.011 0.020 . 1 . . . . A 54 GLU HB3 . 30195 1 428 . 1 1 54 54 GLU HG2 H 1 2.163 0.020 . 1 . . . . A 54 GLU HG2 . 30195 1 429 . 1 1 54 54 GLU HG3 H 1 2.163 0.020 . 1 . . . . A 54 GLU HG3 . 30195 1 430 . 1 1 54 54 GLU CA C 13 55.630 0.3 . 1 . . . . A 54 GLU CA . 30195 1 431 . 1 1 54 54 GLU CB C 13 27.235 0.3 . 1 . . . . A 54 GLU CB . 30195 1 432 . 1 1 54 54 GLU N N 15 117.344 0.3 . 1 . . . . A 54 GLU N . 30195 1 433 . 1 1 55 55 VAL H H 1 7.460 0.020 . 1 . . . . A 55 VAL H . 30195 1 434 . 1 1 55 55 VAL HA H 1 4.187 0.020 . 1 . . . . A 55 VAL HA . 30195 1 435 . 1 1 55 55 VAL HB H 1 2.095 0.020 . 1 . . . . A 55 VAL HB . 30195 1 436 . 1 1 55 55 VAL HG11 H 1 0.880 0.020 . 2 . . . . A 55 VAL HG11 . 30195 1 437 . 1 1 55 55 VAL HG12 H 1 0.880 0.020 . 2 . . . . A 55 VAL HG12 . 30195 1 438 . 1 1 55 55 VAL HG13 H 1 0.880 0.020 . 2 . . . . A 55 VAL HG13 . 30195 1 439 . 1 1 55 55 VAL HG21 H 1 0.745 0.020 . 2 . . . . A 55 VAL HG21 . 30195 1 440 . 1 1 55 55 VAL HG22 H 1 0.745 0.020 . 2 . . . . A 55 VAL HG22 . 30195 1 441 . 1 1 55 55 VAL HG23 H 1 0.745 0.020 . 2 . . . . A 55 VAL HG23 . 30195 1 442 . 1 1 55 55 VAL CA C 13 59.905 0.3 . 1 . . . . A 55 VAL CA . 30195 1 443 . 1 1 55 55 VAL CB C 13 29.989 0.3 . 1 . . . . A 55 VAL CB . 30195 1 444 . 1 1 55 55 VAL N N 15 113.904 0.3 . 1 . . . . A 55 VAL N . 30195 1 445 . 1 1 56 56 ALA H H 1 8.202 0.020 . 1 . . . . A 56 ALA H . 30195 1 446 . 1 1 56 56 ALA HA H 1 4.238 0.020 . 1 . . . . A 56 ALA HA . 30195 1 447 . 1 1 56 56 ALA HB1 H 1 1.319 0.020 . 1 . . . . A 56 ALA HB1 . 30195 1 448 . 1 1 56 56 ALA HB2 H 1 1.319 0.020 . 1 . . . . A 56 ALA HB2 . 30195 1 449 . 1 1 56 56 ALA HB3 H 1 1.319 0.020 . 1 . . . . A 56 ALA HB3 . 30195 1 450 . 1 1 56 56 ALA CA C 13 49.570 0.3 . 1 . . . . A 56 ALA CA . 30195 1 451 . 1 1 56 56 ALA CB C 13 16.300 0.3 . 1 . . . . A 56 ALA CB . 30195 1 452 . 1 1 56 56 ALA N N 15 124.057 0.3 . 1 . . . . A 56 ALA N . 30195 1 453 . 1 1 57 57 ALA H H 1 8.152 0.020 . 1 . . . . A 57 ALA H . 30195 1 454 . 1 1 57 57 ALA HA H 1 4.187 0.020 . 1 . . . . A 57 ALA HA . 30195 1 455 . 1 1 57 57 ALA HB1 H 1 1.353 0.020 . 1 . . . . A 57 ALA HB1 . 30195 1 456 . 1 1 57 57 ALA HB2 H 1 1.353 0.020 . 1 . . . . A 57 ALA HB2 . 30195 1 457 . 1 1 57 57 ALA HB3 H 1 1.353 0.020 . 1 . . . . A 57 ALA HB3 . 30195 1 458 . 1 1 57 57 ALA CA C 13 51.220 0.3 . 1 . . . . A 57 ALA CA . 30195 1 459 . 1 1 57 57 ALA CB C 13 16.143 0.3 . 1 . . . . A 57 ALA CB . 30195 1 460 . 1 1 57 57 ALA N N 15 123.284 0.3 . 1 . . . . A 57 ALA N . 30195 1 461 . 1 1 58 58 ASP H H 1 8.239 0.020 . 1 . . . . A 58 ASP H . 30195 1 462 . 1 1 58 58 ASP HA H 1 4.677 0.020 . 1 . . . . A 58 ASP HA . 30195 1 463 . 1 1 58 58 ASP HB2 H 1 2.652 0.020 . 1 . . . . A 58 ASP HB2 . 30195 1 464 . 1 1 58 58 ASP HB3 H 1 2.652 0.020 . 1 . . . . A 58 ASP HB3 . 30195 1 465 . 1 1 58 58 ASP CA C 13 51.258 0.3 . 1 . . . . A 58 ASP CA . 30195 1 466 . 1 1 58 58 ASP CB C 13 38.097 0.3 . 1 . . . . A 58 ASP CB . 30195 1 467 . 1 1 58 58 ASP N N 15 116.241 0.3 . 1 . . . . A 58 ASP N . 30195 1 468 . 1 1 59 59 GLY H H 1 7.986 0.020 . 1 . . . . A 59 GLY H . 30195 1 469 . 1 1 59 59 GLY HA2 H 1 3.901 0.020 . 1 . . . . A 59 GLY HA2 . 30195 1 470 . 1 1 59 59 GLY HA3 H 1 3.901 0.020 . 1 . . . . A 59 GLY HA3 . 30195 1 471 . 1 1 59 59 GLY CA C 13 43.151 0.3 . 1 . . . . A 59 GLY CA . 30195 1 472 . 1 1 59 59 GLY N N 15 107.441 0.3 . 1 . . . . A 59 GLY N . 30195 1 473 . 1 1 60 60 ASN H H 1 8.341 0.020 . 1 . . . . A 60 ASN H . 30195 1 474 . 1 1 60 60 ASN HA H 1 4.677 0.020 . 1 . . . . A 60 ASN HA . 30195 1 475 . 1 1 60 60 ASN HB2 H 1 2.821 0.020 . 1 . . . . A 60 ASN HB2 . 30195 1 476 . 1 1 60 60 ASN HB3 H 1 2.821 0.020 . 1 . . . . A 60 ASN HB3 . 30195 1 477 . 1 1 60 60 ASN CA C 13 50.345 0.3 . 1 . . . . A 60 ASN CA . 30195 1 478 . 1 1 60 60 ASN CB C 13 35.974 0.3 . 1 . . . . A 60 ASN CB . 30195 1 479 . 1 1 60 60 ASN N N 15 118.036 0.3 . 1 . . . . A 60 ASN N . 30195 1 480 . 1 1 61 61 GLY H H 1 8.451 0.020 . 1 . . . . A 61 GLY H . 30195 1 481 . 1 1 61 61 GLY HA2 H 1 4.002 0.020 . 1 . . . . A 61 GLY HA2 . 30195 1 482 . 1 1 61 61 GLY HA3 H 1 4.002 0.020 . 1 . . . . A 61 GLY HA3 . 30195 1 483 . 1 1 61 61 GLY CA C 13 43.099 0.3 . 1 . . . . A 61 GLY CA . 30195 1 484 . 1 1 61 61 GLY N N 15 107.713 0.3 . 1 . . . . A 61 GLY N . 30195 1 485 . 1 1 62 62 THR H H 1 7.696 0.020 . 1 . . . . A 62 THR H . 30195 1 486 . 1 1 62 62 THR HA H 1 5.115 0.020 . 1 . . . . A 62 THR HA . 30195 1 487 . 1 1 62 62 THR HB H 1 4.069 0.020 . 1 . . . . A 62 THR HB . 30195 1 488 . 1 1 62 62 THR HG21 H 1 0.998 0.020 . 1 . . . . A 62 THR HG21 . 30195 1 489 . 1 1 62 62 THR HG22 H 1 0.998 0.020 . 1 . . . . A 62 THR HG22 . 30195 1 490 . 1 1 62 62 THR HG23 H 1 0.998 0.020 . 1 . . . . A 62 THR HG23 . 30195 1 491 . 1 1 62 62 THR CA C 13 57.414 0.3 . 1 . . . . A 62 THR CA . 30195 1 492 . 1 1 62 62 THR CB C 13 69.599 0.3 . 1 . . . . A 62 THR CB . 30195 1 493 . 1 1 62 62 THR N N 15 111.076 0.3 . 1 . . . . A 62 THR N . 30195 1 494 . 1 1 63 63 ILE H H 1 8.978 0.020 . 1 . . . . A 63 ILE H . 30195 1 495 . 1 1 63 63 ILE HA H 1 4.575 0.020 . 1 . . . . A 63 ILE HA . 30195 1 496 . 1 1 63 63 ILE HB H 1 1.791 0.020 . 1 . . . . A 63 ILE HB . 30195 1 497 . 1 1 63 63 ILE HG21 H 1 1.100 0.020 . 1 . . . . A 63 ILE HG21 . 30195 1 498 . 1 1 63 63 ILE HG22 H 1 1.100 0.020 . 1 . . . . A 63 ILE HG22 . 30195 1 499 . 1 1 63 63 ILE HG23 H 1 1.100 0.020 . 1 . . . . A 63 ILE HG23 . 30195 1 500 . 1 1 63 63 ILE HD11 H 1 0.897 0.020 . 1 . . . . A 63 ILE HD11 . 30195 1 501 . 1 1 63 63 ILE HD12 H 1 0.897 0.020 . 1 . . . . A 63 ILE HD12 . 30195 1 502 . 1 1 63 63 ILE HD13 H 1 0.897 0.020 . 1 . . . . A 63 ILE HD13 . 30195 1 503 . 1 1 63 63 ILE CA C 13 57.515 0.3 . 1 . . . . A 63 ILE CA . 30195 1 504 . 1 1 63 63 ILE CB C 13 38.722 0.3 . 1 . . . . A 63 ILE CB . 30195 1 505 . 1 1 63 63 ILE N N 15 120.045 0.3 . 1 . . . . A 63 ILE N . 30195 1 506 . 1 1 64 64 ASP H H 1 8.420 0.020 . 1 . . . . A 64 ASP H . 30195 1 507 . 1 1 64 64 ASP HA H 1 5.183 0.020 . 1 . . . . A 64 ASP HA . 30195 1 508 . 1 1 64 64 ASP HB2 H 1 2.551 0.020 . 1 . . . . A 64 ASP HB2 . 30195 1 509 . 1 1 64 64 ASP HB3 H 1 2.551 0.020 . 1 . . . . A 64 ASP HB3 . 30195 1 510 . 1 1 64 64 ASP CA C 13 48.998 0.3 . 1 . . . . A 64 ASP CA . 30195 1 511 . 1 1 64 64 ASP CB C 13 39.102 0.3 . 1 . . . . A 64 ASP CB . 30195 1 512 . 1 1 64 64 ASP N N 15 124.941 0.3 . 1 . . . . A 64 ASP N . 30195 1 513 . 1 1 65 65 PHE H H 1 8.920 0.020 . 1 . . . . A 65 PHE H . 30195 1 514 . 1 1 65 65 PHE HA H 1 3.715 0.020 . 1 . . . . A 65 PHE HA . 30195 1 515 . 1 1 65 65 PHE HB2 H 1 1.876 0.020 . 1 . . . . A 65 PHE HB2 . 30195 1 516 . 1 1 65 65 PHE HB3 H 1 1.876 0.020 . 1 . . . . A 65 PHE HB3 . 30195 1 517 . 1 1 65 65 PHE CA C 13 60.107 0.3 . 1 . . . . A 65 PHE CA . 30195 1 518 . 1 1 65 65 PHE N N 15 118.092 0.3 . 