data_11192 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 11192 _Entry.Title ; Solution structure of the Ig-like domain(433- 525) of murine myosin-binding protein C, fast-type ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2010-07-21 _Entry.Accession_date 2010-07-23 _Entry.Last_release_date 2011-07-20 _Entry.Original_release_date 2011-07-20 _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 3.0.9.14 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.Entry_ID 1 K. Inoue . . . 11192 2 K. Izumi . . . 11192 3 M. Yoshida . . . 11192 4 F. Hayashi . . . 11192 5 S. Yokoyama . . . 11192 stop_ loop_ _SG_project.SG_project_ID _SG_project.Project_name _SG_project.Full_name_of_center _SG_project.Initial_of_center _SG_project.Entry_ID . 'Protein 3000' 'RIKEN Structural Genomics/Proteomics Initiative (RSGI)' . 11192 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 11192 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 460 11192 '15N chemical shifts' 104 11192 '1H chemical shifts' 717 11192 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 1 . . 2011-07-20 2010-07-21 original author . 11192 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 2DLT 'BMRB Entry Tracking System' 11192 stop_ save_ ############### # Citations # ############### save_citation_1 _Citation.Sf_category citations _Citation.Sf_framecode citation_1 _Citation.Entry_ID 11192 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID . _Citation.Full_citation . _Citation.Title ; Solution structure of the Ig-like domain(433 - 525) of murine myosin-binding protein C, fast-type ; _Citation.Status 'in preparation' _Citation.Type journal _Citation.Journal_abbrev . _Citation.Journal_name_full . _Citation.Journal_volume . _Citation.Journal_issue . _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first . _Citation.Page_last . _Citation.Year . _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.Entry_ID _Citation_author.Citation_ID 1 K. Inoue . . . 11192 1 2 K. Izumi . . . 11192 1 3 M. Yoshida . . . 11192 1 4 F. Hayashi . . . 11192 1 5 S. Yokoyama . . . 11192 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 11192 _Assembly.ID 1 _Assembly.Name 'Myosin binding protein C, fast-type' _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 'Ig-like domain' 1 $entity_1 A . yes native no no . . . 11192 1 stop_ loop_ _Assembly_db_link.Author_supplied _Assembly_db_link.Database_code _Assembly_db_link.Accession_code _Assembly_db_link.Entry_mol_code _Assembly_db_link.Entry_mol_name _Assembly_db_link.Entry_experimental_method _Assembly_db_link.Entry_structure_resolution _Assembly_db_link.Entry_relation_type _Assembly_db_link.Entry_details _Assembly_db_link.Entry_ID _Assembly_db_link.Assembly_ID yes PDB 2dlt . . . . . . 11192 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 11192 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name 'Ig-like domain' _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 ; GSSGSSGQLEVLQDIADLTV KAAEQAVFKCEVSDEKVTGK WYKNGVEVRPSKRITISHVG RFHKLVIDDVRPEDEGDYTF VPDGYALSLSAKLNFLEIKV SGPSSG ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 106 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-11-26 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 no PDB 2DLT . "Solution Structure Of The Ig-Like Domain(433- 525) Of Murine Myosin-Binding Protein C, Fast-Type" . . . . . 100.00 106 100.00 100.00 2.01e-69 . . . . 11192 1 2 no REF XP_011766651 . "PREDICTED: LOW QUALITY PROTEIN: myosin-binding protein C, fast-type [Macaca nemestrina]" . . . . . 50.94 1220 98.15 100.00 2.78e-25 . . . . 11192 1 stop_ loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID 'Ig-like domain' . 11192 1 stop_ loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 . GLY . 11192 1 2 . SER . 11192 1 3 . SER . 11192 1 4 . GLY . 11192 1 5 . SER . 11192 1 6 . SER . 11192 1 7 . GLY . 11192 1 8 . GLN . 11192 1 9 . LEU . 11192 1 10 . GLU . 11192 1 11 . VAL . 11192 1 12 . LEU . 11192 1 13 . GLN . 11192 1 14 . ASP . 11192 1 15 . ILE . 11192 1 16 . ALA . 11192 1 17 . ASP . 11192 1 18 . LEU . 11192 1 19 . THR . 11192 1 20 . VAL . 11192 1 21 . LYS . 11192 1 22 . ALA . 11192 1 23 . ALA . 11192 1 24 . GLU . 11192 1 25 . GLN . 11192 1 26 . ALA . 11192 1 27 . VAL . 11192 1 28 . PHE . 11192 1 29 . LYS . 11192 1 30 . CYS . 11192 1 31 . GLU . 11192 1 32 . VAL . 11192 1 33 . SER . 11192 1 34 . ASP . 11192 1 35 . GLU . 11192 1 36 . LYS . 11192 1 37 . VAL . 11192 1 38 . THR . 11192 1 39 . GLY . 11192 1 40 . LYS . 11192 1 41 . TRP . 11192 1 42 . TYR . 11192 1 43 . LYS . 11192 1 44 . ASN . 11192 1 45 . GLY . 11192 1 46 . VAL . 11192 1 47 . GLU . 11192 1 48 . VAL . 11192 1 49 . ARG . 11192 1 50 . PRO . 11192 1 51 . SER . 11192 1 52 . LYS . 11192 1 53 . ARG . 11192 1 54 . ILE . 11192 1 55 . THR . 11192 1 56 . ILE . 11192 1 57 . SER . 11192 1 58 . HIS . 11192 1 59 . VAL . 11192 1 60 . GLY . 11192 1 61 . ARG . 11192 1 62 . PHE . 11192 1 63 . HIS . 11192 1 64 . LYS . 11192 1 65 . LEU . 11192 1 66 . VAL . 11192 1 67 . ILE . 11192 1 68 . ASP . 11192 1 69 . ASP . 11192 1 70 . VAL . 11192 1 71 . ARG . 11192 1 72 . PRO . 11192 1 73 . GLU . 11192 1 74 . ASP . 11192 1 75 . GLU . 11192 1 76 . GLY . 11192 1 77 . ASP . 11192 1 78 . TYR . 11192 1 79 . THR . 11192 1 80 . PHE . 11192 1 81 . VAL . 11192 1 82 . PRO . 11192 1 83 . ASP . 11192 1 84 . GLY . 11192 1 85 . TYR . 11192 1 86 . ALA . 11192 1 87 . LEU . 11192 1 88 . SER . 11192 1 89 . LEU . 11192 1 90 . SER . 11192 1 91 . ALA . 11192 1 92 . LYS . 11192 1 93 . LEU . 11192 1 94 . ASN . 11192 1 95 . PHE . 11192 1 96 . LEU . 11192 1 97 . GLU . 11192 1 98 . ILE . 11192 1 99 . LYS . 11192 1 100 . VAL . 11192 1 101 . SER . 11192 1 102 . GLY . 11192 1 103 . PRO . 11192 1 104 . SER . 11192 1 105 . SER . 11192 1 106 . GLY . 11192 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . GLY 1 1 11192 1 . SER 2 2 11192 1 . SER 3 3 11192 1 . GLY 4 4 11192 1 . SER 5 5 11192 1 . SER 6 6 11192 1 . GLY 7 7 11192 1 . GLN 8 8 11192 1 . LEU 9 9 11192 1 . GLU 10 10 11192 1 . VAL 11 11 11192 1 . LEU 12 12 11192 1 . GLN 13 13 11192 1 . ASP 14 14 11192 1 . ILE 15 15 11192 1 . ALA 16 16 11192 1 . ASP 17 17 11192 1 . LEU 18 18 11192 1 . THR 19 19 11192 1 . VAL 20 20 11192 1 . LYS 21 21 11192 1 . ALA 22 22 11192 1 . ALA 23 23 11192 1 . GLU 24 24 11192 1 . GLN 25 25 11192 1 . ALA 26 26 11192 1 . VAL 27 27 11192 1 . PHE 28 28 11192 1 . LYS 29 29 11192 1 . CYS 30 30 11192 1 . GLU 31 31 11192 1 . VAL 32 32 11192 1 . SER 33 33 11192 1 . ASP 34 34 11192 1 . GLU 35 35 11192 1 . LYS 36 36 11192 1 . VAL 37 37 11192 1 . THR 38 38 11192 1 . GLY 39 39 11192 1 . LYS 40 40 11192 1 . TRP 41 41 11192 1 . TYR 42 42 11192 1 . LYS 43 43 11192 1 . ASN 44 44 11192 1 . GLY 45 45 11192 1 . VAL 46 46 11192 1 . GLU 47 47 11192 1 . VAL 48 48 11192 1 . ARG 49 49 11192 1 . PRO 50 50 11192 1 . SER 51 51 11192 1 . LYS 52 52 11192 1 . ARG 53 53 11192 1 . ILE 54 54 11192 1 . THR 55 55 11192 1 . ILE 56 56 11192 1 . SER 57 57 11192 1 . HIS 58 58 11192 1 . VAL 59 59 11192 1 . GLY 60 60 11192 1 . ARG 61 61 11192 1 . PHE 62 62 11192 1 . HIS 63 63 11192 1 . LYS 64 64 11192 1 . LEU 65 65 11192 1 . VAL 66 66 11192 1 . ILE 67 67 11192 1 . ASP 68 68 11192 1 . ASP 69 69 11192 1 . VAL 70 70 11192 1 . ARG 71 71 11192 1 . PRO 72 72 11192 1 . GLU 73 73 11192 1 . ASP 74 74 11192 1 . GLU 75 75 11192 1 . GLY 76 76 11192 1 . ASP 77 77 11192 1 . TYR 78 78 11192 1 . THR 79 79 11192 1 . PHE 80 80 11192 1 . VAL 81 81 11192 1 . PRO 82 82 11192 1 . ASP 83 83 11192 1 . GLY 84 84 11192 1 . TYR 85 85 11192 1 . ALA 86 86 11192 1 . LEU 87 87 11192 1 . SER 88 88 11192 1 . LEU 89 89 11192 1 . SER 90 90 11192 1 . ALA 91 91 11192 1 . LYS 92 92 11192 1 . LEU 93 93 11192 1 . ASN 94 94 11192 1 . PHE 95 95 11192 1 . LEU 96 96 11192 1 . GLU 97 97 11192 1 . ILE 98 98 11192 1 . LYS 99 99 11192 1 . VAL 100 100 11192 1 . SER 101 101 11192 1 . GLY 102 102 11192 1 . PRO 103 103 11192 1 . SER 104 104 11192 1 . SER 105 105 11192 1 . GLY 106 106 11192 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 11192 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Subvariant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Cellular_location _Entity_natural_src.Fragment _Entity_natural_src.Fraction _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Plasmid_details _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Dev_stage _Entity_natural_src.Details _Entity_natural_src.Citation_ID _Entity_natural_src.Citation_label _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $entity_1 . 10090 organism . 'Mus musculus' 'house mouse' . . Eukaryota Metazoa Mus musculus . . . . . . . . . . . . . . . . . . . . . 11192 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 11192 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_subvariant _Entity_experimental_src.Host_org_organ _Entity_experimental_src.Host_org_tissue _Entity_experimental_src.Host_org_tissue_fraction _Entity_experimental_src.Host_org_cell_line _Entity_experimental_src.Host_org_cell_type _Entity_experimental_src.Host_org_cellular_location _Entity_experimental_src.Host_org_organelle _Entity_experimental_src.Host_org_gene _Entity_experimental_src.Host_org_culture_collection _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Host_org_dev_stage _Entity_experimental_src.Details _Entity_experimental_src.Citation_ID _Entity_experimental_src.Citation_label _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $entity_1 . 'cell free synthesis' 'E. coli - cell free' 'E. coli' . 562 Escherichia coli . . . . . . . . . . . . . plasmid . . P050815-18 . . . . . . 11192 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 11192 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details ; 1.16mM U-15N, 13C-labeled {protein;} 20mM {d-Tris-HCl;} 100mM {NaCl;} 1mM {d-DTT;} 0.02% {NaN3;} 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 'Ig-like domain' '[U-13C; U-15N]' . . 1 $entity_1 . protein 1.16 . . mM . . . . 11192 1 2 d-Tris-HCl 'natural abundance' . . . . . buffer 20 . . mM . . . . 11192 1 3 NaCl 'natural abundance' . . . . . salt 100 . . mM . . . . 