1 . . . . A 65 PHE N . 30195 1 519 . 1 1 67 67 GLU H H 1 8.027 0.020 . 1 . . . . A 67 GLU H . 30195 1 520 . 1 1 67 67 GLU HA H 1 3.868 0.020 . 1 . . . . A 67 GLU HA . 30195 1 521 . 1 1 67 67 GLU HB2 H 1 1.859 0.020 . 1 . . . . A 67 GLU HB2 . 30195 1 522 . 1 1 67 67 GLU HB3 H 1 1.859 0.020 . 1 . . . . A 67 GLU HB3 . 30195 1 523 . 1 1 67 67 GLU HG2 H 1 2.276 0.020 . 1 . . . . A 67 GLU HG2 . 30195 1 524 . 1 1 67 67 GLU HG3 H 1 2.276 0.020 . 1 . . . . A 67 GLU HG3 . 30195 1 525 . 1 1 67 67 GLU CA C 13 56.438 0.3 . 1 . . . . A 67 GLU CA . 30195 1 526 . 1 1 67 67 GLU CB C 13 26.527 0.3 . 1 . . . . A 67 GLU CB . 30195 1 527 . 1 1 67 67 GLU N N 15 117.856 0.3 . 1 . . . . A 67 GLU N . 30195 1 528 . 1 1 68 68 PHE H H 1 8.464 0.020 . 1 . . . . A 68 PHE H . 30195 1 529 . 1 1 68 68 PHE HA H 1 3.976 0.020 . 1 . . . . A 68 PHE HA . 30195 1 530 . 1 1 68 68 PHE HB2 H 1 2.999 0.020 . 1 . . . . A 68 PHE HB2 . 30195 1 531 . 1 1 68 68 PHE HB3 H 1 2.999 0.020 . 1 . . . . A 68 PHE HB3 . 30195 1 532 . 1 1 68 68 PHE CA C 13 58.525 0.3 . 1 . . . . A 68 PHE CA . 30195 1 533 . 1 1 68 68 PHE CB C 13 36.676 0.3 . 1 . . . . A 68 PHE CB . 30195 1 534 . 1 1 68 68 PHE N N 15 122.207 0.3 . 1 . . . . A 68 PHE N . 30195 1 535 . 1 1 69 69 LEU H H 1 8.404 0.020 . 1 . . . . A 69 LEU H . 30195 1 536 . 1 1 69 69 LEU HA H 1 3.154 0.020 . 1 . . . . A 69 LEU HA . 30195 1 537 . 1 1 69 69 LEU HB2 H 1 1.299 0.020 . 1 . . . . A 69 LEU HB2 . 30195 1 538 . 1 1 69 69 LEU HB3 H 1 1.299 0.020 . 1 . . . . A 69 LEU HB3 . 30195 1 539 . 1 1 69 69 LEU HD11 H 1 0.647 0.020 . 2 . . . . A 69 LEU HD11 . 30195 1 540 . 1 1 69 69 LEU HD12 H 1 0.647 0.020 . 2 . . . . A 69 LEU HD12 . 30195 1 541 . 1 1 69 69 LEU HD13 H 1 0.647 0.020 . 2 . . . . A 69 LEU HD13 . 30195 1 542 . 1 1 69 69 LEU HD21 H 1 0.828 0.020 . 2 . . . . A 69 LEU HD21 . 30195 1 543 . 1 1 69 69 LEU HD22 H 1 0.828 0.020 . 2 . . . . A 69 LEU HD22 . 30195 1 544 . 1 1 69 69 LEU HD23 H 1 0.828 0.020 . 2 . . . . A 69 LEU HD23 . 30195 1 545 . 1 1 69 69 LEU CA C 13 54.990 0.3 . 1 . . . . A 69 LEU CA . 30195 1 546 . 1 1 69 69 LEU CB C 13 38.171 0.3 . 1 . . . . A 69 LEU CB . 30195 1 547 . 1 1 69 69 LEU N N 15 118.368 0.3 . 1 . . . . A 69 LEU N . 30195 1 548 . 1 1 70 70 THR H H 1 7.646 0.020 . 1 . . . . A 70 THR H . 30195 1 549 . 1 1 70 70 THR HA H 1 3.741 0.020 . 1 . . . . A 70 THR HA . 30195 1 550 . 1 1 70 70 THR HB H 1 3.994 0.020 . 1 . . . . A 70 THR HB . 30195 1 551 . 1 1 70 70 THR HG21 H 1 1.063 0.020 . 1 . . . . A 70 THR HG21 . 30195 1 552 . 1 1 70 70 THR HG22 H 1 1.063 0.020 . 1 . . . . A 70 THR HG22 . 30195 1 553 . 1 1 70 70 THR HG23 H 1 1.063 0.020 . 1 . . . . A 70 THR HG23 . 30195 1 554 . 1 1 70 70 THR CA C 13 63.911 0.3 . 1 . . . . A 70 THR CA . 30195 1 555 . 1 1 70 70 THR CB C 13 65.526 0.3 . 1 . . . . A 70 THR CB . 30195 1 556 . 1 1 70 70 THR N N 15 115.827 0.3 . 1 . . . . A 70 THR N . 30195 1 557 . 1 1 71 71 MET H H 1 7.795 0.020 . 1 . . . . A 71 MET H . 30195 1 558 . 1 1 71 71 MET HA H 1 3.994 0.020 . 1 . . . . A 71 MET HA . 30195 1 559 . 1 1 71 71 MET HB2 H 1 1.787 0.020 . 1 . . . . A 71 MET HB2 . 30195 1 560 . 1 1 71 71 MET HB3 H 1 1.787 0.020 . 1 . . . . A 71 MET HB3 . 30195 1 561 . 1 1 71 71 MET HG2 H 1 2.058 0.020 . 1 . . . . A 71 MET HG2 . 30195 1 562 . 1 1 71 71 MET HG3 H 1 2.058 0.020 . 1 . . . . A 71 MET HG3 . 30195 1 563 . 1 1 71 71 MET CA C 13 56.741 0.3 . 1 . . . . A 71 MET CA . 30195 1 564 . 1 1 71 71 MET CB C 13 29.596 0.3 . 1 . . . . A 71 MET CB . 30195 1 565 . 1 1 71 71 MET N N 15 120.865 0.3 . 1 . . . . A 71 MET N . 30195 1 566 . 1 1 72 72 MET H H 1 7.968 0.020 . 1 . . . . A 72 MET H . 30195 1 567 . 1 1 72 72 MET HA H 1 4.049 0.020 . 1 . . . . A 72 MET HA . 30195 1 568 . 1 1 72 72 MET HB2 H 1 1.787 0.020 . 1 . . . . A 72 MET HB2 . 30195 1 569 . 1 1 72 72 MET HB3 H 1 1.787 0.020 . 1 . . . . A 72 MET HB3 . 30195 1 570 . 1 1 72 72 MET HG2 H 1 2.312 0.020 . 1 . . . . A 72 MET HG2 . 30195 1 571 . 1 1 72 72 MET HG3 H 1 2.312 0.020 . 1 . . . . A 72 MET HG3 . 30195 1 572 . 1 1 72 72 MET CA C 13 53.172 0.3 . 1 . . . . A 72 MET CA . 30195 1 573 . 1 1 72 72 MET CB C 13 28.551 0.3 . 1 . . . . A 72 MET CB . 30195 1 574 . 1 1 72 72 MET N N 15 117.111 0.3 . 1 . . . . A 72 MET N . 30195 1 575 . 1 1 73 73 ALA H H 1 8.240 0.020 . 1 . . . . A 73 ALA H . 30195 1 576 . 1 1 73 73 ALA HA H 1 4.049 0.020 . 1 . . . . A 73 ALA HA . 30195 1 577 . 1 1 73 73 ALA HB1 H 1 1.281 0.020 . 1 . . . . A 73 ALA HB1 . 30195 1 578 . 1 1 73 73 ALA HB2 H 1 1.281 0.020 . 1 . . . . A 73 ALA HB2 . 30195 1 579 . 1 1 73 73 ALA HB3 H 1 1.281 0.020 . 1 . . . . A 73 ALA HB3 . 30195 1 580 . 1 1 73 73 ALA CA C 13 52.061 0.3 . 1 . . . . A 73 ALA CA . 30195 1 581 . 1 1 73 73 ALA CB C 13 15.120 0.3 . 1 . . . . A 73 ALA CB . 30195 1 582 . 1 1 73 73 ALA N N 15 121.186 0.3 . 1 . . . . A 73 ALA N . 30195 1 583 . 1 1 74 74 ARG H H 1 7.408 0.020 . 1 . . . . A 74 ARG H . 30195 1 584 . 1 1 74 74 ARG HA H 1 3.886 0.020 . 1 . . . . A 74 ARG HA . 30195 1 585 . 1 1 74 74 ARG HB2 H 1 1.751 0.020 . 1 . . . . A 74 ARG HB2 . 30195 1 586 . 1 1 74 74 ARG HB3 H 1 1.751 0.020 . 1 . . . . A 74 ARG HB3 . 30195 1 587 . 1 1 74 74 ARG HG2 H 1 1.896 0.020 . 1 . . . . A 74 ARG HG2 . 30195 1 588 . 1 1 74 74 ARG HG3 H 1 1.896 0.020 . 1 . . . . A 74 ARG HG3 . 30195 1 589 . 1 1 74 74 ARG CA C 13 55.798 0.3 . 1 . . . . A 74 ARG CA . 30195 1 590 . 1 1 74 74 ARG CB C 13 27.235 0.3 . 1 . . . . A 74 ARG CB . 30195 1 591 . 1 1 74 74 ARG N N 15 116.472 0.3 . 1 . . . . A 74 ARG N . 30195 1 592 . 1 1 75 75 LYS H H 1 7.617 0.020 . 1 . . . . A 75 LYS H . 30195 1 593 . 1 1 75 75 LYS HA H 1 4.139 0.020 . 1 . . . . A 75 LYS HA . 30195 1 594 . 1 1 75 75 LYS HB2 H 1 1.715 0.020 . 1 . . . . A 75 LYS HB2 . 30195 1 595 . 1 1 75 75 LYS HB3 H 1 1.715 0.020 . 1 . . . . A 75 LYS HB3 . 30195 1 596 . 1 1 75 75 LYS CA C 13 53.947 0.3 . 1 . . . . A 75 LYS CA . 30195 1 597 . 1 1 75 75 LYS CB C 13 28.966 0.3 . 1 . . . . A 75 LYS CB . 30195 1 598 . 1 1 75 75 LYS N N 15 118.285 0.3 . 1 . . . . A 75 LYS N . 30195 1 599 . 1 1 76 76 MET H H 1 7.878 0.020 . 1 . . . . A 76 MET H . 30195 1 600 . 1 1 76 76 MET HA H 1 4.157 0.020 . 1 . . . . A 76 MET HA . 30195 1 601 . 1 1 76 76 MET HB2 H 1 1.950 0.020 . 1 . . . . A 76 MET HB2 . 30195 1 602 . 1 1 76 76 MET HB3 H 1 1.950 0.020 . 1 . . . . A 76 MET HB3 . 30195 1 603 . 1 1 76 76 MET CA C 13 53.677 0.3 . 1 . . . . A 76 MET CA . 30195 1 604 . 1 1 76 76 MET CB C 13 29.910 0.3 . 1 . . . . A 76 MET CB . 30195 1 605 . 1 1 76 76 MET N N 15 117.498 0.3 . 1 . . . . A 76 MET N . 30195 1 606 . 1 1 77 77 LYS H H 1 7.642 0.020 . 1 . . . . A 77 LYS H . 30195 1 607 . 1 1 77 77 LYS HA H 1 4.248 0.020 . 1 . . . . A 77 LYS HA . 30195 1 608 . 1 1 77 77 LYS HB2 H 1 1.896 0.020 . 1 . . . . A 77 LYS HB2 . 30195 1 609 . 1 1 77 77 LYS HB3 H 1 1.896 0.020 . 1 . . . . A 77 LYS HB3 . 30195 1 610 . 1 1 77 77 LYS CA C 13 54.216 0.3 . 1 . . . . A 77 LYS CA . 30195 1 611 . 1 1 77 77 LYS CB C 13 29.989 0.3 . 1 . . . . A 77 LYS CB . 30195 1 612 . 1 1 77 77 LYS N N 15 120.321 0.3 . 1 . . . . A 77 LYS N . 30195 1 613 . 1 1 78 78 ASP H H 1 8.219 0.020 . 1 . . . . A 78 ASP H . 30195 1 614 . 1 1 78 78 ASP HA H 1 4.646 0.020 . 1 . . . . A 78 ASP HA . 30195 1 615 . 1 1 78 78 ASP HB2 H 1 2.692 0.020 . 1 . . . . A 78 ASP HB2 . 30195 1 616 . 1 1 78 78 ASP HB3 H 1 2.692 0.020 . 1 . . . . A 78 ASP HB3 . 30195 1 617 . 1 1 78 78 ASP CA C 13 52.061 0.3 . 1 . . . . A 78 ASP CA . 30195 1 618 . 1 1 78 78 ASP CB C 13 38.171 0.3 . 1 . . . . A 78 ASP CB . 30195 1 619 . 1 1 78 78 ASP N N 15 121.295 0.3 . 1 . . . . A 78 ASP N . 30195 1 620 . 1 1 79 79 THR H H 1 8.039 0.020 . 1 . . . . A 79 THR H . 30195 1 621 . 1 1 79 79 THR HA H 1 4.193 0.020 . 1 . . . . A 79 THR HA . 30195 1 622 . 1 1 79 79 THR HB H 1 4.338 0.020 . 1 . . . . A 79 THR HB . 30195 1 623 . 1 1 79 79 THR HG21 H 1 1.154 0.020 . 1 . . . . A 79 THR HG21 . 30195 1 624 . 1 1 79 79 THR HG22 H 1 1.154 0.020 . 1 . . . . A 79 THR HG22 . 30195 1 625 . 1 1 79 79 THR HG23 H 1 1.154 0.020 . 1 . . . . A 79 THR HG23 . 30195 1 626 . 1 1 79 79 THR CA C 13 59.770 0.3 . 1 . . . . A 79 THR CA . 30195 1 627 . 1 1 79 79 THR CB C 13 66.965 0.3 . 1 . . . . A 79 THR CB . 30195 1 628 . 1 1 79 79 THR N N 15 114.252 0.3 . 1 . . . . A 79 THR N . 30195 1 629 . 1 1 80 80 ASP H H 1 8.359 0.020 . 1 . . . . A 80 ASP H . 30195 1 630 . 1 1 80 80 ASP HA H 1 4.664 0.020 . 1 . . . . A 80 ASP HA . 30195 1 631 . 1 1 80 80 ASP HB2 H 1 2.619 0.020 . 1 . . . . A 80 ASP HB2 . 30195 1 632 . 1 1 80 80 ASP HB3 H 1 2.619 0.020 . 1 . . . . A 80 ASP HB3 . 30195 1 633 . 1 1 80 80 ASP CA C 13 52.061 0.3 . 1 . . . . A 80 ASP CA . 30195 1 634 . 1 1 80 80 ASP CB C 13 38.327 0.3 . 1 . . . . A 80 ASP CB . 30195 1 635 . 1 1 80 80 ASP N N 15 122.925 0.3 . 1 . . . . A 80 ASP N . 30195 1 636 . 1 1 81 81 SER H H 1 8.329 0.020 . 1 . . . . A 81 SER H . 30195 1 637 . 1 1 81 81 SER HA H 1 4.302 0.020 . 1 . . . . A 81 SER HA . 30195 1 638 . 1 1 81 81 SER HB2 H 1 3.741 0.020 . 1 . . . . A 81 SER HB2 . 30195 1 639 . 1 1 81 81 SER HB3 H 1 3.741 0.020 . 1 . . . . A 81 SER HB3 . 30195 1 640 . 1 1 81 81 SER CA C 13 56.842 0.3 . 1 . . . . A 81 SER CA . 30195 1 641 . 1 1 81 81 SER CB C 13 60.907 0.3 . 1 . . . . A 81 SER CB . 30195 1 642 . 1 1 81 81 SER N N 15 116.628 0.3 . 1 . . . . A 81 SER N . 30195 1 643 . 1 1 82 82 GLU H H 1 8.353 0.020 . 1 . . . . A 82 GLU H . 30195 1 644 . 1 1 82 82 GLU HA H 1 4.049 0.020 . 1 . . . . A 82 GLU HA . 30195 1 645 . 1 1 82 82 GLU HB2 H 1 1.841 0.020 . 1 . . . . A 82 GLU HB2 . 30195 1 646 . 1 1 82 82 GLU HB3 H 1 1.841 0.020 . 1 . . . . A 82 GLU HB3 . 30195 1 647 . 1 1 82 82 GLU HG2 H 1 2.131 0.020 . 1 . . . . A 82 GLU HG2 . 30195 1 648 . 1 1 82 82 GLU HG3 H 1 2.131 0.020 . 1 . . . . A 82 GLU HG3 . 30195 1 649 . 1 1 82 82 GLU CA C 13 55.529 0.3 . 1 . . . . A 82 GLU CA . 30195 1 650 . 1 1 82 82 GLU CB C 13 26.921 0.3 . 1 . . . . A 82 GLU CB . 30195 1 651 . 1 1 82 82 GLU N N 15 121.876 0.3 . 1 . . . . A 82 GLU N . 30195 1 652 . 1 1 83 83 GLU H H 1 8.129 0.020 . 1 . . . . A 83 GLU H . 30195 1 653 . 1 1 83 83 GLU HA H 1 3.994 0.020 . 1 . . . . A 83 GLU HA . 30195 1 654 . 1 1 83 83 GLU HB2 H 1 1.805 0.020 . 1 . . . . A 83 GLU HB2 . 30195 1 655 . 1 1 83 83 GLU HB3 H 1 1.805 0.020 . 1 . . . . A 83 GLU HB3 . 30195 1 656 . 1 1 83 83 GLU HG2 H 1 2.058 0.020 . 1 . . . . A 83 GLU HG2 . 30195 1 657 . 1 1 83 83 GLU HG3 H 1 2.058 0.020 . 1 . . . . A 83 GLU HG3 . 30195 1 658 . 1 1 83 83 GLU CA C 13 55.773 0.3 . 1 . . . . A 83 GLU CA . 30195 1 659 . 1 1 83 83 GLU CB C 13 26.527 0.3 . 1 . . . . A 83 GLU CB . 30195 1 660 . 1 1 83 83 GLU N N 15 119.886 0.3 . 1 . . . . A 83 GLU N . 30195 1 661 . 1 1 84 84 GLU H H 1 7.900 0.020 . 1 . . . . A 84 GLU H . 30195 1 662 . 1 1 84 84 GLU HA H 1 3.976 0.020 . 1 . . . . A 84 GLU HA . 30195 1 663 . 1 1 84 84 GLU HB2 H 1 1.859 0.020 . 1 . . . . A 84 GLU HB2 . 30195 1 664 . 1 1 84 84 GLU HB3 H 1 1.859 0.020 . 1 . . . . A 84 GLU HB3 . 30195 1 665 . 1 1 84 84 GLU CA C 13 55.865 0.3 . 1 . . . . A 84 GLU CA . 30195 1 666 . 1 1 84 84 GLU CB C 13 26.921 0.3 . 1 . . . . A 84 GLU CB . 30195 1 667 . 1 1 84 84 GLU N N 15 118.973 0.3 . 1 . . . . A 84 GLU N . 30195 1 668 . 1 1 85 85 ILE H H 1 7.970 0.020 . 1 . . . . A 85 ILE H . 30195 1 669 . 1 1 85 85 ILE HA H 1 3.759 0.020 . 1 . . . . A 85 ILE HA . 30195 1 670 . 1 1 85 85 ILE HB H 1 1.914 0.020 . 1 . . . . A 85 ILE HB . 30195 1 671 . 1 1 85 85 ILE HG21 H 1 0.919 0.020 . 1 . . . . A 85 ILE HG21 . 30195 1 672 . 1 1 85 85 ILE HG22 H 1 0.919 0.020 . 1 . . . . A 85 ILE HG22 . 30195 1 673 . 1 1 85 85 ILE HG23 H 1 0.919 0.020 . 1 . . . . A 85 ILE HG23 . 30195 1 674 . 1 1 85 85 ILE HD11 H 1 0.702 0.020 . 1 . . . . A 85 ILE HD11 . 30195 1 675 . 1 1 85 85 ILE HD12 H 1 0.702 0.020 . 1 . . . . A 85 ILE HD12 . 30195 1 676 . 1 1 85 85 ILE HD13 H 1 0.702 0.020 . 1 . . . . A 85 ILE HD13 . 30195 1 677 . 1 1 85 85 ILE CA C 13 60.881 0.3 . 1 . . . . A 85 ILE CA . 30195 1 678 . 1 1 85 85 ILE CB C 13 36.125 0.3 . 1 . . . . A 85 ILE CB . 30195 1 679 . 1 1 85 85 ILE N N 15 120.870 0.3 . 1 . . . . A 85 ILE N . 30195 1 680 . 1 1 86 86 ARG H H 1 8.179 0.020 . 1 . . . . A 86 ARG H . 30195 1 681 . 1 1 86 86 ARG HA H 1 4.030 0.020 . 1 . . . . A 86 ARG HA . 30195 1 682 . 1 1 86 86 ARG CA C 13 56.370 0.3 . 1 . . . . A 86 ARG CA . 30195 1 683 . 1 1 86 86 ARG CB C 13 29.832 0.3 . 1 . . . . A 86 ARG CB . 30195 1 684 . 1 1 86 86 ARG N N 15 121.318 0.3 . 1 . . . . A 86 ARG N . 30195 1 685 . 1 1 87 87 GLU H H 1 8.265 0.020 . 1 . . . . A 87 GLU H . 30195 1 686 . 1 1 87 87 GLU HA H 1 3.940 0.020 . 1 . . . . A 87 GLU HA . 30195 1 687 . 1 1 87 87 GLU HB2 H 1 1.823 0.020 . 1 . . . . A 87 GLU HB2 . 30195 1 688 . 1 1 87 87 GLU HB3 H 1 1.823 0.020 . 1 . . . . A 87 GLU HB3 . 30195 1 689 . 1 1 87 87 GLU HG2 H 1 2.058 0.020 . 1 . . . . A 87 GLU HG2 . 30195 1 690 . 1 1 87 87 GLU HG3 H 1 2.058 0.020 . 1 . . . . A 87 GLU HG3 . 30195 1 691 . 1 1 87 87 GLU CA C 13 55.360 0.3 . 1 . . . . A 87 GLU CA . 30195 1 692 . 1 1 87 87 GLU CB C 13 26.685 0.3 . 1 . . . . A 87 GLU CB . 30195 1 693 . 1 1 87 87 GLU N N 15 119.274 0.3 . 1 . . . . A 87 GLU N . 30195 1 694 . 1 1 88 88 ALA H H 1 7.857 0.020 . 1 . . . . A 88 ALA H . 30195 1 695 . 1 1 88 88 ALA HA H 1 4.012 0.020 . 1 . . . . A 88 ALA HA . 30195 1 696 . 1 1 88 88 ALA HB1 H 1 1.552 0.020 . 1 . . . . A 88 ALA HB1 . 30195 1 697 . 1 1 88 88 ALA HB2 H 1 1.552 0.020 . 1 . . . . A 88 ALA HB2 . 30195 1 698 . 1 1 88 88 ALA HB3 H 1 1.552 0.020 . 1 . . . . A 88 ALA HB3 . 30195 1 699 . 1 1 88 88 ALA CA C 13 51.523 0.3 . 1 . . . . A 88 ALA CA . 30195 1 700 . 1 1 88 88 ALA CB C 13 15.592 0.3 . 1 . . . . A 88 ALA CB . 30195 1 701 . 