11192 1 4 d-DTT 'natural abundance' . . . . . salt 1 . . mM . . . . 11192 1 5 NaN3 'natural abundance' . . . . . salt 0.02 . . % . . . . 11192 1 6 H2O . . . . . . solvent 90 . . % . . . . 11192 1 7 D2O . . . . . . solvent 10 . . % . . . . 11192 1 stop_ save_ ####################### # Sample conditions # ####################### save_condition_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode condition_1 _Sample_condition_list.Entry_ID 11192 _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' 120 0.1 mM 11192 1 pH 7.0 0.05 pH 11192 1 pressure 1 0.001 atm 11192 1 temperature 298 0.1 K 11192 1 stop_ save_ ############################ # Computer software used # ############################ save_Delta_NMR _Software.Sf_category software _Software.Sf_framecode Delta_NMR _Software.Entry_ID 11192 _Software.ID 1 _Software.Name 'Delta NMR' _Software.Version 4.3.2 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID JEOL . . 11192 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection 11192 1 stop_ save_ save_NMRPipe _Software.Sf_category software _Software.Sf_framecode NMRPipe _Software.Entry_ID 11192 _Software.ID 2 _Software.Name NMRPipe _Software.Version 20031121 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, F.' . . 11192 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 11192 2 stop_ save_ save_NMRView _Software.Sf_category software _Software.Sf_framecode NMRView _Software.Entry_ID 11192 _Software.ID 3 _Software.Name NMRView _Software.Version 5.0.4 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Johnson, B.A.' . . 11192 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 11192 3 stop_ save_ save_Kujira _Software.Sf_category software _Software.Sf_framecode Kujira _Software.Entry_ID 11192 _Software.ID 4 _Software.Name Kujira _Software.Version 0.93191 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Kobayashi, N.' . . 11192 4 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 11192 4 stop_ save_ save_CYANA _Software.Sf_category software _Software.Sf_framecode CYANA _Software.Entry_ID 11192 _Software.ID 5 _Software.Name CYANA _Software.Version 2.0.17 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Guntert, P.' . . 11192 5 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID refinement 11192 5 'structure solution' 11192 5 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_1 _NMR_spectrometer.Entry_ID 11192 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer JEOL _NMR_spectrometer.Model ECA _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 11192 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 JEOL ECA . 800 . . . 11192 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 11192 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '3D 15N-separated NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $condition_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 11192 1 2 '3D 13C-separated NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $condition_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 11192 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode reference_1 _Chem_shift_reference.Entry_ID 11192 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details ; Chemical shift reference of 1H was based on the proton of water (4.784ppm at 298K) and then those of 15N and 13C were calculated based on their gyromagnetic ratios. ; loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.0 . indirect 0.251449530 . . . . . . . . . 11192 1 H 1 DSS 'methyl protons' . . . . ppm 0.0 . indirect 1.0 . . . . . . . . . 11192 1 N 15 DSS 'methyl protons' . . . . ppm 0.0 . indirect 0.101329118 . . . . . . . . . 11192 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_chemical_shift_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode chemical_shift_1 _Assigned_chem_shift_list.Entry_ID 11192 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $condition_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $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 '3D 15N-separated NOESY' 1 $sample_1 isotropic 11192 1 2 '3D 13C-separated NOESY' 1 $sample_1 isotropic 11192 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 1 $Delta_NMR . . 11192 1 2 $NMRPipe . . 11192 1 3 $NMRView . . 11192 1 4 $Kujira . . 11192 1 5 $CYANA . . 11192 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 5 5 SER HA H 1 4.594 0.030 . 1 . . . . 5 SER HA . 11192 1 2 . 1 1 5 5 SER HB2 H 1 3.876 0.030 . 1 . . . . 5 SER HB2 . 11192 1 3 . 1 1 5 5 SER HB3 H 1 3.876 0.030 . 1 . . . . 5 SER HB3 . 11192 1 4 . 1 1 5 5 SER C C 13 174.551 0.300 . 1 . . . . 5 SER C . 11192 1 5 . 1 1 5 5 SER CA C 13 58.092 0.300 . 1 . . . . 5 SER CA . 11192 1 6 . 1 1 5 5 SER CB C 13 63.809 0.300 . 1 . . . . 5 SER CB . 11192 1 7 . 1 1 6 6 SER H H 1 8.470 0.030 . 1 . . . . 6 SER H . 11192 1 8 . 1 1 6 6 SER HA H 1 4.508 0.030 . 1 . . . . 6 SER HA . 11192 1 9 . 1 1 6 6 SER HB2 H 1 3.903 0.030 . 1 . . . . 6 SER HB2 . 11192 1 10 . 1 1 6 6 SER HB3 H 1 3.903 0.030 . 1 . . . . 6 SER HB3 . 11192 1 11 . 1 1 6 6 SER C C 13 174.832 0.300 . 1 . . . . 6 SER C . 11192 1 12 . 1 1 6 6 SER CA C 13 58.419 0.300 . 1 . . . . 6 SER CA . 11192 1 13 . 1 1 6 6 SER CB C 13 63.662 0.300 . 1 . . . . 6 SER CB . 11192 1 14 . 1 1 6 6 SER N N 15 117.740 0.300 . 1 . . . . 6 SER N . 11192 1 15 . 1 1 7 7 GLY H H 1 8.457 0.030 . 1 . . . . 7 GLY H . 11192 1 16 . 1 1 7 7 GLY HA2 H 1 4.029 0.030 . 1 . . . . 7 GLY HA2 . 11192 1 17 . 1 1 7 7 GLY HA3 H 1 4.029 0.030 . 1 . . . . 7 GLY HA3 . 11192 1 18 . 1 1 7 7 GLY C C 13 173.726 0.300 . 1 . . . . 7 GLY C . 11192 1 19 . 1 1 7 7 GLY CA C 13 45.244 0.300 . 1 . . . . 7 GLY CA . 11192 1 20 . 1 1 7 7 GLY N N 15 110.689 0.300 . 1 . . . . 7 GLY N . 11192 1 21 . 1 1 8 8 GLN H H 1 8.247 0.030 . 1 . . . . 8 GLN H . 11192 1 22 . 1 1 8 8 GLN HA H 1 4.501 0.030 . 1 . . . . 8 GLN HA . 11192 1 23 . 1 1 8 8 GLN HB2 H 1 1.976 0.030 . 2 . . . . 8 GLN HB2 . 11192 1 24 . 1 1 8 8 GLN HB3 H 1 2.099 0.030 . 2 . . . . 8 GLN HB3 . 11192 1 25 . 1 1 8 8 GLN HE21 H 1 7.588 0.030 . 2 . . . . 8 GLN HE21 . 11192 1 26 . 1 1 8 8 GLN HE22 H 1 6.859 0.030 . 2 . . . . 8 GLN HE22 . 11192 1 27 . 1 1 8 8 GLN HG2 H 1 2.346 0.030 . 1 . . . . 8 GLN HG2 . 11192 1 28 . 1 1 8 8 GLN HG3 H 1 2.346 0.030 . 1 . . . . 8 GLN HG3 . 11192 1 29 . 1 1 8 8 GLN C C 13 174.709 0.300 . 1 . . . . 8 GLN C . 11192 1 30 . 1 1 8 8 GLN CA C 13 55.157 0.300 . 1 . . . . 8 GLN CA . 11192 1 31 . 1 1 8 8 GLN CB C 13 29.863 0.300 . 1 . . . . 8 GLN CB . 11192 1 32 . 1 1 8 8 GLN CG C 13 33.501 0.300 . 1 . . . . 8 GLN CG . 11192 1 33 . 1 1 8 8 GLN N N 15 119.828 0.300 . 1 . . . . 8 GLN N . 11192 1 34 . 1 1 8 8 GLN NE2 N 15 112.414 0.300 . 1 . . . . 8 GLN NE2 . 11192 1 35 . 1 1 9 9 LEU H H 1 8.003 0.030 . 1 . . . . 9 LEU H . 11192 1 36 . 1 1 9 9 LEU HA H 1 4.016 0.030 . 1 . . . . 9 LEU HA . 11192 1 37 . 1 1 9 9 LEU HB2 H 1 1.263 0.030 . 2 . . . . 9 LEU HB2 . 11192 1 38 . 1 1 9 9 LEU HB3 H 1 0.641 0.030 . 2 . . . . 9 LEU HB3 . 11192 1 39 . 1 1 9 9 LEU HD11 H 1 0.722 0.030 . 1 . . . . 9 LEU HD1 . 11192 1 40 . 1 1 9 9 LEU HD12 H 1 0.722 0.030 . 1 . . . . 9 LEU HD1 . 11192 1 41 . 1 1 9 9 LEU HD13 H 1 0.722 0.030 . 1 . . . . 9 LEU HD1 . 11192 1 42 . 1 1 9 9 LEU HD21 H 1 0.295 0.030 . 1 . . . . 9 LEU HD2 . 11192 1 43 . 1 1 9 9 LEU HD22 H 1 0.295 0.030 . 1 . . . . 9 LEU HD2 . 11192 1 44 . 1 1 9 9 LEU HD23 H 1 0.295 0.030 . 1 . . . . 9 LEU HD2 . 11192 1 45 . 1 1 9 9 LEU HG H 1 1.140 0.030 . 1 . . . . 9 LEU HG . 11192 1 46 . 1 1 9 9 LEU C C 13 174.551 0.300 . 1 . . . . 9 LEU C . 11192 1 47 . 1 1 9 9 LEU CA C 13 54.589 0.300 . 1 . . . . 9 LEU CA . 11192 1 48 . 1 1 9 9 LEU CB C 13 42.763 0.300 . 1 . . . . 9 LEU CB . 11192 1 49 . 1 1 9 9 LEU CD1 C 13 24.467 0.300 . 2 . . . . 9 LEU CD1 . 11192 1 50 . 1 1 9 9 LEU CD2 C 13 25.502 0.300 . 2 . . . . 9 LEU CD2 . 11192 1 51 . 1 1 9 9 LEU CG C 13 26.365 0.300 . 1 . . . . 9 LEU CG . 11192 1 52 . 1 1 9 9 LEU N N 15 124.809 0.300 . 1 . . . . 9 LEU N . 11192 1 53 . 1 1 10 10 GLU H H 1 8.458 0.030 . 1 . . . . 10 GLU H . 11192 1 54 . 1 1 10 10 GLU HA H 1 4.527 0.030 . 1 . . . . 10 GLU HA . 11192 1 55 . 1 1 10 10 GLU HB2 H 1 1.888 0.030 . 2 . . . . 10 GLU HB2 . 11192 1 56 . 1 1 10 10 GLU HB3 H 1 1.732 0.030 . 2 . . . . 10 GLU HB3 . 11192 1 57 . 1 1 10 10 GLU HG2 H 1 2.049 0.030 . 2 . . . . 10 GLU HG2 . 11192 1 58 . 1 1 10 10 GLU HG3 H 1 2.173 0.030 . 2 . . . . 10 GLU HG3 . 11192 1 59 . 1 1 10 10 GLU C C 13 174.990 0.300 . 1 . . . . 10 GLU C . 11192 1 60 . 1 1 10 10 GLU CA C 13 54.433 0.300 . 1 . . . . 10 GLU CA . 11192 1 61 . 1 1 10 10 GLU CB C 13 31.871 0.300 . 1 . . . . 10 GLU CB . 11192 1 62 . 1 1 10 10 GLU CG C 13 35.873 0.300 . 1 . . . . 10 GLU CG . 11192 1 63 . 1 1 10 10 GLU N N 15 125.366 0.300 . 1 . . . . 10 GLU N . 11192 1 64 . 1 1 11 11 VAL H H 1 8.813 0.030 . 1 . . . . 11 VAL H . 11192 1 65 . 1 1 11 11 VAL HA H 1 3.956 0.030 . 1 . . . . 11 VAL HA . 11192 1 66 . 1 1 11 11 VAL HB H 1 2.065 0.030 . 1 . . . . 11 VAL HB . 11192 1 67 . 1 1 11 11 VAL HG11 H 1 0.878 0.030 . 1 . . . . 11 VAL HG1 . 11192 1 68 . 1 1 11 11 VAL HG12 H 1 0.878 0.030 . 1 . . . . 11 VAL HG1 . 11192 1 69 . 1 1 11 11 VAL HG13 H 1 0.878 0.030 . 1 . . . . 11 VAL HG1 . 11192 1 70 . 1 1 11 11 VAL HG21 H 1 0.814 0.030 . 1 . . . . 11 VAL HG2 . 11192 1 71 . 1 1 11 11 VAL HG22 H 1 0.814 0.030 . 1 . . . . 11 VAL HG2 . 11192 1 72 . 1 1 11 11 VAL HG23 H 1 0.814 0.030 . 1 . . . . 11 VAL HG2 . 11192 1 73 . 1 1 11 11 VAL C C 13 175.236 0.300 . 1 . . . . 11 VAL C . 11192 1 74 . 1 1 11 11 VAL CA C 13 62.673 0.300 . 1 . . . . 11 VAL CA . 11192 1 75 . 1 1 11 11 VAL CB C 13 31.450 0.300 . 1 . . . . 11 VAL CB . 11192 1 76 . 1 1 11 11 VAL CG1 C 13 21.439 0.300 . 2 . . . . 11 VAL CG1 . 11192 1 77 . 1 1 11 11 VAL CG2 C 13 20.845 0.300 . 2 . . . . 11 VAL CG2 . 11192 1 78 . 1 1 11 11 VAL N N 15 124.612 0.300 . 1 . . . . 11 VAL N . 11192 1 79 . 1 1 12 12 LEU H H 1 8.437 0.030 . 1 . . . . 12 LEU H . 11192 1 80 . 1 1 12 12 LEU HA H 1 4.294 0.030 . 1 . . . . 12 LEU HA . 11192 1 81 . 1 1 12 12 LEU HB2 H 1 1.126 0.030 . 2 . . . . 12 LEU HB2 . 11192 1 82 . 1 1 12 12 LEU HB3 H 1 1.449 0.030 . 2 . . . . 12 LEU HB3 . 11192 1 83 . 