1 1 88 88 ALA N N 15 122.158 0.3 . 1 . . . . A 88 ALA N . 30195 1 702 . 1 1 89 89 PHE H H 1 7.882 0.020 . 1 . . . . A 89 PHE H . 30195 1 703 . 1 1 89 89 PHE HA H 1 2.981 0.020 . 1 . . . . A 89 PHE HA . 30195 1 704 . 1 1 89 89 PHE HB2 H 1 2.782 0.020 . 1 . . . . A 89 PHE HB2 . 30195 1 705 . 1 1 89 89 PHE HB3 H 1 2.782 0.020 . 1 . . . . A 89 PHE HB3 . 30195 1 706 . 1 1 89 89 PHE CA C 13 57.097 0.3 . 1 . . . . A 89 PHE CA . 30195 1 707 . 1 1 89 89 PHE N N 15 115.965 0.3 . 1 . . . . A 89 PHE N . 30195 1 708 . 1 1 91 91 VAL H H 1 7.924 0.020 . 1 . . . . A 91 VAL H . 30195 1 709 . 1 1 91 91 VAL HA H 1 3.506 0.020 . 1 . . . . A 91 VAL HA . 30195 1 710 . 1 1 91 91 VAL HB H 1 1.841 0.020 . 1 . . . . A 91 VAL HB . 30195 1 711 . 1 1 91 91 VAL HG11 H 1 0.846 0.020 . 1 . . . . A 91 VAL HG11 . 30195 1 712 . 1 1 91 91 VAL HG12 H 1 0.846 0.020 . 1 . . . . A 91 VAL HG12 . 30195 1 713 . 1 1 91 91 VAL HG13 H 1 0.846 0.020 . 1 . . . . A 91 VAL HG13 . 30195 1 714 . 1 1 91 91 VAL HG21 H 1 0.846 0.020 . 1 . . . . A 91 VAL HG21 . 30195 1 715 . 1 1 91 91 VAL HG22 H 1 0.846 0.020 . 1 . . . . A 91 VAL HG22 . 30195 1 716 . 1 1 91 91 VAL HG23 H 1 0.846 0.020 . 1 . . . . A 91 VAL HG23 . 30195 1 717 . 1 1 91 91 VAL CA C 13 62.548 0.3 . 1 . . . . A 91 VAL CA . 30195 1 718 . 1 1 91 91 VAL N N 15 119.084 0.3 . 1 . . . . A 91 VAL N . 30195 1 719 . 1 1 92 92 PHE H H 1 6.854 0.020 . 1 . . . . A 92 PHE H . 30195 1 720 . 1 1 92 92 PHE HA H 1 4.266 0.020 . 1 . . . . A 92 PHE HA . 30195 1 721 . 1 1 92 92 PHE HB2 H 1 2.728 0.020 . 1 . . . . A 92 PHE HB2 . 30195 1 722 . 1 1 92 92 PHE HB3 H 1 2.728 0.020 . 1 . . . . A 92 PHE HB3 . 30195 1 723 . 1 1 92 92 PHE CA C 13 55.836 0.3 . 1 . . . . A 92 PHE CA . 30195 1 724 . 1 1 92 92 PHE CB C 13 36.833 0.3 . 1 . . . . A 92 PHE CB . 30195 1 725 . 1 1 92 92 PHE N N 15 112.485 0.3 . 1 . . . . A 92 PHE N . 30195 1 726 . 1 1 93 93 ALA H H 1 7.973 0.020 . 1 . . . . A 93 ALA H . 30195 1 727 . 1 1 93 93 ALA HA H 1 4.266 0.020 . 1 . . . . A 93 ALA HA . 30195 1 728 . 1 1 93 93 ALA HB1 H 1 1.299 0.020 . 1 . . . . A 93 ALA HB1 . 30195 1 729 . 1 1 93 93 ALA HB2 H 1 1.299 0.020 . 1 . . . . A 93 ALA HB2 . 30195 1 730 . 1 1 93 93 ALA HB3 H 1 1.299 0.020 . 1 . . . . A 93 ALA HB3 . 30195 1 731 . 1 1 93 93 ALA CA C 13 49.772 0.3 . 1 . . . . A 93 ALA CA . 30195 1 732 . 1 1 93 93 ALA CB C 13 16.483 0.3 . 1 . . . . A 93 ALA CB . 30195 1 733 . 1 1 93 93 ALA N N 15 122.815 0.3 . 1 . . . . A 93 ALA N . 30195 1 734 . 1 1 94 94 LYS H H 1 7.811 0.020 . 1 . . . . A 94 LYS H . 30195 1 735 . 1 1 94 94 LYS CA C 13 54.855 0.3 . 1 . . . . A 94 LYS CA . 30195 1 736 . 1 1 94 94 LYS CB C 13 29.832 0.3 . 1 . . . . A 94 LYS CB . 30195 1 737 . 1 1 94 94 LYS N N 15 125.896 0.3 . 1 . . . . A 94 LYS N . 30195 1 738 . 1 1 95 95 ASP H H 1 8.266 0.020 . 1 . . . . A 95 ASP H . 30195 1 739 . 1 1 95 95 ASP HA H 1 4.664 0.020 . 1 . . . . A 95 ASP HA . 30195 1 740 . 1 1 95 95 ASP HB2 H 1 2.710 0.020 . 1 . . . . A 95 ASP HB2 . 30195 1 741 . 1 1 95 95 ASP HB3 H 1 2.710 0.020 . 1 . . . . A 95 ASP HB3 . 30195 1 742 . 1 1 95 95 ASP CA C 13 51.826 0.3 . 1 . . . . A 95 ASP CA . 30195 1 743 . 1 1 95 95 ASP CB C 13 38.159 0.3 . 1 . . . . A 95 ASP CB . 30195 1 744 . 1 1 95 95 ASP N N 15 118.967 0.3 . 1 . . . . A 95 ASP N . 30195 1 745 . 1 1 96 96 GLY H H 1 8.113 0.020 . 1 . . . . A 96 GLY H . 30195 1 746 . 1 1 96 96 GLY HA2 H 1 3.868 0.020 . 1 . . . . A 96 GLY HA2 . 30195 1 747 . 1 1 96 96 GLY HA3 H 1 3.868 0.020 . 1 . . . . A 96 GLY HA3 . 30195 1 748 . 1 1 96 96 GLY CA C 13 43.047 0.3 . 1 . . . . A 96 GLY CA . 30195 1 749 . 1 1 96 96 GLY N N 15 107.633 0.3 . 1 . . . . A 96 GLY N . 30195 1 750 . 1 1 97 97 ASN H H 1 8.235 0.020 . 1 . . . . A 97 ASN H . 30195 1 751 . 1 1 97 97 ASN HA H 1 4.627 0.020 . 1 . . . . A 97 ASN HA . 30195 1 752 . 1 1 97 97 ASN HB2 H 1 2.782 0.020 . 1 . . . . A 97 ASN HB2 . 30195 1 753 . 1 1 97 97 ASN HB3 H 1 2.782 0.020 . 1 . . . . A 97 ASN HB3 . 30195 1 754 . 1 1 97 97 ASN CA C 13 50.547 0.3 . 1 . . . . A 97 ASN CA . 30195 1 755 . 1 1 97 97 ASN CB C 13 36.099 0.3 . 1 . . . . A 97 ASN CB . 30195 1 756 . 1 1 97 97 ASN N N 15 117.733 0.3 . 1 . . . . A 97 ASN N . 30195 1 757 . 1 1 98 98 GLY H H 1 8.312 0.020 . 1 . . . . A 98 GLY H . 30195 1 758 . 1 1 98 98 GLY HA2 H 1 3.886 0.020 . 1 . . . . A 98 GLY HA2 . 30195 1 759 . 1 1 98 98 GLY HA3 H 1 3.886 0.020 . 1 . . . . A 98 GLY HA3 . 30195 1 760 . 1 1 98 98 GLY CA C 13 42.681 0.3 . 1 . . . . A 98 GLY CA . 30195 1 761 . 1 1 98 98 GLY N N 15 107.446 0.3 . 1 . . . . A 98 GLY N . 30195 1 762 . 1 1 99 99 TYR H H 1 7.855 0.020 . 1 . . . . A 99 TYR H . 30195 1 763 . 1 1 99 99 TYR HA H 1 4.030 0.020 . 1 . . . . A 99 TYR HA . 30195 1 764 . 1 1 99 99 TYR HB2 H 1 2.646 0.020 . 1 . . . . A 99 TYR HB2 . 30195 1 765 . 1 1 99 99 TYR HB3 H 1 2.646 0.020 . 1 . . . . A 99 TYR HB3 . 30195 1 766 . 1 1 99 99 TYR CA C 13 56.909 0.3 . 1 . . . . A 99 TYR CA . 30195 1 767 . 1 1 99 99 TYR N N 15 118.748 0.3 . 1 . . . . A 99 TYR N . 30195 1 768 . 1 1 101 101 SER H H 1 8.529 0.020 . 1 . . . . A 101 SER H . 30195 1 769 . 1 1 101 101 SER HA H 1 3.976 0.020 . 1 . . . . A 101 SER HA . 30195 1 770 . 1 1 101 101 SER HB2 H 1 3.669 0.020 . 1 . . . . A 101 SER HB2 . 30195 1 771 . 1 1 101 101 SER HB3 H 1 3.669 0.020 . 1 . . . . A 101 SER HB3 . 30195 1 772 . 1 1 101 101 SER CA C 13 54.923 0.3 . 1 . . . . A 101 SER CA . 30195 1 773 . 1 1 101 101 SER CB C 13 62.166 0.3 . 1 . . . . A 101 SER CB . 30195 1 774 . 1 1 101 101 SER N N 15 119.086 0.3 . 1 . . . . A 101 SER N . 30195 1 775 . 1 1 102 102 ALA H H 1 8.680 0.020 . 1 . . . . A 102 ALA H . 30195 1 776 . 1 1 102 102 ALA HA H 1 3.940 0.020 . 1 . . . . A 102 ALA HA . 30195 1 777 . 1 1 102 102 ALA HB1 H 1 1.299 0.020 . 1 . . . . A 102 ALA HB1 . 30195 1 778 . 1 1 102 102 ALA HB2 H 1 1.299 0.020 . 1 . . . . A 102 ALA HB2 . 30195 1 779 . 1 1 102 102 ALA HB3 H 1 1.299 0.020 . 1 . . . . A 102 ALA HB3 . 30195 1 780 . 1 1 102 102 ALA CA C 13 52.465 0.3 . 1 . . . . A 102 ALA CA . 30195 1 781 . 1 1 102 102 ALA CB C 13 15.435 0.3 . 1 . . . . A 102 ALA CB . 30195 1 782 . 1 1 102 102 ALA N N 15 124.831 0.3 . 1 . . . . A 102 ALA N . 30195 1 783 . 1 1 103 103 ALA H H 1 8.222 0.020 . 1 . . . . A 103 ALA H . 30195 1 784 . 1 1 103 103 ALA HA H 1 3.994 0.020 . 1 . . . . A 103 ALA HA . 30195 1 785 . 1 1 103 103 ALA HB1 H 1 1.281 0.020 . 1 . . . . A 103 ALA HB1 . 30195 1 786 . 1 1 103 103 ALA HB2 H 1 1.281 0.020 . 1 . . . . A 103 ALA HB2 . 30195 1 787 . 1 1 103 103 ALA HB3 H 1 1.281 0.020 . 1 . . . . A 103 ALA HB3 . 30195 1 788 . 1 1 103 103 ALA CA C 13 51.927 0.3 . 1 . . . . A 103 ALA CA . 30195 1 789 . 1 1 103 103 ALA CB C 13 15.513 0.3 . 1 . . . . A 103 ALA CB . 30195 1 790 . 1 1 103 103 ALA N N 15 119.005 0.3 . 1 . . . . A 103 ALA N . 30195 1 791 . 1 1 104 104 GLU H H 1 7.735 0.020 . 1 . . . . A 104 GLU H . 30195 1 792 . 1 1 104 104 GLU HA H 1 4.012 0.020 . 1 . . . . A 104 GLU HA . 30195 1 793 . 1 1 104 104 GLU CA C 13 55.495 0.3 . 1 . . . . A 104 GLU CA . 30195 1 794 . 1 1 104 104 GLU CB C 13 26.763 0.3 . 1 . . . . A 104 GLU CB . 30195 1 795 . 1 1 104 104 GLU N N 15 118.601 0.3 . 1 . . . . A 104 GLU N . 30195 1 796 . 1 1 105 105 LEU H H 1 8.088 0.020 . 1 . . . . A 105 LEU H . 30195 1 797 . 1 1 105 105 LEU HA H 1 4.012 0.020 . 1 . . . . A 105 LEU HA . 30195 1 798 . 1 1 105 105 LEU HB2 H 1 1.769 0.020 . 1 . . . . A 105 LEU HB2 . 30195 1 799 . 1 1 105 105 LEU HB3 H 1 1.769 0.020 . 1 . . . . A 105 LEU HB3 . 30195 1 800 . 1 1 105 105 LEU HG H 1 1.299 0.020 . 1 . . . . A 105 LEU HG . 30195 1 801 . 1 1 105 105 LEU HD11 H 1 0.629 0.020 . 1 . . . . A 105 LEU HD11 . 30195 1 802 . 1 1 105 105 LEU HD12 H 1 0.629 0.020 . 1 . . . . A 105 LEU HD12 . 30195 1 803 . 1 1 105 105 LEU HD13 H 1 0.629 0.020 . 1 . . . . A 105 LEU HD13 . 30195 1 804 . 1 1 105 105 LEU HD21 H 1 0.629 0.020 . 1 . . . . A 105 LEU HD21 . 30195 1 805 . 1 1 105 105 LEU HD22 H 1 0.629 0.020 . 1 . . . . A 105 LEU HD22 . 30195 1 806 . 1 1 105 105 LEU HD23 H 1 0.629 0.020 . 1 . . . . A 105 LEU HD23 . 30195 1 807 . 1 1 105 105 LEU CA C 13 54.923 0.3 . 1 . . . . A 105 LEU CA . 30195 1 808 . 1 1 105 105 LEU CB C 13 38.879 0.3 . 1 . . . . A 105 LEU CB . 30195 1 809 . 1 1 105 105 LEU N N 15 120.659 0.3 . 1 . . . . A 105 LEU N . 30195 1 810 . 1 1 106 106 ARG H H 1 8.025 0.020 . 1 . . . . A 106 ARG H . 30195 1 811 . 1 1 106 106 ARG HA H 1 3.922 0.020 . 1 . . . . A 106 ARG HA . 30195 1 812 . 1 1 106 106 ARG HB2 H 1 1.751 0.020 . 1 . . . . A 106 ARG HB2 . 30195 1 813 . 1 1 106 106 ARG HB3 H 1 1.751 0.020 . 1 . . . . A 106 ARG HB3 . 30195 1 814 . 1 1 106 106 ARG CA C 13 56.539 0.3 . 1 . . . . A 106 ARG CA . 30195 1 815 . 1 1 106 106 ARG CB C 13 27.157 0.3 . 1 . . . . A 106 ARG CB . 30195 1 816 . 1 1 106 106 ARG N N 15 117.594 0.3 . 1 . . . . A 106 ARG N . 30195 1 817 . 1 1 107 107 HIS H H 1 7.680 0.020 . 1 . . . . A 107 HIS H . 30195 1 818 . 1 1 107 107 HIS HA H 1 4.229 0.020 . 1 . . . . A 107 HIS HA . 30195 1 819 . 1 1 107 107 HIS HB2 H 1 1.950 0.020 . 1 . . . . A 107 HIS HB2 . 30195 1 820 . 1 1 107 107 HIS HB3 H 1 1.950 0.020 . 1 . . . . A 107 HIS HB3 . 30195 1 821 . 1 1 107 107 HIS CA C 13 55.596 0.3 . 1 . . . . A 107 HIS CA . 30195 1 822 . 1 1 107 107 HIS CB C 13 26.527 0.3 . 1 . . . . A 107 HIS CB . 30195 1 823 . 1 1 107 107 HIS N N 15 117.689 0.3 . 1 . . . . A 107 HIS N . 30195 1 824 . 1 1 108 108 VAL H H 1 7.929 0.020 . 1 . . . . A 108 VAL H . 30195 1 825 . 1 1 108 108 VAL HA H 1 3.994 0.020 . 1 . . . . A 108 VAL HA . 30195 1 826 . 1 1 108 108 VAL HB H 1 2.058 0.020 . 1 . . . . A 108 VAL HB . 30195 1 827 . 1 1 108 108 VAL HG11 H 1 0.792 0.020 . 1 . . . . A 108 VAL HG11 . 30195 1 828 . 1 1 108 108 VAL HG12 H 1 0.792 0.020 . 1 . . . . A 108 VAL HG12 . 30195 1 829 . 1 1 108 108 VAL HG13 H 1 0.792 0.020 . 1 . . . . A 108 VAL HG13 . 30195 1 830 . 1 1 108 108 VAL CA C 13 62.497 0.3 . 1 . . . . A 108 VAL CA . 30195 1 831 . 1 1 108 108 VAL CB C 13 29.202 0.3 . 1 . . . . A 108 VAL CB . 30195 1 832 . 1 1 108 108 VAL N N 15 118.922 0.3 . 1 . . . . A 108 VAL N . 30195 1 833 . 1 1 109 109 MET H H 1 8.142 0.020 . 1 . . . . A 109 MET H . 30195 1 834 . 1 1 109 109 MET HA H 1 4.664 0.020 . 1 . . . . A 109 MET HA . 30195 1 835 . 1 1 109 109 MET HB2 H 1 1.751 0.020 . 1 . . . . A 109 MET HB2 . 30195 1 836 . 1 1 109 109 MET HB3 H 1 1.751 0.020 . 1 . . . . A 109 MET HB3 . 30195 1 837 . 1 1 109 109 MET HG2 H 1 2.131 0.020 . 1 . . . . A 109 MET HG2 . 30195 1 838 . 1 1 109 109 MET HG3 H 1 2.131 0.020 . 1 . . . . A 109 MET HG3 . 30195 1 839 . 1 1 109 109 MET CA C 13 54.485 0.3 . 1 . . . . A 109 MET CA . 30195 1 840 . 1 1 109 109 MET CB C 13 29.674 0.3 . 1 . . . . A 109 MET CB . 30195 1 841 . 1 1 109 109 MET N N 15 117.291 0.3 . 1 . . . . A 109 MET N . 30195 1 842 . 1 1 110 110 THR H H 1 7.914 0.020 . 1 . . . . A 110 THR H . 30195 1 843 . 1 1 110 110 THR HA H 1 4.103 0.020 . 1 . . . . A 110 THR HA . 30195 1 844 . 1 1 110 110 THR HB H 1 4.229 0.020 . 1 . . . . A 110 THR HB . 30195 1 845 . 1 1 110 110 THR CA C 13 61.521 0.3 . 1 . . . . A 110 THR CA . 30195 1 846 . 1 1 110 110 THR CB C 13 66.503 0.3 . 1 . . . . A 110 THR CB . 30195 1 847 . 1 1 110 110 THR N N 15 112.374 0.3 . 1 . . . . A 110 THR N . 30195 1 848 . 1 1 111 111 ASN H H 1 7.906 0.020 . 1 . . . . A 111 ASN H . 30195 1 849 . 1 1 111 111 ASN HA H 1 4.682 0.020 . 1 . . . . A 111 ASN HA . 30195 1 850 . 1 1 111 111 ASN HB2 H 1 2.746 0.020 . 1 . . . . A 111 ASN HB2 . 30195 1 851 . 1 1 111 111 ASN HB3 H 1 2.746 0.020 . 1 . . . . A 111 ASN HB3 . 30195 1 852 . 1 1 111 111 ASN CA C 13 51.691 0.3 . 1 . . . . A 111 ASN CA . 30195 1 853 . 1 1 111 111 ASN CB C 13 36.047 0.3 . 1 . . . . A 111 ASN CB . 30195 1 854 . 1 1 111 111 ASN N N 15 119.669 0.3 . 1 . . . . A 111 ASN N . 30195 1 855 . 1 1 112 112 LEU H H 1 7.764 0.020 . 1 . . . . A 112 LEU H . 30195 1 856 . 1 1 112 112 LEU HA H 1 4.139 0.020 . 1 . . . . A 112 LEU HA . 30195 1 857 . 1 1 112 112 LEU HB2 H 1 1.660 0.020 . 1 . . . . A 112 LEU HB2 . 30195 1 858 . 1 1 112 112 LEU HB3 H 1 1.660 0.020 . 1 . . . . A 112 LEU HB3 . 30195 1 859 . 1 1 112 112 LEU HD11 H 1 0.683 0.020 . 1 . . . . A 112 LEU HD11 . 30195 1 860 . 1 1 112 112 LEU HD12 H 1 0.683 0.020 . 1 . . . . A 112 LEU HD12 . 30195 1 861 . 1 1 112 112 LEU HD13 H 1 0.683 0.020 . 1 . . . . A 112 LEU HD13 . 30195 1 862 . 1 1 112 112 LEU CA C 13 52.768 0.3 . 1 . . . . A 112 LEU CA . 30195 1 863 . 1 1 112 112 LEU CB C 13 39.720 0.3 . 1 . . . . A 112 LEU CB . 30195 1 864 . 1 1 112 112 LEU N N 15 119.868 0.3 . 1 . . . . A 112 LEU N . 30195 1 865 . 1 1 113 113 GLY H H 1 8.168 0.020 . 1 . . . . A 113 GLY H . 30195 1 866 . 1 1 113 113 GLY HA2 H 1 3.849 0.020 . 1 . . . . A 113 GLY HA2 . 30195 1 867 . 1 1 113 113 GLY HA3 H 1 3.849 0.020 . 1 . . . . A 113 GLY HA3 . 30195 1 868 . 1 1 113 113 GLY CA C 13 43.204 0.3 . 1 . . . . A 113 GLY CA . 30195 1 869 . 1 1 113 113 GLY N N 15 107.803 0.3 . 1 . . . . A 113 GLY N . 30195 1 870 . 1 1 114 114 GLU H H 1 8.018 0.020 . 1 . . . . A 114 GLU H . 30195 1 871 . 1 1 114 114 GLU HA H 1 4.175 0.020 . 1 . . . . A 114 GLU HA . 30195 1 872 . 1 1 114 114 GLU HB2 H 1 1.751 0.020 . 1 . . . . A 114 GLU HB2 . 30195 1 873 . 1 1 114 114 GLU HB3 H 1 1.751 0.020 . 1 . . . . A 114 GLU HB3 . 30195 1 874 . 1 1 114 114 GLU HG2 H 1 1.968 0.020 . 1 . . . . A 114 GLU HG2 . 30195 1 875 . 1 1 114 114 GLU HG3 H 1 1.968 0.020 . 1 . . . . A 114 GLU HG3 . 30195 1 876 . 1 1 114 114 GLU CA C 13 53.711 0.3 . 1 . . . . A 114 GLU CA . 30195 1 877 . 1 1 114 114 GLU CB C 13 27.157 0.3 . 1 . . . . A 114 GLU CB . 30195 1 878 . 1 1 114 114 GLU N N 15 119.894 0.3 . 1 . . . . A 114 GLU N . 30195 1 879 . 1 1 115 115 LYS H H 1 8.238 0.020 . 