1 1 12 12 LEU HD11 H 1 0.642 0.030 . 1 . . . . 12 LEU HD1 . 11192 1 84 . 1 1 12 12 LEU HD12 H 1 0.642 0.030 . 1 . . . . 12 LEU HD1 . 11192 1 85 . 1 1 12 12 LEU HD13 H 1 0.642 0.030 . 1 . . . . 12 LEU HD1 . 11192 1 86 . 1 1 12 12 LEU HD21 H 1 0.691 0.030 . 1 . . . . 12 LEU HD2 . 11192 1 87 . 1 1 12 12 LEU HD22 H 1 0.691 0.030 . 1 . . . . 12 LEU HD2 . 11192 1 88 . 1 1 12 12 LEU HD23 H 1 0.691 0.030 . 1 . . . . 12 LEU HD2 . 11192 1 89 . 1 1 12 12 LEU HG H 1 1.298 0.030 . 1 . . . . 12 LEU HG . 11192 1 90 . 1 1 12 12 LEU C C 13 177.535 0.300 . 1 . . . . 12 LEU C . 11192 1 91 . 1 1 12 12 LEU CA C 13 55.857 0.300 . 1 . . . . 12 LEU CA . 11192 1 92 . 1 1 12 12 LEU CB C 13 41.367 0.300 . 1 . . . . 12 LEU CB . 11192 1 93 . 1 1 12 12 LEU CD1 C 13 25.007 0.300 . 2 . . . . 12 LEU CD1 . 11192 1 94 . 1 1 12 12 LEU CD2 C 13 22.347 0.300 . 2 . . . . 12 LEU CD2 . 11192 1 95 . 1 1 12 12 LEU CG C 13 27.483 0.300 . 1 . . . . 12 LEU CG . 11192 1 96 . 1 1 12 12 LEU N N 15 129.943 0.300 . 1 . . . . 12 LEU N . 11192 1 97 . 1 1 13 13 GLN H H 1 7.921 0.030 . 1 . . . . 13 GLN H . 11192 1 98 . 1 1 13 13 GLN HA H 1 4.555 0.030 . 1 . . . . 13 GLN HA . 11192 1 99 . 1 1 13 13 GLN HB2 H 1 2.052 0.030 . 2 . . . . 13 GLN HB2 . 11192 1 100 . 1 1 13 13 GLN HB3 H 1 2.118 0.030 . 2 . . . . 13 GLN HB3 . 11192 1 101 . 1 1 13 13 GLN HE21 H 1 6.932 0.030 . 2 . . . . 13 GLN HE21 . 11192 1 102 . 1 1 13 13 GLN HE22 H 1 8.136 0.030 . 2 . . . . 13 GLN HE22 . 11192 1 103 . 1 1 13 13 GLN HG2 H 1 2.557 0.030 . 2 . . . . 13 GLN HG2 . 11192 1 104 . 1 1 13 13 GLN HG3 H 1 2.422 0.030 . 2 . . . . 13 GLN HG3 . 11192 1 105 . 1 1 13 13 GLN C C 13 173.533 0.300 . 1 . . . . 13 GLN C . 11192 1 106 . 1 1 13 13 GLN CA C 13 56.285 0.300 . 1 . . . . 13 GLN CA . 11192 1 107 . 1 1 13 13 GLN CB C 13 32.096 0.300 . 1 . . . . 13 GLN CB . 11192 1 108 . 1 1 13 13 GLN CG C 13 33.920 0.300 . 1 . . . . 13 GLN CG . 11192 1 109 . 1 1 13 13 GLN N N 15 117.581 0.300 . 1 . . . . 13 GLN N . 11192 1 110 . 1 1 13 13 GLN NE2 N 15 113.234 0.300 . 1 . . . . 13 GLN NE2 . 11192 1 111 . 1 1 14 14 ASP H H 1 8.714 0.030 . 1 . . . . 14 ASP H . 11192 1 112 . 1 1 14 14 ASP HA H 1 4.632 0.030 . 1 . . . . 14 ASP HA . 11192 1 113 . 1 1 14 14 ASP HB2 H 1 2.593 0.030 . 2 . . . . 14 ASP HB2 . 11192 1 114 . 1 1 14 14 ASP HB3 H 1 2.833 0.030 . 2 . . . . 14 ASP HB3 . 11192 1 115 . 1 1 14 14 ASP C C 13 176.605 0.300 . 1 . . . . 14 ASP C . 11192 1 116 . 1 1 14 14 ASP CA C 13 52.281 0.300 . 1 . . . . 14 ASP CA . 11192 1 117 . 1 1 14 14 ASP CB C 13 41.709 0.300 . 1 . . . . 14 ASP CB . 11192 1 118 . 1 1 14 14 ASP N N 15 126.268 0.300 . 1 . . . . 14 ASP N . 11192 1 119 . 1 1 15 15 ILE H H 1 9.103 0.030 . 1 . . . . 15 ILE H . 11192 1 120 . 1 1 15 15 ILE HA H 1 4.704 0.030 . 1 . . . . 15 ILE HA . 11192 1 121 . 1 1 15 15 ILE HB H 1 1.885 0.030 . 1 . . . . 15 ILE HB . 11192 1 122 . 1 1 15 15 ILE HD11 H 1 0.731 0.030 . 1 . . . . 15 ILE HD1 . 11192 1 123 . 1 1 15 15 ILE HD12 H 1 0.731 0.030 . 1 . . . . 15 ILE HD1 . 11192 1 124 . 1 1 15 15 ILE HD13 H 1 0.731 0.030 . 1 . . . . 15 ILE HD1 . 11192 1 125 . 1 1 15 15 ILE HG12 H 1 1.082 0.030 . 2 . . . . 15 ILE HG12 . 11192 1 126 . 1 1 15 15 ILE HG13 H 1 1.542 0.030 . 2 . . . . 15 ILE HG13 . 11192 1 127 . 1 1 15 15 ILE HG21 H 1 1.098 0.030 . 1 . . . . 15 ILE HG2 . 11192 1 128 . 1 1 15 15 ILE HG22 H 1 1.098 0.030 . 1 . . . . 15 ILE HG2 . 11192 1 129 . 1 1 15 15 ILE HG23 H 1 1.098 0.030 . 1 . . . . 15 ILE HG2 . 11192 1 130 . 1 1 15 15 ILE C C 13 174.463 0.300 . 1 . . . . 15 ILE C . 11192 1 131 . 1 1 15 15 ILE CA C 13 61.466 0.300 . 1 . . . . 15 ILE CA . 11192 1 132 . 1 1 15 15 ILE CB C 13 39.781 0.300 . 1 . . . . 15 ILE CB . 11192 1 133 . 1 1 15 15 ILE CD1 C 13 14.130 0.300 . 1 . . . . 15 ILE CD1 . 11192 1 134 . 1 1 15 15 ILE CG1 C 13 26.421 0.300 . 1 . . . . 15 ILE CG1 . 11192 1 135 . 1 1 15 15 ILE CG2 C 13 19.677 0.300 . 1 . . . . 15 ILE CG2 . 11192 1 136 . 1 1 15 15 ILE N N 15 117.012 0.300 . 1 . . . . 15 ILE N . 11192 1 137 . 1 1 16 16 ALA H H 1 8.182 0.030 . 1 . . . . 16 ALA H . 11192 1 138 . 1 1 16 16 ALA HA H 1 4.908 0.030 . 1 . . . . 16 ALA HA . 11192 1 139 . 1 1 16 16 ALA HB1 H 1 1.509 0.030 . 1 . . . . 16 ALA HB . 11192 1 140 . 1 1 16 16 ALA HB2 H 1 1.509 0.030 . 1 . . . . 16 ALA HB . 11192 1 141 . 1 1 16 16 ALA HB3 H 1 1.509 0.030 . 1 . . . . 16 ALA HB . 11192 1 142 . 1 1 16 16 ALA C C 13 176.201 0.300 . 1 . . . . 16 ALA C . 11192 1 143 . 1 1 16 16 ALA CA C 13 50.704 0.300 . 1 . . . . 16 ALA CA . 11192 1 144 . 1 1 16 16 ALA CB C 13 22.251 0.300 . 1 . . . . 16 ALA CB . 11192 1 145 . 1 1 16 16 ALA N N 15 125.551 0.300 . 1 . . . . 16 ALA N . 11192 1 146 . 1 1 17 17 ASP H H 1 8.304 0.030 . 1 . . . . 17 ASP H . 11192 1 147 . 1 1 17 17 ASP HA H 1 5.108 0.030 . 1 . . . . 17 ASP HA . 11192 1 148 . 1 1 17 17 ASP HB2 H 1 2.797 0.030 . 2 . . . . 17 ASP HB2 . 11192 1 149 . 1 1 17 17 ASP HB3 H 1 2.629 0.030 . 2 . . . . 17 ASP HB3 . 11192 1 150 . 1 1 17 17 ASP C C 13 175.920 0.300 . 1 . . . . 17 ASP C . 11192 1 151 . 1 1 17 17 ASP CA C 13 55.009 0.300 . 1 . . . . 17 ASP CA . 11192 1 152 . 1 1 17 17 ASP CB C 13 41.554 0.300 . 1 . . . . 17 ASP CB . 11192 1 153 . 1 1 17 17 ASP N N 15 119.694 0.300 . 1 . . . . 17 ASP N . 11192 1 154 . 1 1 18 18 LEU H H 1 9.016 0.030 . 1 . . . . 18 LEU H . 11192 1 155 . 1 1 18 18 LEU HA H 1 4.844 0.030 . 1 . . . . 18 LEU HA . 11192 1 156 . 1 1 18 18 LEU HB2 H 1 1.516 0.030 . 2 . . . . 18 LEU HB2 . 11192 1 157 . 1 1 18 18 LEU HB3 H 1 1.376 0.030 . 2 . . . . 18 LEU HB3 . 11192 1 158 . 1 1 18 18 LEU HD11 H 1 0.702 0.030 . 1 . . . . 18 LEU HD1 . 11192 1 159 . 1 1 18 18 LEU HD12 H 1 0.702 0.030 . 1 . . . . 18 LEU HD1 . 11192 1 160 . 1 1 18 18 LEU HD13 H 1 0.702 0.030 . 1 . . . . 18 LEU HD1 . 11192 1 161 . 1 1 18 18 LEU HD21 H 1 0.255 0.030 . 1 . . . . 18 LEU HD2 . 11192 1 162 . 1 1 18 18 LEU HD22 H 1 0.255 0.030 . 1 . . . . 18 LEU HD2 . 11192 1 163 . 1 1 18 18 LEU HD23 H 1 0.255 0.030 . 1 . . . . 18 LEU HD2 . 11192 1 164 . 1 1 18 18 LEU HG H 1 1.508 0.030 . 1 . . . . 18 LEU HG . 11192 1 165 . 1 1 18 18 LEU C C 13 175.955 0.300 . 1 . . . . 18 LEU C . 11192 1 166 . 1 1 18 18 LEU CA C 13 53.682 0.300 . 1 . . . . 18 LEU CA . 11192 1 167 . 1 1 18 18 LEU CB C 13 47.319 0.300 . 1 . . . . 18 LEU CB . 11192 1 168 . 1 1 18 18 LEU CD1 C 13 23.976 0.300 . 2 . . . . 18 LEU CD1 . 11192 1 169 . 1 1 18 18 LEU CD2 C 13 25.104 0.300 . 2 . . . . 18 LEU CD2 . 11192 1 170 . 1 1 18 18 LEU CG C 13 26.195 0.300 . 1 . . . . 18 LEU CG . 11192 1 171 . 1 1 18 18 LEU N N 15 120.859 0.300 . 1 . . . . 18 LEU N . 11192 1 172 . 1 1 19 19 THR H H 1 8.574 0.030 . 1 . . . . 19 THR H . 11192 1 173 . 1 1 19 19 THR HA H 1 5.260 0.030 . 1 . . . . 19 THR HA . 11192 1 174 . 1 1 19 19 THR HB H 1 3.961 0.030 . 1 . . . . 19 THR HB . 11192 1 175 . 1 1 19 19 THR HG21 H 1 1.069 0.030 . 1 . . . . 19 THR HG2 . 11192 1 176 . 1 1 19 19 THR HG22 H 1 1.069 0.030 . 1 . . . . 19 THR HG2 . 11192 1 177 . 1 1 19 19 THR HG23 H 1 1.069 0.030 . 1 . . . . 19 THR HG2 . 11192 1 178 . 1 1 19 19 THR C C 13 173.919 0.300 . 1 . . . . 19 THR C . 11192 1 179 . 1 1 19 19 THR CA C 13 61.740 0.300 . 1 . . . . 19 THR CA . 11192 1 180 . 1 1 19 19 THR CB C 13 69.915 0.300 . 1 . . . . 19 THR CB . 11192 1 181 . 1 1 19 19 THR CG2 C 13 21.719 0.300 . 1 . . . . 19 THR CG2 . 11192 1 182 . 1 1 19 19 THR N N 15 120.425 0.300 . 1 . . . . 19 THR N . 11192 1 183 . 1 1 20 20 VAL H H 1 8.582 0.030 . 1 . . . . 20 VAL H . 11192 1 184 . 1 1 20 20 VAL HA H 1 4.546 0.030 . 1 . . . . 20 VAL HA . 11192 1 185 . 1 1 20 20 VAL HB H 1 2.051 0.030 . 1 . . . . 20 VAL HB . 11192 1 186 . 1 1 20 20 VAL HG11 H 1 0.892 0.030 . 1 . . . . 20 VAL HG1 . 11192 1 187 . 1 1 20 20 VAL HG12 H 1 0.892 0.030 . 1 . . . . 20 VAL HG1 . 11192 1 188 . 1 1 20 20 VAL HG13 H 1 0.892 0.030 . 1 . . . . 20 VAL HG1 . 11192 1 189 . 1 1 20 20 VAL HG21 H 1 0.755 0.030 . 1 . . . . 20 VAL HG2 . 11192 1 190 . 1 1 20 20 VAL HG22 H 1 0.755 0.030 . 1 . . . . 20 VAL HG2 . 11192 1 191 . 1 1 20 20 VAL HG23 H 1 0.755 0.030 . 1 . . . . 20 VAL HG2 . 11192 1 192 . 1 1 20 20 VAL C C 13 172.673 0.300 . 1 . . . . 20 VAL C . 11192 1 193 . 1 1 20 20 VAL CA C 13 59.271 0.300 . 1 . . . . 20 VAL CA . 11192 1 194 . 1 1 20 20 VAL CB C 13 35.571 0.300 . 1 . . . . 20 VAL CB . 11192 1 195 . 1 1 20 20 VAL CG1 C 13 22.230 0.300 . 2 . . . . 20 VAL CG1 . 11192 1 196 . 1 1 20 20 VAL CG2 C 13 20.842 0.300 . 2 . . . . 20 VAL CG2 . 11192 1 197 . 1 1 20 20 VAL N N 15 122.582 0.300 . 1 . . . . 20 VAL N . 11192 1 198 . 1 1 21 21 LYS H H 1 8.125 0.030 . 1 . . . . 21 LYS H . 11192 1 199 . 1 1 21 21 LYS HA H 1 4.309 0.030 . 1 . . . . 21 LYS HA . 11192 1 200 . 1 1 21 21 LYS HB2 H 1 1.470 0.030 . 2 . . . . 21 LYS HB2 . 11192 1 201 . 1 1 21 21 LYS HB3 H 1 1.718 0.030 . 2 . . . . 21 LYS HB3 . 11192 1 202 . 1 1 21 21 LYS HD2 H 1 1.595 0.030 . 1 . . . . 21 LYS HD2 . 11192 1 203 . 1 1 21 21 LYS HD3 H 1 1.595 0.030 . 1 . . . . 21 LYS HD3 . 11192 1 204 . 1 1 21 21 LYS HE2 H 1 2.903 0.030 . 1 . . . . 21 LYS HE2 . 11192 1 205 . 1 1 21 21 LYS HE3 H 1 2.903 0.030 . 1 . . . . 21 LYS HE3 . 11192 1 206 . 1 1 21 21 LYS HG2 H 1 1.328 0.030 . 1 . . . . 21 LYS HG2 . 11192 1 207 . 1 1 21 21 LYS HG3 H 1 1.328 0.030 . 1 . . . . 21 LYS HG3 . 11192 1 208 . 1 1 21 21 LYS C C 13 174.797 0.300 . 1 . . . . 21 LYS C . 11192 1 209 . 1 1 21 21 LYS CA C 13 53.822 0.300 . 1 . . . . 21 LYS CA . 11192 1 210 . 1 1 21 21 LYS CB C 13 34.584 0.300 . 1 . . . . 21 LYS CB . 11192 1 211 . 1 1 21 21 LYS CD C 13 29.249 0.300 . 1 . . . . 21 LYS CD . 11192 1 212 . 1 1 21 21 LYS CE C 13 41.650 0.300 . 1 . . . . 21 LYS CE . 11192 1 213 . 1 1 21 21 LYS CG C 13 24.682 0.300 . 1 . . . . 21 LYS CG . 11192 1 214 . 1 1 21 21 LYS N N 15 121.304 0.300 . 1 . . . . 21 LYS N . 11192 1 215 . 1 1 22 22 ALA H H 1 7.837 0.030 . 1 . . . . 22 ALA H . 11192 1 216 . 1 1 22 22 ALA HA H 1 4.063 0.030 . 1 . . . . 22 ALA HA . 11192 1 217 . 1 1 22 22 ALA HB1 H 1 1.529 0.030 . 1 . . . . 22 ALA HB . 11192 1 218 . 1 1 22 22 ALA HB2 H 1 1.529 0.030 . 1 . . . . 22 ALA HB . 11192 1 219 . 1 1 22 22 ALA HB3 H 1 1.529 0.030 . 1 . . . . 22 ALA HB . 11192 1 220 . 1 1 22 22 ALA C C 13 177.886 0.300 . 1 . . . . 22 ALA C . 11192 1 221 . 