1 . . . . A 115 LYS H . 30195 1 880 . 1 1 115 115 LYS HA H 1 4.193 0.020 . 1 . . . . A 115 LYS HA . 30195 1 881 . 1 1 115 115 LYS HB2 H 1 1.805 0.020 . 1 . . . . A 115 LYS HB2 . 30195 1 882 . 1 1 115 115 LYS HB3 H 1 1.805 0.020 . 1 . . . . A 115 LYS HB3 . 30195 1 883 . 1 1 115 115 LYS CA C 13 53.812 0.3 . 1 . . . . A 115 LYS CA . 30195 1 884 . 1 1 115 115 LYS CB C 13 29.674 0.3 . 1 . . . . A 115 LYS CB . 30195 1 885 . 1 1 115 115 LYS N N 15 120.422 0.3 . 1 . . . . A 115 LYS N . 30195 1 886 . 1 1 116 116 LEU H H 1 7.843 0.020 . 1 . . . . A 116 LEU H . 30195 1 887 . 1 1 116 116 LEU HA H 1 4.627 0.020 . 1 . . . . A 116 LEU HA . 30195 1 888 . 1 1 116 116 LEU HB2 H 1 1.516 0.020 . 1 . . . . A 116 LEU HB2 . 30195 1 889 . 1 1 116 116 LEU HB3 H 1 1.516 0.020 . 1 . . . . A 116 LEU HB3 . 30195 1 890 . 1 1 116 116 LEU HD11 H 1 0.647 0.020 . 1 . . . . A 116 LEU HD11 . 30195 1 891 . 1 1 116 116 LEU HD12 H 1 0.647 0.020 . 1 . . . . A 116 LEU HD12 . 30195 1 892 . 1 1 116 116 LEU HD13 H 1 0.647 0.020 . 1 . . . . A 116 LEU HD13 . 30195 1 893 . 1 1 116 116 LEU HD21 H 1 0.647 0.020 . 1 . . . . A 116 LEU HD21 . 30195 1 894 . 1 1 116 116 LEU HD22 H 1 0.647 0.020 . 1 . . . . A 116 LEU HD22 . 30195 1 895 . 1 1 116 116 LEU HD23 H 1 0.647 0.020 . 1 . . . . A 116 LEU HD23 . 30195 1 896 . 1 1 116 116 LEU CA C 13 51.523 0.3 . 1 . . . . A 116 LEU CA . 30195 1 897 . 1 1 116 116 LEU CB C 13 41.318 0.3 . 1 . . . . A 116 LEU CB . 30195 1 898 . 1 1 116 116 LEU N N 15 122.019 0.3 . 1 . . . . A 116 LEU N . 30195 1 899 . 1 1 117 117 THR H H 1 8.805 0.020 . 1 . . . . A 117 THR H . 30195 1 900 . 1 1 117 117 THR HA H 1 4.447 0.020 . 1 . . . . A 117 THR HA . 30195 1 901 . 1 1 117 117 THR HB H 1 4.646 0.020 . 1 . . . . A 117 THR HB . 30195 1 902 . 1 1 117 117 THR HG21 H 1 1.190 0.020 . 1 . . . . A 117 THR HG21 . 30195 1 903 . 1 1 117 117 THR HG22 H 1 1.190 0.020 . 1 . . . . A 117 THR HG22 . 30195 1 904 . 1 1 117 117 THR HG23 H 1 1.190 0.020 . 1 . . . . A 117 THR HG23 . 30195 1 905 . 1 1 117 117 THR CA C 13 58.154 0.3 . 1 . . . . A 117 THR CA . 30195 1 906 . 1 1 117 117 THR CB C 13 68.224 0.3 . 1 . . . . A 117 THR CB . 30195 1 907 . 1 1 117 117 THR N N 15 113.495 0.3 . 1 . . . . A 117 THR N . 30195 1 908 . 1 1 118 118 ASP H H 1 8.706 0.020 . 1 . . . . A 118 ASP H . 30195 1 909 . 1 1 118 118 ASP HA H 1 4.193 0.020 . 1 . . . . A 118 ASP HA . 30195 1 910 . 1 1 118 118 ASP HB2 H 1 2.475 0.020 . 1 . . . . A 118 ASP HB2 . 30195 1 911 . 1 1 118 118 ASP HB3 H 1 2.475 0.020 . 1 . . . . A 118 ASP HB3 . 30195 1 912 . 1 1 118 118 ASP CA C 13 54.653 0.3 . 1 . . . . A 118 ASP CA . 30195 1 913 . 1 1 118 118 ASP CB C 13 37.305 0.3 . 1 . . . . A 118 ASP CB . 30195 1 914 . 1 1 118 118 ASP N N 15 120.936 0.3 . 1 . . . . A 118 ASP N . 30195 1 915 . 1 1 119 119 GLU H H 1 8.494 0.020 . 1 . . . . A 119 GLU H . 30195 1 916 . 1 1 119 119 GLU HA H 1 4.067 0.020 . 1 . . . . A 119 GLU HA . 30195 1 917 . 1 1 119 119 GLU HB2 H 1 1.805 0.020 . 1 . . . . A 119 GLU HB2 . 30195 1 918 . 1 1 119 119 GLU HB3 H 1 1.805 0.020 . 1 . . . . A 119 GLU HB3 . 30195 1 919 . 1 1 119 119 GLU CA C 13 56.741 0.3 . 1 . . . . A 119 GLU CA . 30195 1 920 . 1 1 119 119 GLU CB C 13 26.449 0.3 . 1 . . . . A 119 GLU CB . 30195 1 921 . 1 1 119 119 GLU N N 15 118.257 0.3 . 1 . . . . A 119 GLU N . 30195 1 922 . 1 1 120 120 GLU H H 1 7.781 0.020 . 1 . . . . A 120 GLU H . 30195 1 923 . 1 1 120 120 GLU HA H 1 4.121 0.020 . 1 . . . . A 120 GLU HA . 30195 1 924 . 1 1 120 120 GLU HB2 H 1 1.841 0.020 . 1 . . . . A 120 GLU HB2 . 30195 1 925 . 1 1 120 120 GLU HB3 H 1 1.841 0.020 . 1 . . . . A 120 GLU HB3 . 30195 1 926 . 1 1 120 120 GLU CA C 13 56.000 0.3 . 1 . . . . A 120 GLU CA . 30195 1 927 . 1 1 120 120 GLU CB C 13 27.471 0.3 . 1 . . . . A 120 GLU CB . 30195 1 928 . 1 1 120 120 GLU N N 15 120.294 0.3 . 1 . . . . A 120 GLU N . 30195 1 929 . 1 1 121 121 VAL H H 1 8.122 0.020 . 1 . . . . A 121 VAL H . 30195 1 930 . 1 1 121 121 VAL HA H 1 3.831 0.020 . 1 . . . . A 121 VAL HA . 30195 1 931 . 1 1 121 121 VAL HB H 1 2.040 0.020 . 1 . . . . A 121 VAL HB . 30195 1 932 . 1 1 121 121 VAL HG11 H 1 0.883 0.020 . 1 . . . . A 121 VAL HG11 . 30195 1 933 . 1 1 121 121 VAL HG12 H 1 0.883 0.020 . 1 . . . . A 121 VAL HG12 . 30195 1 934 . 1 1 121 121 VAL HG13 H 1 0.883 0.020 . 1 . . . . A 121 VAL HG13 . 30195 1 935 . 1 1 121 121 VAL CA C 13 63.675 0.3 . 1 . . . . A 121 VAL CA . 30195 1 936 . 1 1 121 121 VAL CB C 13 27.235 0.3 . 1 . . . . A 121 VAL CB . 30195 1 937 . 1 1 121 121 VAL N N 15 120.729 0.3 . 1 . . . . A 121 VAL N . 30195 1 938 . 1 1 122 122 ASP H H 1 8.248 0.020 . 1 . . . . A 122 ASP H . 30195 1 939 . 1 1 122 122 ASP HA H 1 4.211 0.020 . 1 . . . . A 122 ASP HA . 30195 1 940 . 1 1 122 122 ASP HB2 H 1 2.619 0.020 . 1 . . . . A 122 ASP HB2 . 30195 1 941 . 1 1 122 122 ASP HB3 H 1 2.619 0.020 . 1 . . . . A 122 ASP HB3 . 30195 1 942 . 1 1 122 122 ASP CA C 13 54.524 0.3 . 1 . . . . A 122 ASP CA . 30195 1 943 . 1 1 122 122 ASP CB C 13 42.771 0.3 . 1 . . . . A 122 ASP CB . 30195 1 944 . 1 1 122 122 ASP N N 15 119.726 0.3 . 1 . . . . A 122 ASP N . 30195 1 945 . 1 1 123 123 GLU H H 1 8.222 0.020 . 1 . . . . A 123 GLU H . 30195 1 946 . 1 1 123 123 GLU HA H 1 4.049 0.020 . 1 . . . . A 123 GLU HA . 30195 1 947 . 1 1 123 123 GLU HB2 H 1 1.878 0.020 . 1 . . . . A 123 GLU HB2 . 30195 1 948 . 1 1 123 123 GLU HB3 H 1 1.878 0.020 . 1 . . . . A 123 GLU HB3 . 30195 1 949 . 1 1 123 123 GLU CA C 13 56.620 0.3 . 1 . . . . A 123 GLU CA . 30195 1 950 . 1 1 123 123 GLU CB C 13 26.580 0.3 . 1 . . . . A 123 GLU CB . 30195 1 951 . 1 1 123 123 GLU N N 15 119.915 0.3 . 1 . . . . A 123 GLU N . 30195 1 952 . 1 1 124 124 MET H H 1 7.878 0.020 . 1 . . . . A 124 MET H . 30195 1 953 . 1 1 124 124 MET HA H 1 3.886 0.020 . 1 . . . . A 124 MET HA . 30195 1 954 . 1 1 124 124 MET HB2 H 1 2.131 0.020 . 1 . . . . A 124 MET HB2 . 30195 1 955 . 1 1 124 124 MET HB3 H 1 2.131 0.020 . 1 . . . . A 124 MET HB3 . 30195 1 956 . 1 1 124 124 MET CA C 13 56.130 0.3 . 1 . . . . A 124 MET CA . 30195 1 957 . 1 1 124 124 MET CB C 13 30.461 0.3 . 1 . . . . A 124 MET CB . 30195 1 958 . 1 1 124 124 MET N N 15 119.080 0.3 . 1 . . . . A 124 MET N . 30195 1 959 . 1 1 125 125 ILE H H 1 8.169 0.020 . 1 . . . . A 125 ILE H . 30195 1 960 . 1 1 125 125 ILE HA H 1 3.795 0.020 . 1 . . . . A 125 ILE HA . 30195 1 961 . 1 1 125 125 ILE HB H 1 1.733 0.020 . 1 . . . . A 125 ILE HB . 30195 1 962 . 1 1 125 125 ILE HG21 H 1 0.828 0.020 . 1 . . . . A 125 ILE HG21 . 30195 1 963 . 1 1 125 125 ILE HG22 H 1 0.828 0.020 . 1 . . . . A 125 ILE HG22 . 30195 1 964 . 1 1 125 125 ILE HG23 H 1 0.828 0.020 . 1 . . . . A 125 ILE HG23 . 30195 1 965 . 1 1 125 125 ILE HD11 H 1 0.774 0.020 . 1 . . . . A 125 ILE HD11 . 30195 1 966 . 1 1 125 125 ILE HD12 H 1 0.774 0.020 . 1 . . . . A 125 ILE HD12 . 30195 1 967 . 1 1 125 125 ILE HD13 H 1 0.774 0.020 . 1 . . . . A 125 ILE HD13 . 30195 1 968 . 1 1 125 125 ILE CA C 13 61.958 0.3 . 1 . . . . A 125 ILE CA . 30195 1 969 . 1 1 125 125 ILE CB C 13 34.842 0.3 . 1 . . . . A 125 ILE CB . 30195 1 970 . 1 1 125 125 ILE N N 15 119.157 0.3 . 1 . . . . A 125 ILE N . 30195 1 971 . 1 1 126 126 ARG H H 1 7.904 0.020 . 1 . . . . A 126 ARG H . 30195 1 972 . 1 1 126 126 ARG HA H 1 4.067 0.020 . 1 . . . . A 126 ARG HA . 30195 1 973 . 1 1 126 126 ARG HB2 H 1 2.022 0.020 . 1 . . . . A 126 ARG HB2 . 30195 1 974 . 1 1 126 126 ARG HB3 H 1 2.022 0.020 . 1 . . . . A 126 ARG HB3 . 30195 1 975 . 1 1 126 126 ARG CA C 13 56.202 0.3 . 1 . . . . A 126 ARG CA . 30195 1 976 . 1 1 126 126 ARG CB C 13 27.629 0.3 . 1 . . . . A 126 ARG CB . 30195 1 977 . 1 1 126 126 ARG N N 15 119.956 0.3 . 1 . . . . A 126 ARG N . 30195 1 978 . 1 1 127 127 GLU H H 1 8.024 0.020 . 1 . . . . A 127 GLU H . 30195 1 979 . 1 1 127 127 GLU HA H 1 4.012 0.020 . 1 . . . . A 127 GLU HA . 30195 1 980 . 1 1 127 127 GLU HB2 H 1 1.932 0.020 . 1 . . . . A 127 GLU HB2 . 30195 1 981 . 1 1 127 127 GLU HB3 H 1 1.932 0.020 . 1 . . . . A 127 GLU HB3 . 30195 1 982 . 1 1 127 127 GLU CA C 13 54.990 0.3 . 1 . . . . A 127 GLU CA . 30195 1 983 . 1 1 127 127 GLU CB C 13 26.763 0.3 . 1 . . . . A 127 GLU CB . 30195 1 984 . 1 1 127 127 GLU N N 15 118.102 0.3 . 1 . . . . A 127 GLU N . 30195 1 985 . 1 1 128 128 ALA H H 1 7.689 0.020 . 1 . . . . A 128 ALA H . 30195 1 986 . 1 1 128 128 ALA HA H 1 4.175 0.020 . 1 . . . . A 128 ALA HA . 30195 1 987 . 1 1 128 128 ALA HB1 H 1 1.353 0.020 . 1 . . . . A 128 ALA HB1 . 30195 1 988 . 1 1 128 128 ALA HB2 H 1 1.353 0.020 . 1 . . . . A 128 ALA HB2 . 30195 1 989 . 1 1 128 128 ALA HB3 H 1 1.353 0.020 . 1 . . . . A 128 ALA HB3 . 30195 1 990 . 1 1 128 128 ALA CA C 13 50.176 0.3 . 1 . . . . A 128 ALA CA . 30195 1 991 . 1 1 128 128 ALA CB C 13 16.379 0.3 . 1 . . . . A 128 ALA CB . 30195 1 992 . 1 1 128 128 ALA N N 15 121.388 0.3 . 1 . . . . A 128 ALA N . 30195 1 993 . 1 1 129 129 ALA H H 1 8.006 0.020 . 1 . . . . A 129 ALA H . 30195 1 994 . 1 1 129 129 ALA HA H 1 4.103 0.020 . 1 . . . . A 129 ALA HA . 30195 1 995 . 1 1 129 129 ALA HB1 H 1 1.461 0.020 . 1 . . . . A 129 ALA HB1 . 30195 1 996 . 1 1 129 129 ALA HB2 H 1 1.461 0.020 . 1 . . . . A 129 ALA HB2 . 30195 1 997 . 1 1 129 129 ALA HB3 H 1 1.461 0.020 . 1 . . . . A 129 ALA HB3 . 30195 1 998 . 1 1 129 129 ALA CA C 13 49.907 0.3 . 1 . . . . A 129 ALA CA . 30195 1 999 . 1 1 129 129 ALA CB C 13 15.435 0.3 . 1 . . . . A 129 ALA CB . 30195 1 1000 . 1 1 129 129 ALA N N 15 121.132 0.3 . 1 . . . . A 129 ALA N . 30195 1 1001 . 1 1 130 130 ILE H H 1 7.774 0.020 . 1 . . . . A 130 ILE H . 30195 1 1002 . 1 1 130 130 ILE HA H 1 4.211 0.020 . 1 . . . . A 130 ILE HA . 30195 1 1003 . 1 1 130 130 ILE HB H 1 1.823 0.020 . 1 . . . . A 130 ILE HB . 30195 1 1004 . 1 1 130 130 ILE HG12 H 1 1.208 0.020 . 1 . . . . A 130 ILE HG12 . 30195 1 1005 . 1 1 130 130 ILE HG13 H 1 1.208 0.020 . 1 . . . . A 130 ILE HG13 . 30195 1 1006 . 1 1 130 130 ILE HD11 H 1 0.810 0.020 . 1 . . . . A 130 ILE HD11 . 30195 1 1007 . 1 1 130 130 ILE HD12 H 1 0.810 0.020 . 1 . . . . A 130 ILE HD12 . 30195 1 1008 . 1 1 130 130 ILE HD13 H 1 0.810 0.020 . 1 . . . . A 130 ILE HD13 . 30195 1 1009 . 1 1 130 130 ILE CA C 13 58.693 0.3 . 1 . . . . A 130 ILE CA . 30195 1 1010 . 1 1 130 130 ILE CB C 13 35.968 0.3 . 1 . . . . A 130 ILE CB . 30195 1 1011 . 1 1 130 130 ILE N N 15 118.856 0.3 . 1 . . . . A 130 ILE N . 30195 1 1012 . 1 1 131 131 ASP H H 1 8.345 0.020 . 1 . . . . A 131 ASP H . 30195 1 1013 . 1 1 131 131 ASP HA H 1 4.646 0.020 . 1 . . . . A 131 ASP HA . 30195 1 1014 . 1 1 131 131 ASP HB2 H 1 2.674 0.020 . 1 . . . . A 131 ASP HB2 . 30195 1 1015 . 1 1 131 131 ASP HB3 H 1 2.674 0.020 . 1 . . . . A 131 ASP HB3 . 30195 1 1016 . 1 1 131 131 ASP CA C 13 51.388 0.3 . 1 . . . . A 131 ASP CA . 30195 1 1017 . 1 1 131 131 ASP CB C 13 37.384 0.3 . 1 . . . . A 131 ASP CB . 30195 1 1018 . 1 1 131 131 ASP N N 15 123.284 0.3 . 1 . . . . A 131 ASP N . 30195 1 1019 . 1 1 132 132 GLY H H 1 8.229 0.020 . 1 . . . . A 132 GLY H . 30195 1 1020 . 1 1 132 132 GLY HA2 H 1 3.813 0.020 . 1 . . . . A 132 GLY HA2 . 30195 1 1021 . 1 1 132 132 GLY HA3 H 1 3.813 0.020 . 1 . . . . A 132 GLY HA3 . 30195 1 1022 . 1 1 132 132 GLY CA C 13 43.309 0.3 . 1 . . . . A 132 GLY CA . 30195 1 1023 . 1 1 132 132 GLY N N 15 108.046 0.3 . 1 . . . . A 132 GLY N . 30195 1 1024 . 1 1 133 133 ASP H H 1 8.190 0.020 . 1 . . . . A 133 ASP H . 30195 1 1025 . 1 1 133 133 ASP HA H 1 4.682 0.020 . 1 . . . . A 133 ASP HA . 30195 1 1026 . 1 1 133 133 ASP HB2 H 1 2.493 0.020 . 1 . . . . A 133 ASP HB2 . 30195 1 1027 . 1 1 133 133 ASP HB3 H 1 2.493 0.020 . 1 . . . . A 133 ASP HB3 . 30195 1 1028 . 1 1 133 133 ASP CA C 13 51.422 0.3 . 1 . . . . A 133 ASP CA . 30195 1 1029 . 1 1 133 133 ASP CB C 13 38.346 0.3 . 1 . . . . A 133 ASP CB . 30195 1 1030 . 1 1 133 133 ASP N N 15 119.587 0.3 . 1 . . . . A 133 ASP N . 30195 1 1031 . 1 1 134 134 GLY H H 1 8.213 0.020 . 1 . . . . A 134 GLY H . 30195 1 1032 . 1 1 134 134 GLY HA2 H 1 3.831 0.020 . 1 . . . . A 134 GLY HA2 . 30195 1 1033 . 1 1 134 134 GLY HA3 H 1 3.831 0.020 . 1 . . . . A 134 GLY HA3 . 30195 1 1034 . 1 1 134 134 GLY CA C 13 42.890 0.3 . 1 . . . . A 134 GLY CA . 30195 1 1035 . 1 1 134 134 GLY N N 15 108.030 0.3 . 1 . . . . A 134 GLY N . 30195 1 1036 . 1 1 135 135 GLN H H 1 8.109 0.020 . 1 . . . . A 135 GLN H . 30195 1 1037 . 1 1 135 135 GLN HA H 1 4.646 0.020 . 1 . . . . A 135 GLN HA . 30195 1 1038 . 1 1 135 135 GLN HB2 H 1 1.769 0.020 . 1 . . . . A 135 GLN HB2 . 30195 1 1039 . 1 1 135 135 GLN HB3 H 1 1.769 0.020 . 1 . . . . A 135 GLN HB3 . 30195 1 1040 . 1 1 135 135 GLN CA C 13 52.499 0.3 . 1 . . . . A 135 GLN CA . 30195 1 1041 . 1 1 135 135 GLN N N 15 118.777 0.3 . 1 . . . . A 135 GLN N . 30195 1 1042 . 1 1 136 136 VAL H H 1 8.476 0.020 . 1 . . . . A 136 VAL H . 30195 1 1043 . 1 1 136 136 VAL HA H 1 4.609 0.020 . 1 . . . . A 136 VAL HA . 30195 1 1044 . 1 1 136 136 VAL HB H 1 1.878 0.020 . 1 . . . . A 136 VAL HB . 30195 1 1045 . 1 1 136 136 VAL HG11 H 1 1.027 0.020 . 1 . . . . A 136 VAL HG11 . 30195 1 1046 . 1 1 136 136 VAL HG12 H 1 1.027 0.020 . 1 . . . . A 136 VAL HG12 . 30195 1 1047 . 1 1 136 136 VAL HG13 H 1 1.027 0.020 . 1 . . . . A 136 VAL HG13 . 30195 1 1048 . 1 1 136 136 VAL HG21 H 1 1.027 0.020 . 1 . . . . A 136 VAL HG21 . 30195 1 1049 . 1 1 136 136 VAL HG22 H 1 1.027 0.020 . 1 . . . . A 136 VAL HG22 . 30195 1 1050 . 1 1 136 136 VAL HG23 H 1 1.027 0.020 . 1 . . . . A 136 VAL HG23 . 30195 1 1051 . 1 1 136 136 VAL CA C 13 58.532 0.3 . 1 . . . . A 136 VAL CA . 30195 1 1052 . 1 1 136 136 VAL CB C 13 31.326 0.3 . 1 . . . . A 136 VAL CB . 30195 1 1053 . 1 1 136 136 VAL N N 15 122.094 0.3 . 1 . . . . A 136 VAL N . 30195 1 1054 . 