1 1 22 22 ALA CA C 13 53.457 0.300 . 1 . . . . 22 ALA CA . 11192 1 222 . 1 1 22 22 ALA CB C 13 18.647 0.300 . 1 . . . . 22 ALA CB . 11192 1 223 . 1 1 22 22 ALA N N 15 119.151 0.300 . 1 . . . . 22 ALA N . 11192 1 224 . 1 1 23 23 ALA H H 1 9.266 0.030 . 1 . . . . 23 ALA H . 11192 1 225 . 1 1 23 23 ALA HA H 1 4.269 0.030 . 1 . . . . 23 ALA HA . 11192 1 226 . 1 1 23 23 ALA HB1 H 1 1.637 0.030 . 1 . . . . 23 ALA HB . 11192 1 227 . 1 1 23 23 ALA HB2 H 1 1.637 0.030 . 1 . . . . 23 ALA HB . 11192 1 228 . 1 1 23 23 ALA HB3 H 1 1.637 0.030 . 1 . . . . 23 ALA HB . 11192 1 229 . 1 1 23 23 ALA C C 13 177.254 0.300 . 1 . . . . 23 ALA C . 11192 1 230 . 1 1 23 23 ALA CA C 13 54.047 0.300 . 1 . . . . 23 ALA CA . 11192 1 231 . 1 1 23 23 ALA CB C 13 17.479 0.300 . 1 . . . . 23 ALA CB . 11192 1 232 . 1 1 23 23 ALA N N 15 118.312 0.300 . 1 . . . . 23 ALA N . 11192 1 233 . 1 1 24 24 GLU H H 1 7.693 0.030 . 1 . . . . 24 GLU H . 11192 1 234 . 1 1 24 24 GLU HA H 1 4.401 0.030 . 1 . . . . 24 GLU HA . 11192 1 235 . 1 1 24 24 GLU HB2 H 1 2.180 0.030 . 2 . . . . 24 GLU HB2 . 11192 1 236 . 1 1 24 24 GLU HB3 H 1 2.108 0.030 . 2 . . . . 24 GLU HB3 . 11192 1 237 . 1 1 24 24 GLU HG2 H 1 2.158 0.030 . 2 . . . . 24 GLU HG2 . 11192 1 238 . 1 1 24 24 GLU HG3 H 1 2.274 0.030 . 2 . . . . 24 GLU HG3 . 11192 1 239 . 1 1 24 24 GLU C C 13 172.708 0.300 . 1 . . . . 24 GLU C . 11192 1 240 . 1 1 24 24 GLU CA C 13 56.303 0.300 . 1 . . . . 24 GLU CA . 11192 1 241 . 1 1 24 24 GLU CB C 13 30.361 0.300 . 1 . . . . 24 GLU CB . 11192 1 242 . 1 1 24 24 GLU CG C 13 37.951 0.300 . 1 . . . . 24 GLU CG . 11192 1 243 . 1 1 24 24 GLU N N 15 119.886 0.300 . 1 . . . . 24 GLU N . 11192 1 244 . 1 1 25 25 GLN H H 1 7.915 0.030 . 1 . . . . 25 GLN H . 11192 1 245 . 1 1 25 25 GLN HA H 1 5.134 0.030 . 1 . . . . 25 GLN HA . 11192 1 246 . 1 1 25 25 GLN HB2 H 1 1.901 0.030 . 2 . . . . 25 GLN HB2 . 11192 1 247 . 1 1 25 25 GLN HB3 H 1 1.977 0.030 . 2 . . . . 25 GLN HB3 . 11192 1 248 . 1 1 25 25 GLN HE21 H 1 6.571 0.030 . 2 . . . . 25 GLN HE21 . 11192 1 249 . 1 1 25 25 GLN HE22 H 1 8.346 0.030 . 2 . . . . 25 GLN HE22 . 11192 1 250 . 1 1 25 25 GLN HG2 H 1 2.266 0.030 . 2 . . . . 25 GLN HG2 . 11192 1 251 . 1 1 25 25 GLN HG3 H 1 1.691 0.030 . 2 . . . . 25 GLN HG3 . 11192 1 252 . 1 1 25 25 GLN C C 13 175.042 0.300 . 1 . . . . 25 GLN C . 11192 1 253 . 1 1 25 25 GLN CA C 13 54.466 0.300 . 1 . . . . 25 GLN CA . 11192 1 254 . 1 1 25 25 GLN CB C 13 32.471 0.300 . 1 . . . . 25 GLN CB . 11192 1 255 . 1 1 25 25 GLN CG C 13 35.534 0.300 . 1 . . . . 25 GLN CG . 11192 1 256 . 1 1 25 25 GLN N N 15 117.043 0.300 . 1 . . . . 25 GLN N . 11192 1 257 . 1 1 25 25 GLN NE2 N 15 114.537 0.300 . 1 . . . . 25 GLN NE2 . 11192 1 258 . 1 1 26 26 ALA H H 1 9.119 0.030 . 1 . . . . 26 ALA H . 11192 1 259 . 1 1 26 26 ALA HA H 1 4.430 0.030 . 1 . . . . 26 ALA HA . 11192 1 260 . 1 1 26 26 ALA HB1 H 1 1.010 0.030 . 1 . . . . 26 ALA HB . 11192 1 261 . 1 1 26 26 ALA HB2 H 1 1.010 0.030 . 1 . . . . 26 ALA HB . 11192 1 262 . 1 1 26 26 ALA HB3 H 1 1.010 0.030 . 1 . . . . 26 ALA HB . 11192 1 263 . 1 1 26 26 ALA C C 13 174.288 0.300 . 1 . . . . 26 ALA C . 11192 1 264 . 1 1 26 26 ALA CA C 13 50.085 0.300 . 1 . . . . 26 ALA CA . 11192 1 265 . 1 1 26 26 ALA CB C 13 22.160 0.300 . 1 . . . . 26 ALA CB . 11192 1 266 . 1 1 26 26 ALA N N 15 129.168 0.300 . 1 . . . . 26 ALA N . 11192 1 267 . 1 1 27 27 VAL H H 1 7.267 0.030 . 1 . . . . 27 VAL H . 11192 1 268 . 1 1 27 27 VAL HA H 1 4.579 0.030 . 1 . . . . 27 VAL HA . 11192 1 269 . 1 1 27 27 VAL HB H 1 1.793 0.030 . 1 . . . . 27 VAL HB . 11192 1 270 . 1 1 27 27 VAL HG11 H 1 0.681 0.030 . 1 . . . . 27 VAL HG1 . 11192 1 271 . 1 1 27 27 VAL HG12 H 1 0.681 0.030 . 1 . . . . 27 VAL HG1 . 11192 1 272 . 1 1 27 27 VAL HG13 H 1 0.681 0.030 . 1 . . . . 27 VAL HG1 . 11192 1 273 . 1 1 27 27 VAL HG21 H 1 0.766 0.030 . 1 . . . . 27 VAL HG2 . 11192 1 274 . 1 1 27 27 VAL HG22 H 1 0.766 0.030 . 1 . . . . 27 VAL HG2 . 11192 1 275 . 1 1 27 27 VAL HG23 H 1 0.766 0.030 . 1 . . . . 27 VAL HG2 . 11192 1 276 . 1 1 27 27 VAL C C 13 174.463 0.300 . 1 . . . . 27 VAL C . 11192 1 277 . 1 1 27 27 VAL CA C 13 60.901 0.300 . 1 . . . . 27 VAL CA . 11192 1 278 . 1 1 27 27 VAL CB C 13 33.979 0.300 . 1 . . . . 27 VAL CB . 11192 1 279 . 1 1 27 27 VAL CG1 C 13 20.820 0.300 . 2 . . . . 27 VAL CG1 . 11192 1 280 . 1 1 27 27 VAL CG2 C 13 21.337 0.300 . 2 . . . . 27 VAL CG2 . 11192 1 281 . 1 1 27 27 VAL N N 15 120.668 0.300 . 1 . . . . 27 VAL N . 11192 1 282 . 1 1 28 28 PHE H H 1 9.023 0.030 . 1 . . . . 28 PHE H . 11192 1 283 . 1 1 28 28 PHE HA H 1 4.897 0.030 . 1 . . . . 28 PHE HA . 11192 1 284 . 1 1 28 28 PHE HB2 H 1 2.716 0.030 . 2 . . . . 28 PHE HB2 . 11192 1 285 . 1 1 28 28 PHE HB3 H 1 3.013 0.030 . 2 . . . . 28 PHE HB3 . 11192 1 286 . 1 1 28 28 PHE HD1 H 1 6.882 0.030 . 1 . . . . 28 PHE HD1 . 11192 1 287 . 1 1 28 28 PHE HD2 H 1 6.882 0.030 . 1 . . . . 28 PHE HD2 . 11192 1 288 . 1 1 28 28 PHE HE1 H 1 6.678 0.030 . 1 . . . . 28 PHE HE1 . 11192 1 289 . 1 1 28 28 PHE HE2 H 1 6.678 0.030 . 1 . . . . 28 PHE HE2 . 11192 1 290 . 1 1 28 28 PHE HZ H 1 6.750 0.030 . 1 . . . . 28 PHE HZ . 11192 1 291 . 1 1 28 28 PHE C C 13 173.849 0.300 . 1 . . . . 28 PHE C . 11192 1 292 . 1 1 28 28 PHE CA C 13 56.583 0.300 . 1 . . . . 28 PHE CA . 11192 1 293 . 1 1 28 28 PHE CB C 13 41.705 0.300 . 1 . . . . 28 PHE CB . 11192 1 294 . 1 1 28 28 PHE CD1 C 13 130.849 0.300 . 1 . . . . 28 PHE CD1 . 11192 1 295 . 1 1 28 28 PHE CD2 C 13 130.849 0.300 . 1 . . . . 28 PHE CD2 . 11192 1 296 . 1 1 28 28 PHE CE1 C 13 130.830 0.300 . 1 . . . . 28 PHE CE1 . 11192 1 297 . 1 1 28 28 PHE CE2 C 13 130.830 0.300 . 1 . . . . 28 PHE CE2 . 11192 1 298 . 1 1 28 28 PHE CZ C 13 128.747 0.300 . 1 . . . . 28 PHE CZ . 11192 1 299 . 1 1 28 28 PHE N N 15 126.553 0.300 . 1 . . . . 28 PHE N . 11192 1 300 . 1 1 29 29 LYS H H 1 8.912 0.030 . 1 . . . . 29 LYS H . 11192 1 301 . 1 1 29 29 LYS HA H 1 5.590 0.030 . 1 . . . . 29 LYS HA . 11192 1 302 . 1 1 29 29 LYS HB2 H 1 1.573 0.030 . 2 . . . . 29 LYS HB2 . 11192 1 303 . 1 1 29 29 LYS HB3 H 1 1.767 0.030 . 2 . . . . 29 LYS HB3 . 11192 1 304 . 1 1 29 29 LYS HD2 H 1 1.481 0.030 . 1 . . . . 29 LYS HD2 . 11192 1 305 . 1 1 29 29 LYS HD3 H 1 1.481 0.030 . 1 . . . . 29 LYS HD3 . 11192 1 306 . 1 1 29 29 LYS HE2 H 1 2.728 0.030 . 2 . . . . 29 LYS HE2 . 11192 1 307 . 1 1 29 29 LYS HE3 H 1 2.805 0.030 . 2 . . . . 29 LYS HE3 . 11192 1 308 . 1 1 29 29 LYS HG2 H 1 1.287 0.030 . 2 . . . . 29 LYS HG2 . 11192 1 309 . 1 1 29 29 LYS HG3 H 1 1.371 0.030 . 2 . . . . 29 LYS HG3 . 11192 1 310 . 1 1 29 29 LYS C C 13 173.287 0.300 . 1 . . . . 29 LYS C . 11192 1 311 . 1 1 29 29 LYS CA C 13 54.635 0.300 . 1 . . . . 29 LYS CA . 11192 1 312 . 1 1 29 29 LYS CB C 13 36.280 0.300 . 1 . . . . 29 LYS CB . 11192 1 313 . 1 1 29 29 LYS CD C 13 29.665 0.300 . 1 . . . . 29 LYS CD . 11192 1 314 . 1 1 29 29 LYS CE C 13 41.648 0.300 . 1 . . . . 29 LYS CE . 11192 1 315 . 1 1 29 29 LYS CG C 13 24.294 0.300 . 1 . . . . 29 LYS CG . 11192 1 316 . 1 1 29 29 LYS N N 15 121.918 0.300 . 1 . . . . 29 LYS N . 11192 1 317 . 1 1 30 30 CYS H H 1 9.149 0.030 . 1 . . . . 30 CYS H . 11192 1 318 . 1 1 30 30 CYS HA H 1 4.974 0.030 . 1 . . . . 30 CYS HA . 11192 1 319 . 1 1 30 30 CYS HB2 H 1 2.910 0.030 . 2 . . . . 30 CYS HB2 . 11192 1 320 . 1 1 30 30 CYS HB3 H 1 2.875 0.030 . 2 . . . . 30 CYS HB3 . 11192 1 321 . 1 1 30 30 CYS C C 13 171.514 0.300 . 1 . . . . 30 CYS C . 11192 1 322 . 1 1 30 30 CYS CA C 13 54.746 0.300 . 1 . . . . 30 CYS CA . 11192 1 323 . 1 1 30 30 CYS CB C 13 31.747 0.300 . 1 . . . . 30 CYS CB . 11192 1 324 . 1 1 30 30 CYS N N 15 117.893 0.300 . 1 . . . . 30 CYS N . 11192 1 325 . 1 1 31 31 GLU H H 1 8.732 0.030 . 1 . . . . 31 GLU H . 11192 1 326 . 1 1 31 31 GLU HA H 1 5.047 0.030 . 1 . . . . 31 GLU HA . 11192 1 327 . 1 1 31 31 GLU HB2 H 1 1.438 0.030 . 2 . . . . 31 GLU HB2 . 11192 1 328 . 1 1 31 31 GLU HB3 H 1 1.886 0.030 . 2 . . . . 31 GLU HB3 . 11192 1 329 . 1 1 31 31 GLU HG2 H 1 1.660 0.030 . 2 . . . . 31 GLU HG2 . 11192 1 330 . 1 1 31 31 GLU HG3 H 1 1.138 0.030 . 2 . . . . 31 GLU HG3 . 11192 1 331 . 1 1 31 31 GLU C C 13 176.201 0.300 . 1 . . . . 31 GLU C . 11192 1 332 . 1 1 31 31 GLU CA C 13 54.170 0.300 . 1 . . . . 31 GLU CA . 11192 1 333 . 1 1 31 31 GLU CB C 13 33.974 0.300 . 1 . . . . 31 GLU CB . 11192 1 334 . 1 1 31 31 GLU CG C 13 36.392 0.300 . 1 . . . . 31 GLU CG . 11192 1 335 . 1 1 31 31 GLU N N 15 122.211 0.300 . 1 . . . . 31 GLU N . 11192 1 336 . 1 1 32 32 VAL H H 1 8.836 0.030 . 1 . . . . 32 VAL H . 11192 1 337 . 1 1 32 32 VAL HA H 1 5.211 0.030 . 1 . . . . 32 VAL HA . 11192 1 338 . 1 1 32 32 VAL HB H 1 2.208 0.030 . 1 . . . . 32 VAL HB . 11192 1 339 . 1 1 32 32 VAL HG11 H 1 0.820 0.030 . 1 . . . . 32 VAL HG1 . 11192 1 340 . 1 1 32 32 VAL HG12 H 1 0.820 0.030 . 1 . . . . 32 VAL HG1 . 11192 1 341 . 1 1 32 32 VAL HG13 H 1 0.820 0.030 . 1 . . . . 32 VAL HG1 . 11192 1 342 . 1 1 32 32 VAL HG21 H 1 0.948 0.030 . 1 . . . . 32 VAL HG2 . 11192 1 343 . 1 1 32 32 VAL HG22 H 1 0.948 0.030 . 1 . . . . 32 VAL HG2 . 11192 1 344 . 1 1 32 32 VAL HG23 H 1 0.948 0.030 . 1 . . . . 32 VAL HG2 . 11192 1 345 . 1 1 32 32 VAL C C 13 175.446 0.300 . 1 . . . . 32 VAL C . 11192 1 346 . 1 1 32 32 VAL CA C 13 58.915 0.300 . 1 . . . . 32 VAL CA . 11192 1 347 . 1 1 32 32 VAL CB C 13 34.146 0.300 . 1 . . . . 32 VAL CB . 11192 1 348 . 1 1 32 32 VAL CG1 C 13 20.963 0.300 . 2 . . . . 32 VAL CG1 . 11192 1 349 . 1 1 32 32 VAL CG2 C 13 18.566 0.300 . 2 . . . . 32 VAL CG2 . 11192 1 350 . 1 1 32 32 VAL N N 15 120.015 0.300 . 1 . . . . 32 VAL N . 11192 1 351 . 1 1 33 33 SER H H 1 8.205 0.030 . 1 . . . . 33 SER H . 11192 1 352 . 1 1 33 33 SER HA H 1 3.970 0.030 . 1 . . . . 33 SER HA . 11192 1 353 . 1 1 33 33 SER HB2 H 1 4.209 0.030 . 2 . . . . 33 SER HB2 . 11192 1 354 . 1 1 33 33 SER HB3 H 1 3.738 0.030 . 2 . . . . 33 SER HB3 . 11192 1 355 . 1 1 33 33 SER C C 13 173.305 0.300 . 1 . . . . 33 SER C . 11192 1 356 . 1 1 33 33 SER CA C 13 60.835 0.300 . 1 . . . . 33 SER CA . 11192 1 357 . 1 1 33 33 SER CB C 13 62.913 0.300 . 1 . . . . 33 SER CB . 11192 1 358 . 1 1 33 33 SER N N 15 110.253 0.300 . 1 . . . . 33 SER N . 11192 1 359 . 