1 1 137 137 ASN H H 1 8.607 0.020 . 1 . . . . A 137 ASN H . 30195 1 1055 . 1 1 137 137 ASN HA H 1 4.627 0.020 . 1 . . . . A 137 ASN HA . 30195 1 1056 . 1 1 137 137 ASN HB2 H 1 2.583 0.020 . 1 . . . . A 137 ASN HB2 . 30195 1 1057 . 1 1 137 137 ASN HB3 H 1 2.583 0.020 . 1 . . . . A 137 ASN HB3 . 30195 1 1058 . 1 1 137 137 ASN CA C 13 49.537 0.3 . 1 . . . . A 137 ASN CA . 30195 1 1059 . 1 1 137 137 ASN CB C 13 35.889 0.3 . 1 . . . . A 137 ASN CB . 30195 1 1060 . 1 1 137 137 ASN N N 15 123.726 0.3 . 1 . . . . A 137 ASN N . 30195 1 1061 . 1 1 138 138 TYR H H 1 8.275 0.020 . 1 . . . . A 138 TYR H . 30195 1 1062 . 1 1 138 138 TYR HA H 1 4.121 0.020 . 1 . . . . A 138 TYR HA . 30195 1 1063 . 1 1 138 138 TYR CA C 13 58.154 0.3 . 1 . . . . A 138 TYR CA . 30195 1 1064 . 1 1 138 138 TYR CB C 13 35.260 0.3 . 1 . . . . A 138 TYR CB . 30195 1 1065 . 1 1 138 138 TYR N N 15 123.091 0.3 . 1 . . . . A 138 TYR N . 30195 1 1066 . 1 1 139 139 GLU H H 1 8.201 0.020 . 1 . . . . A 139 GLU H . 30195 1 1067 . 1 1 139 139 GLU HA H 1 3.976 0.020 . 1 . . . . A 139 GLU HA . 30195 1 1068 . 1 1 139 139 GLU HB2 H 1 1.787 0.020 . 1 . . . . A 139 GLU HB2 . 30195 1 1069 . 1 1 139 139 GLU HB3 H 1 1.787 0.020 . 1 . . . . A 139 GLU HB3 . 30195 1 1070 . 1 1 139 139 GLU HG2 H 1 2.004 0.020 . 1 . . . . A 139 GLU HG2 . 30195 1 1071 . 1 1 139 139 GLU HG3 H 1 2.004 0.020 . 1 . . . . A 139 GLU HG3 . 30195 1 1072 . 1 1 139 139 GLU CA C 13 56.606 0.3 . 1 . . . . A 139 GLU CA . 30195 1 1073 . 1 1 139 139 GLU CB C 13 26.501 0.3 . 1 . . . . A 139 GLU CB . 30195 1 1074 . 1 1 139 139 GLU N N 15 119.717 0.3 . 1 . . . . A 139 GLU N . 30195 1 1075 . 1 1 140 140 GLU H H 1 7.876 0.020 . 1 . . . . A 140 GLU H . 30195 1 1076 . 1 1 140 140 GLU HA H 1 4.030 0.020 . 1 . . . . A 140 GLU HA . 30195 1 1077 . 1 1 140 140 GLU HB2 H 1 1.914 0.020 . 1 . . . . A 140 GLU HB2 . 30195 1 1078 . 1 1 140 140 GLU HB3 H 1 1.914 0.020 . 1 . . . . A 140 GLU HB3 . 30195 1 1079 . 1 1 140 140 GLU CA C 13 55.899 0.3 . 1 . . . . A 140 GLU CA . 30195 1 1080 . 1 1 140 140 GLU CB C 13 26.921 0.3 . 1 . . . . A 140 GLU CB . 30195 1 1081 . 1 1 140 140 GLU N N 15 117.372 0.3 . 1 . . . . A 140 GLU N . 30195 1 1082 . 1 1 141 141 PHE H H 1 7.973 0.020 . 1 . . . . A 141 PHE H . 30195 1 1083 . 1 1 141 141 PHE HA H 1 3.904 0.020 . 1 . . . . A 141 PHE HA . 30195 1 1084 . 1 1 141 141 PHE CA C 13 57.919 0.3 . 1 . . . . A 141 PHE CA . 30195 1 1085 . 1 1 141 141 PHE CB C 13 36.519 0.3 . 1 . . . . A 141 PHE CB . 30195 1 1086 . 1 1 141 141 PHE N N 15 120.644 0.3 . 1 . . . . A 141 PHE N . 30195 1 1087 . 1 1 142 142 VAL H H 1 8.130 0.020 . 1 . . . . A 142 VAL H . 30195 1 1088 . 1 1 142 142 VAL HA H 1 3.958 0.020 . 1 . . . . A 142 VAL HA . 30195 1 1089 . 1 1 142 142 VAL HB H 1 1.733 0.020 . 1 . . . . A 142 VAL HB . 30195 1 1090 . 1 1 142 142 VAL HG11 H 1 0.756 0.020 . 1 . . . . A 142 VAL HG11 . 30195 1 1091 . 1 1 142 142 VAL HG12 H 1 0.756 0.020 . 1 . . . . A 142 VAL HG12 . 30195 1 1092 . 1 1 142 142 VAL HG13 H 1 0.756 0.020 . 1 . . . . A 142 VAL HG13 . 30195 1 1093 . 1 1 142 142 VAL HG21 H 1 0.756 0.020 . 1 . . . . A 142 VAL HG21 . 30195 1 1094 . 1 1 142 142 VAL HG22 H 1 0.756 0.020 . 1 . . . . A 142 VAL HG22 . 30195 1 1095 . 1 1 142 142 VAL HG23 H 1 0.756 0.020 . 1 . . . . A 142 VAL HG23 . 30195 1 1096 . 1 1 142 142 VAL CA C 13 63.237 0.3 . 1 . . . . A 142 VAL CA . 30195 1 1097 . 1 1 142 142 VAL CB C 13 29.260 0.3 . 1 . . . . A 142 VAL CB . 30195 1 1098 . 1 1 142 142 VAL N N 15 118.798 0.3 . 1 . . . . A 142 VAL N . 30195 1 1099 . 1 1 143 143 GLN H H 1 7.759 0.020 . 1 . . . . A 143 GLN H . 30195 1 1100 . 1 1 143 143 GLN HA H 1 4.067 0.020 . 1 . . . . A 143 GLN HA . 30195 1 1101 . 1 1 143 143 GLN HB2 H 1 1.914 0.020 . 1 . . . . A 143 GLN HB2 . 30195 1 1102 . 1 1 143 143 GLN HB3 H 1 1.914 0.020 . 1 . . . . A 143 GLN HB3 . 30195 1 1103 . 1 1 143 143 GLN CA C 13 55.431 0.3 . 1 . . . . A 143 GLN CA . 30195 1 1104 . 1 1 143 143 GLN CB C 13 29.910 0.3 . 1 . . . . A 143 GLN CB . 30195 1 1105 . 1 1 143 143 GLN N N 15 119.619 0.3 . 1 . . . . A 143 GLN N . 30195 1 1106 . 1 1 144 144 MET H H 1 7.784 0.020 . 1 . . . . A 144 MET H . 30195 1 1107 . 1 1 144 144 MET HA H 1 4.139 0.020 . 1 . . . . A 144 MET HA . 30195 1 1108 . 1 1 144 144 MET HB2 H 1 2.022 0.020 . 1 . . . . A 144 MET HB2 . 30195 1 1109 . 1 1 144 144 MET HB3 H 1 2.022 0.020 . 1 . . . . A 144 MET HB3 . 30195 1 1110 . 1 1 144 144 MET CA C 13 53.543 0.3 . 1 . . . . A 144 MET CA . 30195 1 1111 . 1 1 144 144 MET CB C 13 28.966 0.3 . 1 . . . . A 144 MET CB . 30195 1 1112 . 1 1 144 144 MET N N 15 116.729 0.3 . 1 . . . . A 144 MET N . 30195 1 1113 . 1 1 145 145 MET H H 1 7.870 0.020 . 1 . . . . A 145 MET H . 30195 1 1114 . 1 1 145 145 MET HA H 1 4.229 0.020 . 1 . . . . A 145 MET HA . 30195 1 1115 . 1 1 145 145 MET HB2 H 1 1.896 0.020 . 1 . . . . A 145 MET HB2 . 30195 1 1116 . 1 1 145 145 MET HB3 H 1 1.896 0.020 . 1 . . . . A 145 MET HB3 . 30195 1 1117 . 1 1 145 145 MET CA C 13 53.677 0.3 . 1 . . . . A 145 MET CA . 30195 1 1118 . 1 1 145 145 MET CB C 13 29.674 0.3 . 1 . . . . A 145 MET CB . 30195 1 1119 . 1 1 145 145 MET N N 15 117.399 0.3 . 1 . . . . A 145 MET N . 30195 1 1120 . 1 1 146 146 THR H H 1 7.652 0.020 . 1 . . . . A 146 THR H . 30195 1 1121 . 1 1 146 146 THR HA H 1 4.248 0.020 . 1 . . . . A 146 THR HA . 30195 1 1122 . 1 1 146 146 THR HB H 1 4.067 0.020 . 1 . . . . A 146 THR HB . 30195 1 1123 . 1 1 146 146 THR HG21 H 1 1.154 0.020 . 1 . . . . A 146 THR HG21 . 30195 1 1124 . 1 1 146 146 THR HG22 H 1 1.154 0.020 . 1 . . . . A 146 THR HG22 . 30195 1 1125 . 1 1 146 146 THR HG23 H 1 1.154 0.020 . 1 . . . . A 146 THR HG23 . 30195 1 1126 . 1 1 146 146 THR CA C 13 59.703 0.3 . 1 . . . . A 146 THR CA . 30195 1 1127 . 1 1 146 146 THR CB C 13 67.041 0.3 . 1 . . . . A 146 THR CB . 30195 1 1128 . 1 1 146 146 THR N N 15 111.380 0.3 . 1 . . . . A 146 THR N . 30195 1 1129 . 1 1 147 147 ALA H H 1 7.711 0.020 . 1 . . . . A 147 ALA H . 30195 1 1130 . 1 1 147 147 ALA HA H 1 4.229 0.020 . 1 . . . . A 147 ALA HA . 30195 1 1131 . 1 1 147 147 ALA HB1 H 1 1.424 0.020 . 1 . . . . A 147 ALA HB1 . 30195 1 1132 . 1 1 147 147 ALA HB2 H 1 1.424 0.020 . 1 . . . . A 147 ALA HB2 . 30195 1 1133 . 1 1 147 147 ALA HB3 H 1 1.424 0.020 . 1 . . . . A 147 ALA HB3 . 30195 1 1134 . 1 1 147 147 ALA CA C 13 49.974 0.3 . 1 . . . . A 147 ALA CA . 30195 1 1135 . 1 1 147 147 ALA CB C 13 16.221 0.3 . 1 . . . . A 147 ALA CB . 30195 1 1136 . 1 1 147 147 ALA N N 15 125.991 0.3 . 1 . . . . A 147 ALA N . 30195 1 1137 . 1 1 148 148 LYS H H 1 7.662 0.020 . 1 . . . . A 148 LYS H . 30195 1 1138 . 1 1 148 148 LYS HA H 1 4.139 0.020 . 1 . . . . A 148 LYS HA . 30195 1 1139 . 1 1 148 148 LYS CA C 13 54.889 0.3 . 1 . . . . A 148 LYS CA . 30195 1 1140 . 1 1 148 148 LYS N N 15 125.356 0.3 . 1 . . . . A 148 LYS N . 30195 1 stop_ save_