1 1 34 34 ASP H H 1 6.526 0.030 . 1 . . . . 34 ASP H . 11192 1 360 . 1 1 34 34 ASP HA H 1 4.924 0.030 . 1 . . . . 34 ASP HA . 11192 1 361 . 1 1 34 34 ASP HB2 H 1 2.528 0.030 . 2 . . . . 34 ASP HB2 . 11192 1 362 . 1 1 34 34 ASP HB3 H 1 2.720 0.030 . 2 . . . . 34 ASP HB3 . 11192 1 363 . 1 1 34 34 ASP C C 13 176.201 0.300 . 1 . . . . 34 ASP C . 11192 1 364 . 1 1 34 34 ASP CA C 13 52.615 0.300 . 1 . . . . 34 ASP CA . 11192 1 365 . 1 1 34 34 ASP CB C 13 43.334 0.300 . 1 . . . . 34 ASP CB . 11192 1 366 . 1 1 34 34 ASP N N 15 119.041 0.300 . 1 . . . . 34 ASP N . 11192 1 367 . 1 1 35 35 GLU H H 1 9.438 0.030 . 1 . . . . 35 GLU H . 11192 1 368 . 1 1 35 35 GLU HA H 1 4.090 0.030 . 1 . . . . 35 GLU HA . 11192 1 369 . 1 1 35 35 GLU HB2 H 1 2.011 0.030 . 1 . . . . 35 GLU HB2 . 11192 1 370 . 1 1 35 35 GLU HB3 H 1 2.011 0.030 . 1 . . . . 35 GLU HB3 . 11192 1 371 . 1 1 35 35 GLU HG2 H 1 2.262 0.030 . 1 . . . . 35 GLU HG2 . 11192 1 372 . 1 1 35 35 GLU HG3 H 1 2.262 0.030 . 1 . . . . 35 GLU HG3 . 11192 1 373 . 1 1 35 35 GLU C C 13 176.043 0.300 . 1 . . . . 35 GLU C . 11192 1 374 . 1 1 35 35 GLU CA C 13 58.143 0.300 . 1 . . . . 35 GLU CA . 11192 1 375 . 1 1 35 35 GLU CB C 13 29.199 0.300 . 1 . . . . 35 GLU CB . 11192 1 376 . 1 1 35 35 GLU CG C 13 35.696 0.300 . 1 . . . . 35 GLU CG . 11192 1 377 . 1 1 35 35 GLU N N 15 125.730 0.300 . 1 . . . . 35 GLU N . 11192 1 378 . 1 1 36 36 LYS H H 1 8.791 0.030 . 1 . . . . 36 LYS H . 11192 1 379 . 1 1 36 36 LYS HA H 1 4.358 0.030 . 1 . . . . 36 LYS HA . 11192 1 380 . 1 1 36 36 LYS HB2 H 1 1.965 0.030 . 1 . . . . 36 LYS HB2 . 11192 1 381 . 1 1 36 36 LYS HB3 H 1 1.965 0.030 . 1 . . . . 36 LYS HB3 . 11192 1 382 . 1 1 36 36 LYS HD2 H 1 1.764 0.030 . 1 . . . . 36 LYS HD2 . 11192 1 383 . 1 1 36 36 LYS HD3 H 1 1.764 0.030 . 1 . . . . 36 LYS HD3 . 11192 1 384 . 1 1 36 36 LYS HE2 H 1 3.081 0.030 . 1 . . . . 36 LYS HE2 . 11192 1 385 . 1 1 36 36 LYS HE3 H 1 3.081 0.030 . 1 . . . . 36 LYS HE3 . 11192 1 386 . 1 1 36 36 LYS HG2 H 1 1.521 0.030 . 1 . . . . 36 LYS HG2 . 11192 1 387 . 1 1 36 36 LYS HG3 H 1 1.521 0.030 . 1 . . . . 36 LYS HG3 . 11192 1 388 . 1 1 36 36 LYS C C 13 177.272 0.300 . 1 . . . . 36 LYS C . 11192 1 389 . 1 1 36 36 LYS CA C 13 56.437 0.300 . 1 . . . . 36 LYS CA . 11192 1 390 . 1 1 36 36 LYS CB C 13 31.733 0.300 . 1 . . . . 36 LYS CB . 11192 1 391 . 1 1 36 36 LYS CD C 13 28.450 0.300 . 1 . . . . 36 LYS CD . 11192 1 392 . 1 1 36 36 LYS CE C 13 41.460 0.300 . 1 . . . . 36 LYS CE . 11192 1 393 . 1 1 36 36 LYS CG C 13 24.890 0.300 . 1 . . . . 36 LYS CG . 11192 1 394 . 1 1 36 36 LYS N N 15 118.783 0.300 . 1 . . . . 36 LYS N . 11192 1 395 . 1 1 37 37 VAL H H 1 7.041 0.030 . 1 . . . . 37 VAL H . 11192 1 396 . 1 1 37 37 VAL HA H 1 4.135 0.030 . 1 . . . . 37 VAL HA . 11192 1 397 . 1 1 37 37 VAL HB H 1 2.102 0.030 . 1 . . . . 37 VAL HB . 11192 1 398 . 1 1 37 37 VAL HG11 H 1 1.165 0.030 . 1 . . . . 37 VAL HG1 . 11192 1 399 . 1 1 37 37 VAL HG12 H 1 1.165 0.030 . 1 . . . . 37 VAL HG1 . 11192 1 400 . 1 1 37 37 VAL HG13 H 1 1.165 0.030 . 1 . . . . 37 VAL HG1 . 11192 1 401 . 1 1 37 37 VAL HG21 H 1 0.969 0.030 . 1 . . . . 37 VAL HG2 . 11192 1 402 . 1 1 37 37 VAL HG22 H 1 0.969 0.030 . 1 . . . . 37 VAL HG2 . 11192 1 403 . 1 1 37 37 VAL HG23 H 1 0.969 0.030 . 1 . . . . 37 VAL HG2 . 11192 1 404 . 1 1 37 37 VAL C C 13 174.674 0.300 . 1 . . . . 37 VAL C . 11192 1 405 . 1 1 37 37 VAL CA C 13 63.238 0.300 . 1 . . . . 37 VAL CA . 11192 1 406 . 1 1 37 37 VAL CB C 13 32.426 0.300 . 1 . . . . 37 VAL CB . 11192 1 407 . 1 1 37 37 VAL CG1 C 13 23.667 0.300 . 2 . . . . 37 VAL CG1 . 11192 1 408 . 1 1 37 37 VAL CG2 C 13 21.222 0.300 . 2 . . . . 37 VAL CG2 . 11192 1 409 . 1 1 37 37 VAL N N 15 120.472 0.300 . 1 . . . . 37 VAL N . 11192 1 410 . 1 1 38 38 THR H H 1 8.090 0.030 . 1 . . . . 38 THR H . 11192 1 411 . 1 1 38 38 THR HA H 1 4.635 0.030 . 1 . . . . 38 THR HA . 11192 1 412 . 1 1 38 38 THR HB H 1 4.561 0.030 . 1 . . . . 38 THR HB . 11192 1 413 . 1 1 38 38 THR HG21 H 1 1.389 0.030 . 1 . . . . 38 THR HG2 . 11192 1 414 . 1 1 38 38 THR HG22 H 1 1.389 0.030 . 1 . . . . 38 THR HG2 . 11192 1 415 . 1 1 38 38 THR HG23 H 1 1.389 0.030 . 1 . . . . 38 THR HG2 . 11192 1 416 . 1 1 38 38 THR C C 13 174.042 0.300 . 1 . . . . 38 THR C . 11192 1 417 . 1 1 38 38 THR CA C 13 59.436 0.300 . 1 . . . . 38 THR CA . 11192 1 418 . 1 1 38 38 THR CB C 13 71.014 0.300 . 1 . . . . 38 THR CB . 11192 1 419 . 1 1 38 38 THR CG2 C 13 21.480 0.300 . 1 . . . . 38 THR CG2 . 11192 1 420 . 1 1 38 38 THR N N 15 116.758 0.300 . 1 . . . . 38 THR N . 11192 1 421 . 1 1 39 39 GLY H H 1 8.476 0.030 . 1 . . . . 39 GLY H . 11192 1 422 . 1 1 39 39 GLY HA2 H 1 4.088 0.030 . 2 . . . . 39 GLY HA2 . 11192 1 423 . 1 1 39 39 GLY HA3 H 1 3.461 0.030 . 2 . . . . 39 GLY HA3 . 11192 1 424 . 1 1 39 39 GLY C C 13 171.181 0.300 . 1 . . . . 39 GLY C . 11192 1 425 . 1 1 39 39 GLY CA C 13 46.654 0.300 . 1 . . . . 39 GLY CA . 11192 1 426 . 1 1 39 39 GLY N N 15 105.345 0.300 . 1 . . . . 39 GLY N . 11192 1 427 . 1 1 40 40 LYS H H 1 7.143 0.030 . 1 . . . . 40 LYS H . 11192 1 428 . 1 1 40 40 LYS HA H 1 4.700 0.030 . 1 . . . . 40 LYS HA . 11192 1 429 . 1 1 40 40 LYS HB2 H 1 1.558 0.030 . 2 . . . . 40 LYS HB2 . 11192 1 430 . 1 1 40 40 LYS HB3 H 1 1.343 0.030 . 2 . . . . 40 LYS HB3 . 11192 1 431 . 1 1 40 40 LYS HD2 H 1 1.597 0.030 . 1 . . . . 40 LYS HD2 . 11192 1 432 . 1 1 40 40 LYS HD3 H 1 1.597 0.030 . 1 . . . . 40 LYS HD3 . 11192 1 433 . 1 1 40 40 LYS HE2 H 1 3.042 0.030 . 1 . . . . 40 LYS HE2 . 11192 1 434 . 1 1 40 40 LYS HE3 H 1 3.042 0.030 . 1 . . . . 40 LYS HE3 . 11192 1 435 . 1 1 40 40 LYS HG2 H 1 1.471 0.030 . 2 . . . . 40 LYS HG2 . 11192 1 436 . 1 1 40 40 LYS HG3 H 1 1.359 0.030 . 2 . . . . 40 LYS HG3 . 11192 1 437 . 1 1 40 40 LYS C C 13 172.936 0.300 . 1 . . . . 40 LYS C . 11192 1 438 . 1 1 40 40 LYS CA C 13 54.746 0.300 . 1 . . . . 40 LYS CA . 11192 1 439 . 1 1 40 40 LYS CB C 13 38.155 0.300 . 1 . . . . 40 LYS CB . 11192 1 440 . 1 1 40 40 LYS CD C 13 29.122 0.300 . 1 . . . . 40 LYS CD . 11192 1 441 . 1 1 40 40 LYS CE C 13 42.294 0.300 . 1 . . . . 40 LYS CE . 11192 1 442 . 1 1 40 40 LYS CG C 13 25.725 0.300 . 1 . . . . 40 LYS CG . 11192 1 443 . 1 1 40 40 LYS N N 15 118.778 0.300 . 1 . . . . 40 LYS N . 11192 1 444 . 1 1 41 41 TRP H H 1 8.736 0.030 . 1 . . . . 41 TRP H . 11192 1 445 . 1 1 41 41 TRP HA H 1 5.683 0.030 . 1 . . . . 41 TRP HA . 11192 1 446 . 1 1 41 41 TRP HB2 H 1 2.940 0.030 . 2 . . . . 41 TRP HB2 . 11192 1 447 . 1 1 41 41 TRP HB3 H 1 3.108 0.030 . 2 . . . . 41 TRP HB3 . 11192 1 448 . 1 1 41 41 TRP HD1 H 1 7.360 0.030 . 1 . . . . 41 TRP HD1 . 11192 1 449 . 1 1 41 41 TRP HE1 H 1 10.316 0.030 . 1 . . . . 41 TRP HE1 . 11192 1 450 . 1 1 41 41 TRP HE3 H 1 7.390 0.030 . 1 . . . . 41 TRP HE3 . 11192 1 451 . 1 1 41 41 TRP HH2 H 1 6.624 0.030 . 1 . . . . 41 TRP HH2 . 11192 1 452 . 1 1 41 41 TRP HZ2 H 1 6.701 0.030 . 1 . . . . 41 TRP HZ2 . 11192 1 453 . 1 1 41 41 TRP HZ3 H 1 6.570 0.030 . 1 . . . . 41 TRP HZ3 . 11192 1 454 . 1 1 41 41 TRP C C 13 175.709 0.300 . 1 . . . . 41 TRP C . 11192 1 455 . 1 1 41 41 TRP CA C 13 55.294 0.300 . 1 . . . . 41 TRP CA . 11192 1 456 . 1 1 41 41 TRP CB C 13 31.421 0.300 . 1 . . . . 41 TRP CB . 11192 1 457 . 1 1 41 41 TRP CD1 C 13 126.859 0.300 . 1 . . . . 41 TRP CD1 . 11192 1 458 . 1 1 41 41 TRP CE3 C 13 120.549 0.300 . 1 . . . . 41 TRP CE3 . 11192 1 459 . 1 1 41 41 TRP CH2 C 13 123.419 0.300 . 1 . . . . 41 TRP CH2 . 11192 1 460 . 1 1 41 41 TRP CZ2 C 13 113.881 0.300 . 1 . . . . 41 TRP CZ2 . 11192 1 461 . 1 1 41 41 TRP CZ3 C 13 120.569 0.300 . 1 . . . . 41 TRP CZ3 . 11192 1 462 . 1 1 41 41 TRP N N 15 120.583 0.300 . 1 . . . . 41 TRP N . 11192 1 463 . 1 1 41 41 TRP NE1 N 15 129.891 0.300 . 1 . . . . 41 TRP NE1 . 11192 1 464 . 1 1 42 42 TYR H H 1 9.673 0.030 . 1 . . . . 42 TYR H . 11192 1 465 . 1 1 42 42 TYR HA H 1 4.946 0.030 . 1 . . . . 42 TYR HA . 11192 1 466 . 1 1 42 42 TYR HB2 H 1 2.923 0.030 . 2 . . . . 42 TYR HB2 . 11192 1 467 . 1 1 42 42 TYR HB3 H 1 2.239 0.030 . 2 . . . . 42 TYR HB3 . 11192 1 468 . 1 1 42 42 TYR HD1 H 1 6.675 0.030 . 1 . . . . 42 TYR HD1 . 11192 1 469 . 1 1 42 42 TYR HD2 H 1 6.675 0.030 . 1 . . . . 42 TYR HD2 . 11192 1 470 . 1 1 42 42 TYR HE1 H 1 6.550 0.030 . 1 . . . . 42 TYR HE1 . 11192 1 471 . 1 1 42 42 TYR HE2 H 1 6.550 0.030 . 1 . . . . 42 TYR HE2 . 11192 1 472 . 1 1 42 42 TYR C C 13 173.972 0.300 . 1 . . . . 42 TYR C . 11192 1 473 . 1 1 42 42 TYR CA C 13 56.820 0.300 . 1 . . . . 42 TYR CA . 11192 1 474 . 1 1 42 42 TYR CB C 13 42.111 0.300 . 1 . . . . 42 TYR CB . 11192 1 475 . 1 1 42 42 TYR CD1 C 13 132.619 0.300 . 1 . . . . 42 TYR CD1 . 11192 1 476 . 1 1 42 42 TYR CD2 C 13 132.619 0.300 . 1 . . . . 42 TYR CD2 . 11192 1 477 . 1 1 42 42 TYR CE1 C 13 117.406 0.300 . 1 . . . . 42 TYR CE1 . 11192 1 478 . 1 1 42 42 TYR CE2 C 13 117.406 0.300 . 1 . . . . 42 TYR CE2 . 11192 1 479 . 1 1 42 42 TYR N N 15 118.507 0.300 . 1 . . . . 42 TYR N . 11192 1 480 . 1 1 43 43 LYS H H 1 9.038 0.030 . 1 . . . . 43 LYS H . 11192 1 481 . 1 1 43 43 LYS HA H 1 4.451 0.030 . 1 . . . . 43 LYS HA . 11192 1 482 . 1 1 43 43 LYS HB2 H 1 1.156 0.030 . 2 . . . . 43 LYS HB2 . 11192 1 483 . 1 1 43 43 LYS HB3 H 1 1.612 0.030 . 2 . . . . 43 LYS HB3 . 11192 1 484 . 1 1 43 43 LYS HD2 H 1 1.609 0.030 . 2 . . . . 43 LYS HD2 . 11192 1 485 . 1 1 43 43 LYS HD3 H 1 1.484 0.030 . 2 . . . . 43 LYS HD3 . 11192 1 486 . 1 1 43 43 LYS HE2 H 1 2.826 0.030 . 2 . . . . 43 LYS HE2 . 11192 1 487 . 1 1 43 43 LYS HE3 H 1 2.872 0.030 . 2 . . . . 43 LYS HE3 . 11192 1 488 . 1 1 43 43 LYS HG2 H 1 0.606 0.030 . 2 . . . . 43 LYS HG2 . 11192 1 489 . 1 1 43 43 LYS HG3 H 1 0.349 0.030 . 2 . . . . 43 LYS HG3 . 11192 1 490 . 1 1 43 43 LYS C C 13 176.640 0.300 . 1 . . . . 43 LYS C . 11192 1 491 . 1 1 43 43 LYS CA C 13 54.076 0.300 . 1 . . . . 43 LYS CA . 11192 1 492 . 1 1 43 43 LYS CB C 13 34.382 0.300 . 1 . . . . 43 LYS CB . 11192 1 493 . 1 1 43 43 LYS CD C 13 29.746 0.300 . 1 . . . . 43 LYS CD . 11192 1 494 . 1 1 43 43 LYS CE C 13 42.478 0.300 . 1 . . . . 43 LYS CE . 11192 1 495 . 1 1 43 43 LYS CG C 13 24.689 0.300 . 1 . . . . 43 LYS CG . 11192 1 496 . 1 1 43 43 LYS N N 15 120.841 0.300 . 1 . . . . 43 LYS N . 11192 1 497 . 1 1 44 44 ASN H H 1 9.779 0.030 . 1 . . . . 44 ASN H . 11192 1 498 . 1 1 44 44 ASN HA H 1 4.423 0.030 . 1 . . . . 44 ASN HA . 11192 1 499 . 1 1 44 44 ASN HB2 H 1 2.887 0.030 . 2 . . . . 44 ASN HB2 . 11192 1 500 . 1 1 44 44 ASN HB3 H 1 3.078 0.030 . 2 . . . . 44 ASN HB3 . 11192 1 501 . 1 1 44 44 ASN HD21 H 1 7.149 0.030 . 2 . . . . 44 ASN HD21 . 11192 1 502 . 1 1 44 44 ASN HD22 H 1 7.727 0.030 . 2 . . . . 44 ASN HD22 . 11192 1 503 . 1 1 44 44 ASN C C 13 175.253 0.300 . 1 . . . . 44 ASN C . 11192 1 504 . 1 1 44 44 ASN CA C 13 54.078 0.300 . 1 . . . . 44 ASN CA . 11192 1 505 . 1 1 44 44 ASN CB C 13 37.043 0.300 . 1 . . . . 44 ASN CB . 11192 1 506 . 1 1 44 44 ASN N N 15 128.420 0.300 . 1 . . . . 44 ASN N . 11192 1 507 . 1 1 44 44 ASN ND2 N 15 112.835 0.300 . 1 . . . . 44 ASN ND2 . 11192 1 508 . 1 1 45 45 GLY H H 1 8.399 0.030 . 1 . . . . 45 GLY H . 11192 1 509 . 1 1 45 45 GLY HA2 H 1 3.418 0.030 . 2 . . . . 45 GLY HA2 . 11192 1 510 . 1 1 45 45 GLY HA3 H 1 4.149 0.030 . 2 . . . . 45 GLY HA3 . 11192 1 511 . 1 1 45 45 GLY C C 13 173.427 0.300 . 1 . . . . 45 GLY C . 11192 1 512 . 1 1 45 45 GLY CA C 13 45.332 0.300 . 1 . . . . 45 GLY CA . 11192 1 513 . 1 1 45 45 GLY N N 15 100.792 0.300 . 1 . . . . 45 GLY N . 11192 1 514 . 1 1 46 46 VAL H H 1 8.023 0.030 . 1 . . . . 46 VAL H . 11192 1 515 . 1 1 46 46 VAL HA H 1 4.395 0.030 . 1 . . . . 46 VAL HA . 11192 1 516 . 1 1 46 46 VAL HB H 1 2.151 0.030 . 1 . . . . 46 VAL HB . 11192 1 517 . 1 1 46 46 VAL HG11 H 1 1.094 0.030 . 1 . . . . 46 VAL HG1 . 11192 1 518 . 1 1 46 46 VAL HG12 H 1 1.094 0.030 . 1 . . . . 46 VAL HG1 . 11192 1 519 . 1 1 46 46 VAL HG13 H 1 1.094 0.030 . 1 . . . . 46 VAL HG1 . 11192 1 520 . 1 1 46 46 VAL HG21 H 1 0.986 0.030 . 1 . . . . 46 VAL HG2 . 11192 1 521 . 1 1 46 46 VAL HG22 H 1 0.986 0.030 . 1 . . . . 46 VAL HG2 . 11192 1 522 . 1 1 46 46 VAL HG23 H 1 0.986 0.030 . 1 . . . . 46 VAL HG2 . 11192 1 523 . 1 1 46 46 VAL C C 13 175.727 0.300 . 1 . . . . 46 VAL C . 11192 1 524 . 1 1 46 46 VAL CA C 13 61.548 0.300 . 1 . . . . 46 VAL CA . 11192 1 525 . 1 1 46 46 VAL CB C 13 33.379 0.300 . 1 . . . . 46 VAL CB . 11192 1 526 . 1 1 46 46 VAL CG1 C 13 21.102 0.300 . 2 . . . . 46 VAL CG1 . 11192 1 527 . 1 1 46 46 VAL CG2 C 13 21.012 0.300 . 2 . . . . 46 VAL CG2 . 11192 1 528 . 1 1 46 46 VAL N N 15 122.986 0.300 . 1 . . . . 46 VAL N . 11192 1 529 . 1 1 47 47 GLU H H 1 9.181 0.030 . 1 . . . . 47 GLU H . 11192 1 530 . 1 1 47 47 GLU HA H 1 3.783 0.030 . 1 . . . . 47 GLU HA . 11192 1 531 . 1 1 47 47 GLU HB2 H 1 1.853 0.030 . 2 . . . . 47 GLU HB2 . 11192 1 532 . 1 1 47 47 GLU HB3 H 1 1.750 0.030 . 2 . . . . 47 GLU HB3 . 11192 1 533 . 1 1 47 47 GLU HG2 H 1 1.978 0.030 . 2 . . . . 47 GLU HG2 . 11192 1 534 . 1 1 47 47 GLU HG3 H 1 2.051 0.030 . 2 . . . . 47 GLU HG3 . 11192 1 535 . 1 1 47 47 GLU C C 13 176.148 0.300 . 1 . . . . 47 GLU C . 11192 1 536 . 1 1 47 47 GLU CA C 13 57.713 0.300 . 1 . . . . 47 GLU CA . 11192 1 537 . 1 1 47 47 GLU CB C 13 29.513 0.300 . 1 . . . . 47 GLU CB . 11192 1 538 . 1 1 47 47 GLU CG C 13 35.639 0.300 . 1 . . . . 47 GLU CG . 11192 1 539 . 1 1 47 47 GLU N N 15 131.301 0.300 . 1 . . . . 47 GLU N . 11192 1 540 . 1 1 48 48 VAL H H 1 8.881 0.030 . 1 . . . . 48 VAL H . 11192 1 541 . 1 1 48 48 VAL HA H 1 3.898 0.030 . 1 . . . . 48 VAL HA . 11192 1 542 . 1 1 48 48 VAL HB H 1 1.845 0.030 . 1 . . . . 48 VAL HB . 11192 1 543 . 1 1 48 48 VAL HG11 H 1 0.915 0.030 . 1 . . . . 48 VAL HG1 . 11192 1 544 . 1 1 48 48 VAL HG12 H 1 0.915 0.030 . 1 . . . . 48 VAL HG1 . 11192 1 545 . 1 1 48 48 VAL HG13 H 1 0.915 0.030 . 1 . . . . 48 VAL HG1 . 11192 1 546 . 1 1 48 48 VAL HG21 H 1 1.002 0.030 . 1 . . . . 48 VAL HG2 . 11192 1 547 . 1 1 48 48 VAL HG22 H 1 1.002 0.030 . 1 . . . . 48 VAL HG2 . 11192 1 548 . 1 1 48 48 VAL HG23 H 1 1.002 0.030 . 1 . . . . 48 VAL HG2 . 11192 1 549 . 1 1 48 48 VAL C C 13 174.533 0.300 . 1 . . . . 48 VAL C . 11192 1 550 . 1 1 48 48 VAL CA C 13 62.505 0.300 . 1 . . . . 48 VAL CA . 11192 1 551 . 1 1 48 48 VAL CB C 13 32.362 0.300 . 1 . . . . 48 VAL CB . 11192 1 552 . 1 1 48 48 VAL CG1 C 13 22.240 0.300 . 2 . . . . 48 VAL CG1 . 11192 1 553 . 1 1 48 48 VAL CG2 C 13 22.244 0.300 . 2 . . . . 48 VAL CG2 . 11192 1 554 . 1 1 48 48 VAL N N 15 128.669 0.300 . 1 . . . . 48 VAL N . 11192 1 555 . 1 1 49 49 ARG H H 1 8.202 0.030 . 1 . . . . 49 ARG H . 11192 1 556 . 1 1 49 49 ARG HA H 1 4.896 0.030 . 1 . . . . 49 ARG HA . 11192 1 557 . 1 1 49 49 ARG HB2 H 1 1.695 0.030 . 2 . . . . 49 ARG HB2 . 11192 1 558 . 1 1 49 49 ARG HB3 H 1 1.921 0.030 . 2 . . . . 49 ARG HB3 . 11192 1 559 . 1 1 49 49 ARG HD2 H 1 3.222 0.030 . 1 . . . . 49 ARG HD2 . 11192 1 560 . 1 1 49 49 ARG HD3 H 1 3.222 0.030 . 1 . . . . 49 ARG HD3 . 11192 1 561 . 1 1 49 49 ARG HG2 H 1 1.659 0.030 . 2 . . . . 49 ARG HG2 . 11192 1 562 . 1 1 49 49 ARG HG3 H 1 1.737 0.030 . 2 . . . . 49 ARG HG3 . 11192 1 563 . 1 1 49 49 ARG C C 13 173.375 0.300 . 1 . . . . 49 ARG C . 11192 1 564 . 1 1 49 49 ARG CA C 13 51.763 0.300 . 1 . . . . 49 ARG CA . 11192 1 565 . 1 1 49 49 ARG CB C 13 30.049 0.300 . 1 . . . . 49 ARG CB . 11192 1 566 . 1 1 49 49 ARG CD C 13 42.675 0.300 . 1 . . . . 49 ARG CD . 11192 1 567 . 1 1 49 49 ARG CG C 13 26.598 0.300 . 1 . . . . 49 ARG CG . 11192 1 568 . 1 1 49 49 ARG N N 15 126.846 0.300 . 1 . . . . 49 ARG N . 11192 1 569 . 1 1 50 50 PRO HA H 1 4.366 0.030 . 1 . . . . 50 PRO HA . 11192 1 570 . 1 1 50 50 PRO HB2 H 1 2.086 0.030 . 2 . . . . 50 PRO HB2 . 11192 1 571 . 1 1 50 50 PRO HB3 H 1 2.515 0.030 . 2 . . . . 50 PRO HB3 . 11192 1 572 . 1 1 50 50 PRO HD2 H 1 3.710 0.030 . 2 . . . . 50 PRO HD2 . 11192 1 573 . 1 1 50 50 PRO HD3 H 1 3.874 0.030 . 2 . . . . 50 PRO HD3 . 11192 1 574 . 1 1 50 50 PRO HG2 H 1 2.214 0.030 . 2 . . . . 50 PRO HG2 . 11192 1 575 . 1 1 50 50 PRO HG3 H 1 2.029 0.030 . 2 . . . . 50 PRO HG3 . 11192 1 576 . 1 1 50 50 PRO C C 13 175.850 0.300 . 1 . . . . 50 PRO C . 11192 1 577 . 1 1 50 50 PRO CA C 13 62.888 0.300 . 1 . . . . 50 PRO CA . 11192 1 578 . 1 1 50 50 PRO CB C 13 32.595 0.300 . 1 . . . . 50 PRO CB . 11192 1 579 . 1 1 50 50 PRO CD C 13 50.447 0.300 . 1 . . . . 50 PRO CD . 11192 1 580 . 1 1 50 50 PRO CG C 13 27.749 0.300 . 1 . . . . 50 PRO CG . 11192 1 581 . 1 1 51 51 SER H H 1 9.422 0.030 . 1 . . . . 51 SER H . 11192 1 582 . 1 1 51 51 SER HA H 1 4.828 0.030 . 1 . . . . 51 SER HA . 11192 1 583 . 1 1 51 51 SER HB2 H 1 3.983 0.030 . 2 . . . . 51 SER HB2 . 11192 1 584 . 1 1 51 51 SER HB3 H 1 4.306 0.030 . 2 . . . . 51 SER HB3 . 11192 1 585 . 1 1 51 51 SER C C 13 173.954 0.300 . 1 . . . . 51 SER C . 11192 1 586 . 1 1 51 51 SER CA C 13 56.787 0.300 . 1 . . . . 51 SER CA . 11192 1 587 . 1 1 51 51 SER CB C 13 65.786 0.300 . 1 . . . . 51 SER CB . 11192 1 588 . 1 1 51 51 SER N N 15 117.821 0.300 . 1 . . . . 51 SER N . 11192 1 589 . 1 1 52 52 LYS HA H 1 4.151 0.030 . 1 . . . . 52 LYS HA . 11192 1 590 . 1 1 52 52 LYS HB2 H 1 1.863 0.030 . 2 . . . . 52 LYS HB2 . 11192 1 591 . 1 1 52 52 LYS HB3 H 1 1.911 0.030 . 2 . . . . 52 LYS HB3 . 11192 1 592 . 1 1 52 52 LYS HD2 H 1 1.717 0.030 . 1 . . . . 52 LYS HD2 . 11192 1 593 . 1 1 52 52 LYS HD3 H 1 1.717 0.030 . 1 . . . . 52 LYS HD3 . 11192 1 594 . 1 1 52 52 LYS HE2 H 1 3.010 0.030 . 1 . . . . 52 LYS HE2 . 11192 1 595 . 1 1 52 52 LYS HE3 H 1 3.010 0.030 . 1 . . . . 52 LYS HE3 . 11192 1 596 . 1 1 52 52 LYS HG2 H 1 1.499 0.030 . 1 . . . . 52 LYS HG2 . 11192 1 597 . 1 1 52 52 LYS HG3 H 1 1.499 0.030 . 1 . . . . 52 LYS HG3 . 11192 1 598 . 1 1 52 52 LYS C C 13 176.938 0.300 . 1 . . . . 52 LYS C . 11192 1 599 . 1 1 52 52 LYS CA C 13 58.894 0.300 . 1 . . . . 52 LYS CA . 11192 1 600 . 1 1 52 52 LYS CB C 13 31.949 0.300 . 1 . . . . 52 LYS CB . 11192 1 601 . 1 1 52 52 LYS CD C 13 28.824 0.300 . 1 . . . . 52 LYS CD . 11192 1 602 . 1 1 52 52 LYS CE C 13 41.973 0.300 . 1 . . . . 52 LYS CE . 11192 1 603 . 1 1 52 52 LYS CG C 13 24.822 0.300 . 1 . . . . 52 LYS CG . 11192 1 604 . 1 1 53 53 ARG H H 1 7.930 0.030 . 1 . . . . 53 ARG H . 11192 1 605 . 1 1 53 53 ARG HA H 1 4.509 0.030 . 1 . . . . 53 ARG HA . 11192 1 606 . 1 1 53 53 ARG HB2 H 1 1.810 0.030 . 2 . . . . 53 ARG HB2 . 11192 1 607 . 1 1 53 53 ARG HB3 H 1 1.919 0.030 . 2 . . . . 53 ARG HB3 . 11192 1 608 . 1 1 53 53 ARG HD2 H 1 3.159 0.030 . 2 . . . . 53 ARG HD2 . 11192 1 609 . 1 1 53 53 ARG HD3 H 1 3.385 0.030 . 2 . . . . 53 ARG HD3 . 11192 1 610 . 1 1 53 53 ARG HE H 1 6.875 0.030 . 1 . . . . 53 ARG HE . 11192 1 611 . 1 1 53 53 ARG HG2 H 1 1.536 0.030 . 2 . . . . 53 ARG HG2 . 11192 1 612 . 1 1 53 53 ARG HG3 H 1 1.630 0.030 . 2 . . . . 53 ARG HG3 . 11192 1 613 . 1 1 53 53 ARG C C 13 174.551 0.300 . 1 . . . . 53 ARG C . 11192 1 614 . 1 1 53 53 ARG CA C 13 56.364 0.300 . 1 . . . . 53 ARG CA . 11192 1 615 . 1 1 53 53 ARG CB C 13 32.324 0.300 . 1 . . . . 53 ARG CB . 11192 1 616 . 1 1 53 53 ARG CD C 13 42.975 0.300 . 1 . . . . 53 ARG CD . 11192 1 617 . 1 1 53 53 ARG CG C 13 29.265 0.300 . 1 . . . . 53 ARG CG . 11192 1 618 . 1 1 53 53 ARG N N 15 114.609 0.300 . 1 . . . . 53 ARG N . 11192 1 619 . 1 1 53 53 ARG NE N 15 81.278 0.300 . 1 . . . . 53 ARG NE . 11192 1 620 . 1 1 54 54 ILE H H 1 7.208 0.030 . 1 . . . . 54 ILE H . 11192 1 621 . 1 1 54 54 ILE HA H 1 5.037 0.030 . 1 . . . . 54 ILE HA . 11192 1 622 . 1 1 54 54 ILE HB H 1 1.891 0.030 . 1 . . . . 54 ILE HB . 11192 1 623 . 1 1 54 54 ILE HD11 H 1 0.878 0.030 . 1 . . . . 54 ILE HD1 . 11192 1 624 . 1 1 54 54 ILE HD12 H 1 0.878 0.030 . 1 . . . . 54 ILE HD1 . 11192 1 625 . 1 1 54 54 ILE HD13 H 1 0.878 0.030 . 1 . . . . 54 ILE HD1 . 11192 1 626 . 1 1 54 54 ILE HG12 H 1 0.999 0.030 . 2 . . . . 54 ILE HG12 . 11192 1 627 . 1 1 54 54 ILE HG13 H 1 1.499 0.030 . 2 . . . . 54 ILE HG13 . 11192 1 628 . 1 1 54 54 ILE HG21 H 1 0.579 0.030 . 1 . . . . 54 ILE HG2 . 11192 1 629 . 1 1 54 54 ILE HG22 H 1 0.579 0.030 . 1 . . . . 54 ILE HG2 . 11192 1 630 . 1 1 54 54 ILE HG23 H 1 0.579 0.030 . 1 . . . . 54 ILE HG2 . 11192 1 631 . 1 1 54 54 ILE C C 13 174.779 0.300 . 1 . . . . 54 ILE C . 11192 1 632 . 1 1 54 54 ILE CA C 13 60.478 0.300 . 1 . . . . 54 ILE CA . 11192 1 633 . 1 1 54 54 ILE CB C 13 39.069 0.300 . 1 . . . . 54 ILE CB . 11192 1 634 . 1 1 54 54 ILE CD1 C 13 12.880 0.300 . 1 . . . . 54 ILE CD1 . 11192 1 635 . 1 1 54 54 ILE CG1 C 13 28.046 0.300 . 1 . . . . 54 ILE CG1 . 11192 1 636 . 1 1 54 54 ILE CG2 C 13 17.255 0.300 . 1 . . . . 54 ILE CG2 . 11192 1 637 . 1 1 54 54 ILE N N 15 121.339 0.300 . 1 . . . . 54 ILE N . 11192 1 638 . 1 1 55 55 THR H H 1 8.985 0.030 . 1 . . . . 55 THR H . 11192 1 639 . 1 1 55 55 THR HA H 1 4.614 0.030 . 1 . . . . 55 THR HA . 11192 1 640 . 1 1 55 55 THR HB H 1 3.819 0.030 . 1 . . . . 55 THR HB . 11192 1 641 . 1 1 55 55 THR HG21 H 1 1.134 0.030 . 1 . . . . 55 THR HG2 . 11192 1 642 . 1 1 55 55 THR HG22 H 1 1.134 0.030 . 1 . . . . 55 THR HG2 . 11192 1 643 . 1 1 55 55 THR HG23 H 1 1.134 0.030 . 1 . . . . 55 THR HG2 . 11192 1 644 . 1 1 55 55 THR C C 13 173.199 0.300 . 1 . . . . 55 THR C . 11192 1 645 . 1 1 55 55 THR CA C 13 61.057 0.300 . 1 . . . . 55 THR CA . 11192 1 646 . 1 1 55 55 THR CB C 13 70.697 0.300 . 1 . . . . 55 THR CB . 11192 1 647 . 1 1 55 55 THR CG2 C 13 21.090 0.300 . 1 . . . . 55 THR CG2 . 11192 1 648 . 1 1 55 55 THR N N 15 121.602 0.300 . 1 . . . . 55 THR N . 11192 1 649 . 1 1 56 56 ILE H H 1 8.746 0.030 . 1 . . . . 56 ILE H . 11192 1 650 . 1 1 56 56 ILE HA H 1 4.723 0.030 . 1 . . . . 56 ILE HA . 11192 1 651 . 1 1 56 56 ILE HB H 1 1.657 0.030 . 1 . . . . 56 ILE HB . 11192 1 652 . 1 1 56 56 ILE HD11 H 1 0.848 0.030 . 1 . . . . 56 ILE HD1 . 11192 1 653 . 1 1 56 56 ILE HD12 H 1 0.848 0.030 . 1 . . . . 56 ILE HD1 . 11192 1 654 . 1 1 56 56 ILE HD13 H 1 0.848 0.030 . 1 . . . . 56 ILE HD1 . 11192 1 655 . 1 1 56 56 ILE HG12 H 1 0.689 0.030 . 2 . . . . 56 ILE HG12 . 11192 1 656 . 1 1 56 56 ILE HG13 H 1 1.326 0.030 . 2 . . . . 56 ILE HG13 . 11192 1 657 . 1 1 56 56 ILE HG21 H 1 1.154 0.030 . 1 . . . . 56 ILE HG2 . 11192 1 658 . 1 1 56 56 ILE HG22 H 1 1.154 0.030 . 1 . . . . 56 ILE HG2 . 11192 1 659 . 1 1 56 56 ILE HG23 H 1 1.154 0.030 . 1 . . . . 56 ILE HG2 . 11192 1 660 . 1 1 56 56 ILE C C 13 175.481 0.300 . 1 . . . . 56 ILE C . 11192 1 661 . 1 1 56 56 ILE CA C 13 60.404 0.300 . 1 . . . . 56 ILE CA . 11192 1 662 . 1 1 56 56 ILE CB C 13 40.733 0.300 . 1 . . . . 56 ILE CB . 11192 1 663 . 1 1 56 56 ILE CD1 C 13 13.978 0.300 . 1 . . . . 56 ILE CD1 . 11192 1 664 . 1 1 56 56 ILE CG1 C 13 28.437 0.300 . 1 . . . . 56 ILE CG1 . 11192 1 665 . 1 1 56 56 ILE CG2 C 13 18.733 0.300 . 1 . . . . 56 ILE CG2 . 11192 1 666 . 1 1 56 56 ILE N N 15 127.967 0.300 . 1 . . . . 56 ILE N . 11192 1 667 . 1 1 57 57 SER H H 1 9.404 0.030 . 1 . . . . 57 SER H . 11192 1 668 . 1 1 57 57 SER HA H 1 5.093 0.030 . 1 . . . . 57 SER HA . 11192 1 669 . 1 1 57 57 SER HB2 H 1 3.713 0.030 . 1 . . . . 57 SER HB2 . 11192 1 670 . 1 1 57 57 SER HB3 H 1 3.713 0.030 . 1 . . . . 57 SER HB3 . 11192 1 671 . 1 1 57 57 SER C C 13 173.814 0.300 . 1 . . . . 57 SER C . 11192 1 672 . 1 1 57 57 SER CA C 13 56.659 0.300 . 1 . . . . 57 SER CA . 11192 1 673 . 1 1 57 57 SER CB C 13 66.443 0.300 . 1 . . . . 57 SER CB . 11192 1 674 . 1 1 57 57 SER N N 15 120.379 0.300 . 1 . . . . 57 SER N . 11192 1 675 . 1 1 58 58 HIS H H 1 8.763 0.030 . 1 . . . . 58 HIS H . 11192 1 676 . 1 1 58 58 HIS HA H 1 5.311 0.030 . 1 . . . . 58 HIS HA . 11192 1 677 . 1 1 58 58 HIS HB2 H 1 3.067 0.030 . 2 . . . . 58 HIS HB2 . 11192 1 678 . 1 1 58 58 HIS HB3 H 1 3.190 0.030 . 2 . . . . 58 HIS HB3 . 11192 1 679 . 1 1 58 58 HIS HD2 H 1 6.376 0.030 . 1 . . . . 58 HIS HD2 . 11192 1 680 . 1 1 58 58 HIS HE1 H 1 7.029 0.030 . 1 . . . . 58 HIS HE1 . 11192 1 681 . 1 1 58 58 HIS C C 13 173.006 0.300 . 1 . . . . 58 HIS C . 11192 1 682 . 1 1 58 58 HIS CA C 13 53.230 0.300 . 1 . . . . 58 HIS CA . 11192 1 683 . 1 1 58 58 HIS CB C 13 31.393 0.300 . 1 . . . . 58 HIS CB . 11192 1 684 . 1 1 58 58 HIS CD2 C 13 117.595 0.300 . 1 . . . . 58 HIS CD2 . 11192 1 685 . 1 1 58 58 HIS CE1 C 13 136.568 0.300 . 1 . . . . 58 HIS CE1 . 11192 1 686 . 1 1 59 59 VAL H H 1 8.644 0.030 . 1 . . . . 59 VAL H . 11192 1 687 . 1 1 59 59 VAL HA H 1 4.090 0.030 . 1 . . . . 59 VAL HA . 11192 1 688 . 1 1 59 59 VAL HB H 1 2.064 0.030 . 1 . . . . 59 VAL HB . 11192 1 689 . 1 1 59 59 VAL HG11 H 1 0.918 0.030 . 1 . . . . 59 VAL HG1 . 11192 1 690 . 1 1 59 59 VAL HG12 H 1 0.918 0.030 . 1 . . . . 59 VAL HG1 . 11192 1 691 . 1 1 59 59 VAL HG13 H 1 0.918 0.030 . 1 . . . . 59 VAL HG1 . 11192 1 692 . 1 1 59 59 VAL HG21 H 1 0.886 0.030 . 1 . . . . 59 VAL HG2 . 11192 1 693 . 1 1 59 59 VAL HG22 H 1 0.886 0.030 . 1 . . . . 59 VAL HG2 . 11192 1 694 . 1 1 59 59 VAL HG23 H 1 0.886 0.030 . 1 . . . . 59 VAL HG2 . 11192 1 695 . 1 1 59 59 VAL C C 13 175.429 0.300 . 1 . . . . 59 VAL C . 11192 1 696 . 1 1 59 59 VAL CA C 13 60.862 0.300 . 1 . . . . 59 VAL CA . 11192 1 697 . 1 1 59 59 VAL CB C 13 33.415 0.300 . 1 . . . . 59 VAL CB . 11192 1 698 . 1 1 59 59 VAL CG1 C 13 20.794 0.300 . 2 . . . . 59 VAL CG1 . 11192 1 699 . 1 1 59 59 VAL CG2 C 13 19.979 0.300 . 2 . . . . 59 VAL CG2 . 11192 1 700 . 1 1 59 59 VAL N N 15 129.533 0.300 . 1 . . . . 59 VAL N . 11192 1 701 . 1 1 60 60 GLY H H 1 8.761 0.030 . 1 . . . . 60 GLY H . 11192 1 702 . 1 1 60 60 GLY HA2 H 1 3.600 0.030 . 2 . . . . 60 GLY HA2 . 11192 1 703 . 1 1 60 60 GLY HA3 H 1 4.091 0.030 . 2 . . . . 60 GLY HA3 . 11192 1 704 . 1 1 60 60 GLY C C 13 174.147 0.300 . 1 . . . . 60 GLY C . 11192 1 705 . 1 1 60 60 GLY CA C 13 46.634 0.300 . 1 . . . . 60 GLY CA . 11192 1 706 . 1 1 60 60 GLY N N 15 117.506 0.300 . 1 . . . . 60 GLY N . 11192 1 707 . 1 1 61 61 ARG H H 1 8.829 0.030 . 1 . . . . 61 ARG H . 11192 1 708 . 1 1 61 61 ARG HA H 1 4.009 0.030 . 1 . . . . 61 ARG HA . 11192 1 709 . 1 1 61 61 ARG HB2 H 1 2.581 0.030 . 2 . . . . 61 ARG HB2 . 11192 1 710 . 1 1 61 61 ARG HB3 H 1 1.278 0.030 . 2 . . . . 61 ARG HB3 . 11192 1 711 . 1 1 61 61 ARG HD2 H 1 3.198 0.030 . 2 . . . . 61 ARG HD2 . 11192 1 712 . 1 1 61 61 ARG HD3 H 1 3.296 0.030 . 2 . . . . 61 ARG HD3 . 11192 1 713 . 1 1 61 61 ARG HE H 1 7.936 0.030 . 1 . . . . 61 ARG HE . 11192 1 714 . 1 1 61 61 ARG HG2 H 1 1.181 0.030 . 2 . . . . 61 ARG HG2 . 11192 1 715 . 1 1 61 61 ARG HG3 H 1 1.814 0.030 . 2 . . . . 61 ARG HG3 . 11192 1 716 . 1 1 61 61 ARG C C 13 174.884 0.300 . 1 . . . . 61 ARG C . 11192 1 717 . 1 1 61 61 ARG CA C 13 57.923 0.300 . 1 . . . . 61 ARG CA . 11192 1 718 . 1 1 61 61 ARG CB C 13 31.249 0.300 . 1 . . . . 61 ARG CB . 11192 1 719 . 1 1 61 61 ARG CD C 13 42.937 0.300 . 1 . . . . 61 ARG CD . 11192 1 720 . 1 1 61 61 ARG CG C 13 29.123 0.300 . 1 . . . . 61 ARG CG . 11192 1 721 . 1 1 61 61 ARG N N 15 125.393 0.300 . 1 . . . . 61 ARG N . 11192 1 722 . 1 1 61 61 ARG NE N 15 84.134 0.300 . 1 . . . . 61 ARG NE . 11192 1 723 . 1 1 62 62 PHE H H 1 8.314 0.030 . 1 . . . . 62 PHE H . 11192 1 724 . 1 1 62 62 PHE HA H 1 5.315 0.030 . 1 . . . . 62 PHE HA . 11192 1 725 . 1 1 62 62 PHE HB2 H 1 3.304 0.030 . 2 . . . . 62 PHE HB2 . 11192 1 726 . 1 1 62 62 PHE HB3 H 1 2.769 0.030 . 2 . . . . 62 PHE HB3 . 11192 1 727 . 1 1 62 62 PHE HD1 H 1 7.288 0.030 . 1 . . . . 62 PHE HD1 . 11192 1 728 . 1 1 62 62 PHE HD2 H 1 7.288 0.030 . 1 . . . . 62 PHE HD2 . 11192 1 729 . 1 1 62 62 PHE HE1 H 1 7.297 0.030 . 1 . . . . 62 PHE HE1 . 11192 1 730 . 1 1 62 62 PHE HE2 H 1 7.297 0.030 . 1 . . . . 62 PHE HE2 . 11192 1 731 . 1 1 62 62 PHE HZ H 1 7.230 0.030 . 1 . . . . 62 PHE HZ . 11192 1 732 . 1 1 62 62 PHE C C 13 175.850 0.300 . 1 . . . . 62 PHE C . 11192 1 733 . 1 1 62 62 PHE CA C 13 57.681 0.300 . 1 . . . . 62 PHE CA . 11192 1 734 . 1 1 62 62 PHE CB C 13 40.922 0.300 . 1 . . . . 62 PHE CB . 11192 1 735 . 1 1 62 62 PHE CD1 C 13 131.327 0.300 . 1 . . . . 62 PHE CD1 . 11192 1 736 . 1 1 62 62 PHE CD2 C 13 131.327 0.300 . 1 . . . . 62 PHE CD2 . 11192 1 737 . 1 1 62 62 PHE CE1 C 13 130.392 0.300 . 1 . . . . 62 PHE CE1 . 11192 1 738 . 1 1 62 62 PHE CE2 C 13 130.392 0.300 . 1 . . . . 62 PHE CE2 . 11192 1 739 . 1 1 62 62 PHE CZ C 13 129.975 0.300 . 1 . . . . 62 PHE CZ . 11192 1 740 . 1 1 62 62 PHE N N 15 115.206 0.300 . 1 . . . . 62 PHE N . 11192 1 741 . 1 1 63 63 HIS H H 1 8.748 0.030 . 1 . . . . 63 HIS H . 11192 1 742 . 1 1 63 63 HIS HA H 1 5.047 0.030 . 1 . . . . 63 HIS HA . 11192 1 743 . 1 1 63 63 HIS HB2 H 1 2.546 0.030 . 2 . . . . 63 HIS HB2 . 11192 1 744 . 1 1 63 63 HIS HB3 H 1 2.451 0.030 . 2 . . . . 63 HIS HB3 . 11192 1 745 . 1 1 63 63 HIS HD2 H 1 6.399 0.030 . 1 . . . . 63 HIS HD2 . 11192 1 746 . 1 1 63 63 HIS HE1 H 1 7.985 0.030 . 1 . . . . 63 HIS HE1 . 11192 1 747 . 1 1 63 63 HIS C C 13 174.130 0.300 . 1 . . . . 63 HIS C . 11192 1 748 . 1 1 63 63 HIS CA C 13 55.841 0.300 . 1 . . . . 63 HIS CA . 11192 1 749 . 1 1 63 63 HIS CB C 13 33.641 0.300 . 1 . . . . 63 HIS CB . 11192 1 750 . 1 1 63 63 HIS CD2 C 13 115.540 0.300 . 1 . . . . 63 HIS CD2 . 11192 1 751 . 1 1 63 63 HIS CE1 C 13 137.042 0.300 . 1 . . . . 63 HIS CE1 . 11192 1 752 . 1 1 63 63 HIS N N 15 124.610 0.300 . 1 . . . . 63 HIS N . 11192 1 753 . 1 1 64 64 LYS H H 1 8.784 0.030 . 1 . . . . 64 LYS H . 11192 1 754 . 1 1 64 64 LYS HA H 1 5.590 0.030 . 1 . . . . 64 LYS HA . 11192 1 755 . 1 1 64 64 LYS HB2 H 1 1.507 0.030 . 2 . . . . 64 LYS HB2 . 11192 1 756 . 1 1 64 64 LYS HB3 H 1 1.677 0.030 . 2 . . . . 64 LYS HB3 . 11192 1 757 . 1 1 64 64 LYS HD2 H 1 1.409 0.030 . 2 . . . . 64 LYS HD2 . 11192 1 758 . 1 1 64 64 LYS HD3 H 1 1.457 0.030 . 2 . . . . 64 LYS HD3 . 11192 1 759 . 1 1 64 64 LYS HE2 H 1 2.624 0.030 . 1 . . . . 64 LYS HE2 . 11192 1 760 . 1 1 64 64 LYS HE3 H 1 2.624 0.030 . 1 . . . . 64 LYS HE3 . 11192 1 761 . 1 1 64 64 LYS HG2 H 1 1.232 0.030 . 2 . . . . 64 LYS HG2 . 11192 1 762 . 1 1 64 64 LYS HG3 H 1 1.319 0.030 . 2 . . . . 64 LYS HG3 . 11192 1 763 . 1 1 64 64 LYS C C 13 172.023 0.300 . 1 . . . . 64 LYS C . 11192 1 764 . 1 1 64 64 LYS CA C 13 54.661 0.300 . 1 . . . . 64 LYS CA . 11192 1 765 . 1 1 64 64 LYS CB C 13 37.495 0.300 . 1 . . . . 64 LYS CB . 11192 1 766 . 1 1 64 64 LYS CD C 13 29.622 0.300 . 1 . . . . 64 LYS CD . 11192 1 767 . 1 1 64 64 LYS CE C 13 41.431 0.300 . 1 . . . . 64 LYS CE . 11192 1 768 . 1 1 64 64 LYS CG C 13 24.858 0.300 . 1 . . . . 64 LYS CG . 11192 1 769 . 1 1 64 64 LYS N N 15 122.319 0.300 . 1 . . . . 64 LYS N . 11192 1 770 . 1 1 65 65 LEU H H 1 8.519 0.030 . 1 . . . . 65 LEU H . 11192 1 771 . 1 1 65 65 LEU HA H 1 4.448 0.030 . 1 . . . . 65 LEU HA . 11192 1 772 . 1 1 65 65 LEU HB2 H 1 -0.823 0.030 . 2 . . . . 65 LEU HB2 . 11192 1 773 . 1 1 65 65 LEU HB3 H 1 0.515 0.030 . 2 . . . . 65 LEU HB3 . 11192 1 774 . 1 1 65 65 LEU HD11 H 1 0.400 0.030 . 1 . . . . 65 LEU HD1 . 11192 1 775 . 1 1 65 65 LEU HD12 H 1 0.400 0.030 . 1 . . . . 65 LEU HD1 . 11192 1 776 . 1 1 65 65 LEU HD13 H 1 0.400 0.030 . 1 . . . . 65 LEU HD1 . 11192 1 777 . 1 1 65 65 LEU HD21 H 1 0.510 0.030 . 1 . . . . 65 LEU HD2 . 11192 1 778 . 1 1 65 65 LEU HD22 H 1 0.510 0.030 . 1 . . . . 65 LEU HD2 . 11192 1 779 . 1 1 65 65 LEU HD23 H 1 0.510 0.030 . 1 . . . . 65 LEU HD2 . 11192 1 780 . 1 1 65 65 LEU HG H 1 0.960 0.030 . 1 . . . . 65 LEU HG . 11192 1 781 . 1 1 65 65 LEU C C 13 173.533 0.300 . 1 . . . . 65 LEU C . 11192 1 782 . 1 1 65 65 LEU CA C 13 53.484 0.300 . 1 . . . . 65 LEU CA . 11192 1 783 . 1 1 65 65 LEU CB C 13 42.131 0.300 . 1 . . . . 65 LEU CB . 11192 1 784 . 1 1 65 65 LEU CD1 C 13 25.429 0.300 . 2 . . . . 65 LEU CD1 . 11192 1 785 . 1 1 65 65 LEU CD2 C 13 26.896 0.300 . 2 . . . . 65 LEU CD2 . 11192 1 786 . 1 1 65 65 LEU CG C 13 27.262 0.300 . 1 . . . . 65 LEU CG . 11192 1 787 . 1 1 65 65 LEU N N 15 127.599 0.300 . 1 . . . . 65 LEU N . 11192 1 788 . 1 1 66 66 VAL H H 1 8.752 0.030 . 1 . . . . 66 VAL H . 11192 1 789 . 1 1 66 66 VAL HA H 1 4.684 0.030 . 1 . . . . 66 VAL HA . 11192 1 790 . 1 1 66 66 VAL HB H 1 1.884 0.030 . 1 . . . . 66 VAL HB . 11192 1 791 . 1 1 66 66 VAL HG11 H 1 0.707 0.030 . 1 . . . . 66 VAL HG1 . 11192 1 792 . 1 1 66 66 VAL HG12 H 1 0.707 0.030 . 1 . . . . 66 VAL HG1 . 11192 1 793 . 1 1 66 66 VAL HG13 H 1 0.707 0.030 . 1 . . . . 66 VAL HG1 . 11192 1 794 . 1 1 66 66 VAL HG21 H 1 0.807 0.030 . 1 . . . . 66 VAL HG2 . 11192 1 795 . 1 1 66 66 VAL HG22 H 1 0.807 0.030 . 1 . . . . 66 VAL HG2 . 11192 1 796 . 1 1 66 66 VAL HG23 H 1 0.807 0.030 . 1 . . . . 66 VAL HG2 . 11192 1 797 . 1 1 66 66 VAL C C 13 174.516 0.300 . 1 . . . . 66 VAL C . 11192 1 798 . 1 1 66 66 VAL CA C 13 60.505 0.300 . 1 . . . . 66 VAL CA . 11192 1 799 . 1 1 66 66 VAL CB C 13 33.964 0.300 . 1 . . . . 66 VAL CB . 11192 1 800 . 1 1 66 66 VAL CG1 C 13 21.242 0.300 . 2 . . . . 66 VAL CG1 . 11192 1 801 . 1 1 66 66 VAL CG2 C 13 21.170 0.300 . 2 . . . . 66 VAL CG2 . 11192 1 802 . 1 1 66 66 VAL N N 15 126.262 0.300 . 1 . . . . 66 VAL N . 11192 1 803 . 1 1 67 67 ILE H H 1 9.102 0.030 . 1 . . . . 67 ILE H . 11192 1 804 . 1 1 67 67 ILE HA H 1 4.499 0.030 . 1 . . . . 67 ILE HA . 11192 1 805 . 1 1 67 67 ILE HB H 1 1.592 0.030 . 1 . . . . 67 ILE HB . 11192 1 806 . 1 1 67 67 ILE HD11 H 1 0.657 0.030 . 1 . . . . 67 ILE HD1 . 11192 1 807 . 1 1 67 67 ILE HD12 H 1 0.657 0.030 . 1 . . . . 67 ILE HD1 . 11192 1 808 . 1 1 67 67 ILE HD13 H 1 0.657 0.030 . 1 . . . . 67 ILE HD1 . 11192 1 809 . 1 1 67 67 ILE HG12 H 1 0.794 0.030 . 2 . . . . 67 ILE HG12 . 11192 1 810 . 1 1 67 67 ILE HG13 H 1 1.310 0.030 . 2 . . . . 67 ILE HG13 . 11192 1 811 . 1 1 67 67 ILE HG21 H 1 0.731 0.030 . 1 . . . . 67 ILE HG2 . 11192 1 812 . 1 1 67 67 ILE HG22 H 1 0.731 0.030 . 1 . . . . 67 ILE HG2 . 11192 1 813 . 1 1 67 67 ILE HG23 H 1 0.731 0.030 . 1 . . . . 67 ILE HG2 . 11192 1 814 . 1 1 67 67 ILE C C 13 174.674 0.300 . 1 . . . . 67 ILE C . 11192 1 815 . 1 1 67 67 ILE CA C 13 60.067 0.300 . 1 . . . . 67 ILE CA . 11192 1 816 . 1 1 67 67 ILE CB C 13 39.687 0.300 . 1 . . . . 67 ILE CB . 11192 1 817 . 1 1 67 67 ILE CD1 C 13 14.035 0.300 . 1 . . . . 67 ILE CD1 . 11192 1 818 . 1 1 67 67 ILE CG1 C 13 26.719 0.300 . 1 . . . . 67 ILE CG1 . 11192 1 819 . 1 1 67 67 ILE CG2 C 13 17.997 0.300 . 1 . . . . 67 ILE CG2 . 11192 1 820 . 1 1 67 67 ILE N N 15 127.459 0.300 . 1 . . . . 67 ILE N . 11192 1 821 . 1 1 68 68 ASP H H 1 8.705 0.030 . 1 . . . . 68 ASP H . 11192 1 822 . 1 1 68 68 ASP HA H 1 4.789 0.030 . 1 . . . . 68 ASP HA . 11192 1 823 . 1 1 68 68 ASP HB2 H 1 2.546 0.030 . 1 . . . . 68 ASP HB2 . 11192 1 824 . 1 1 68 68 ASP HB3 H 1 2.546 0.030 . 1 . . . . 68 ASP HB3 . 11192 1 825 . 1 1 68 68 ASP C C 13 174.744 0.300 . 1 . . . . 68 ASP C . 11192 1 826 . 1 1 68 68 ASP CA C 13 54.060 0.300 . 1 . . . . 68 ASP CA . 11192 1 827 . 1 1 68 68 ASP CB C 13 43.152 0.300 . 1 . . . . 68 ASP CB . 11192 1 828 . 1 1 68 68 ASP N N 15 125.247 0.300 . 1 . . . . 68 ASP N . 11192 1 829 . 1 1 69 69 ASP H H 1 8.397 0.030 . 1 . . . . 69 ASP H . 11192 1 830 . 1 1 69 69 ASP HA H 1 3.939 0.030 . 1 . . . . 69 ASP HA . 11192 1 831 . 1 1 69 69 ASP HB2 H 1 2.900 0.030 . 2 . . . . 69 ASP HB2 . 11192 1 832 . 1 1 69 69 ASP HB3 H 1 2.269 0.030 . 2 . . . . 69 ASP HB3 . 11192 1 833 . 1 1 69 69 ASP C C 13 174.990 0.300 . 1 . . . . 69 ASP C . 11192 1 834 . 1 1 69 69 ASP CA C 13 53.954 0.300 . 1 . . . . 69 ASP CA . 11192 1 835 . 1 1 69 69 ASP CB C 13 39.670 0.300 . 1 . . . . 69 ASP CB . 11192 1 836 . 1 1 69 69 ASP N N 15 118.148 0.300 . 1 . . . . 69 ASP N . 11192 1 837 . 1 1 70 70 VAL H H 1 8.288 0.030 . 1 . . . . 70 VAL H . 11192 1 838 . 1 1 70 70 VAL HA H 1 3.815 0.030 . 1 . . . . 70 VAL HA . 11192 1 839 . 1 1 70 70 VAL HB H 1 2.013 0.030 . 1 . . . . 70 VAL HB . 11192 1 840 . 1 1 70 70 VAL HG11 H 1 0.987 0.030 . 1 . . . . 70 VAL HG1 . 11192 1 841 . 1 1 70 70 VAL HG12 H 1 0.987 0.030 . 1 . . . . 70 VAL HG1 . 11192 1 842 . 1 1 70 70 VAL HG13 H 1 0.987 0.030 . 1 . . . . 70 VAL HG1 . 11192 1 843 . 1 1 70 70 VAL HG21 H 1 0.989 0.030 . 1 . . . . 70 VAL HG2 . 11192 1 844 . 1 1 70 70 VAL HG22 H 1 0.989 0.030 . 1 . . . . 70 VAL HG2 . 11192 1 845 . 1 1 70 70 VAL HG23 H 1 0.989 0.030 . 1 . . . . 70 VAL HG2 . 11192 1 846 . 1 1 70 70 VAL C C 13 175.867 0.300 . 1 . . . . 70 VAL C . 11192 1 847 . 1 1 70 70 VAL CA C 13 64.483 0.300 . 1 . . . . 70 VAL CA . 11192 1 848 . 1 1 70 70 VAL CB C 13 32.007 0.300 . 1 . . . . 70 VAL CB . 11192 1 849 . 1 1 70 70 VAL CG1 C 13 22.245 0.300 . 2 . . . . 70 VAL CG1 . 11192 1 850 . 1 1 70 70 VAL CG2 C 13 24.130 0.300 . 2 . . . . 70 VAL CG2 . 11192 1 851 . 1 1 70 70 VAL N N 15 115.912 0.300 . 1 . . . . 70 VAL N . 11192 1 852 . 1 1 71 71 ARG H H 1 9.238 0.030 . 1 . . . . 71 ARG H . 11192 1 853 . 1 1 71 71 ARG HA H 1 4.779 0.030 . 1 . . . . 71 ARG HA . 11192 1 854 . 1 1 71 71 ARG HB2 H 1 1.419 0.030 . 2 . . . . 71 ARG HB2 . 11192 1 855 . 1 1 71 71 ARG HB3 H 1 2.059 0.030 . 2 . . . . 71 ARG HB3 . 11192 1 856 . 1 1 71 71 ARG HD2 H 1 3.160 0.030 . 2 . . . . 71 ARG HD2 . 11192 1 857 . 1 1 71 71 ARG HD3 H 1 3.206 0.030 . 2 . . . . 71 ARG HD3 . 11192 1 858 . 1 1 71 71 ARG HE H 1 6.903 0.030 . 1 . . . . 71 ARG HE . 11192 1 859 . 1 1 71 71 ARG HG2 H 1 1.787 0.030 . 1 . . . . 71 ARG HG2 . 11192 1 860 . 1 1 71 71 ARG HG3 H 1 1.787 0.030 . 1 . . . . 71 ARG HG3 . 11192 1 861 . 1 1 71 71 ARG C C 13 174.024 0.300 . 1 . . . . 71 ARG C . 11192 1 862 . 1 1 71 71 ARG CA C 13 52.809 0.300 . 1 . . . . 71 ARG CA . 11192 1 863 . 1 1 71 71 ARG CB C 13 30.918 0.300 . 1 . . . . 71 ARG CB . 11192 1 864 . 1 1 71 71 ARG CD C 13 43.345 0.300 . 1 . . . . 71 ARG CD . 11192 1 865 . 1 1 71 71 ARG CG C 13 25.911 0.300 . 1 . . . . 71 ARG CG . 11192 1 866 . 1 1 71 71 ARG N N 15 127.265 0.300 . 1 . . . . 71 ARG N . 11192 1 867 . 1 1 71 71 ARG NE N 15 85.281 0.300 . 1 . . . . 71 ARG NE . 11192 1 868 . 1 1 72 72 PRO HA H 1 2.684 0.030 . 1 . . . . 72 PRO HA . 11192 1 869 . 1 1 72 72 PRO HB2 H 1 1.820 0.030 . 2 . . . . 72 PRO HB2 . 11192 1 870 . 1 1 72 72 PRO HB3 H 1 1.572 0.030 . 2 . . . . 72 PRO HB3 . 11192 1 871 . 1 1 72 72 PRO HD2 H 1 3.328 0.030 . 2 . . . . 72 PRO HD2 . 11192 1 872 . 1 1 72 72 PRO HD3 H 1 3.579 0.030 . 2 . . . . 72 PRO HD3 . 11192 1 873 . 1 1 72 72 PRO HG2 H 1 1.931 0.030 . 2 . . . . 72 PRO HG2 . 11192 1 874 . 1 1 72 72 PRO HG3 H 1 1.493 0.030 . 2 . . . . 72 PRO HG3 . 11192 1 875 . 1 1 72 72 PRO C C 13 178.887 0.300 . 1 . . . . 72 PRO C . 11192 1 876 . 1 1 72 72 PRO CA C 13 65.278 0.300 . 1 . . . . 72 PRO CA . 11192 1 877 . 1 1 72 72 PRO CB C 13 30.748 0.300 . 1 . . . . 72 PRO CB . 11192 1 878 . 1 1 72 72 PRO CD C 13 49.382 0.300 . 1 . . . . 72 PRO CD . 11192 1 879 . 1 1 72 72 PRO CG C 13 26.864 0.300 . 1 . . . . 72 PRO CG . 11192 1 880 . 1 1 73 73 GLU H H 1 8.712 0.030 . 1 . . . . 73 GLU H . 11192 1 881 . 1 1 73 73 GLU HA H 1 4.156 0.030 . 1 . . . . 73 GLU HA . 11192 1 882 . 1 1 73 73 GLU HB2 H 1 2.014 0.030 . 1 . . . . 73 GLU HB2 . 11192 1 883 . 1 1 73 73 GLU HB3 H 1 2.014 0.030 . 1 . . . . 73 GLU HB3 . 11192 1 884 . 1 1 73 73 GLU HG2 H 1 2.166 0.030 . 1 . . . . 73 GLU HG2 . 11192 1 885 . 1 1 73 73 GLU HG3 H 1 2.166 0.030 . 1 . . . . 73 GLU HG3 . 11192 1 886 . 1 1 73 73 GLU C C 13 176.535 0.300 . 1 . . . . 73 GLU C . 11192 1 887 . 1 1 73 73 GLU CA C 13 58.037 0.300 . 1 . . . . 73 GLU CA . 11192 1 888 . 1 1 73 73 GLU CB C 13 28.234 0.300 . 1 . . . . 73 GLU CB . 11192 1 889 . 1 1 73 73 GLU CG C 13 35.976 0.300 . 1 . . . . 73 GLU CG . 11192 1 890 . 1 1 73 73 GLU N N 15 113.593 0.300 . 1 . . . . 73 GLU N . 11192 1 891 . 1 1 74 74 ASP H H 1 8.414 0.030 . 1 . . . . 74 ASP H . 11192 1 892 . 1 1 74 74 ASP HA H 1 4.521 0.030 . 1 . . . . 74 ASP HA . 11192 1 893 . 1 1 74 74 ASP HB2 H 1 2.961 0.030 . 2 . . . . 74 ASP HB2 . 11192 1 894 . 1 1 74 74 ASP HB3 H 1 2.701 0.030 . 2 . . . . 74 ASP HB3 . 11192 1 895 . 1 1 74 74 ASP C C 13 176.745 0.300 . 1 . . . . 74 ASP C . 11192 1 896 . 1 1 74 74 ASP CA C 13 55.733 0.300 . 1 . . . . 74 ASP CA . 11192 1 897 . 1 1 74 74 ASP CB C 13 41.428 0.300 . 1 . . . . 74 ASP CB . 11192 1 898 . 1 1 74 74 ASP N N 15 118.562 0.300 . 1 . . . . 74 ASP N . 11192 1 899 . 1 1 75 75 GLU H H 1 7.654 0.030 . 1 . . . . 75 GLU H . 11192 1 900 . 1 1 75 75 GLU HA H 1 4.377 0.030 . 1 . . . . 75 GLU HA . 11192 1 901 . 1 1 75 75 GLU HB2 H 1 2.168 0.030 . 2 . . . . 75 GLU HB2 . 11192 1 902 . 1 1 75 75 GLU HB3 H 1 2.247 0.030 . 2 . . . . 75 GLU HB3 . 11192 1 903 . 1 1 75 75 GLU HG2 H 1 2.387 0.030 . 2 . . . . 75 GLU HG2 . 11192 1 904 . 1 1 75 75 GLU HG3 H 1 2.997 0.030 . 2 . . . . 75 GLU HG3 . 11192 1 905 . 1 1 75 75 GLU C C 13 175.078 0.300 . 1 . . . . 75 GLU C . 11192 1 906 . 1 1 75 75 GLU CA C 13 57.704 0.300 . 1 . . . . 75 GLU CA . 11192 1 907 . 1 1 75 75 GLU CB C 13 30.367 0.300 . 1 . . . . 75 GLU CB . 11192 1 908 . 1 1 75 75 GLU CG C 13 36.413 0.300 . 1 . . . . 75 GLU CG . 11192 1 909 . 1 1 75 75 GLU N N 15 121.131 0.300 . 1 . . . . 75 GLU N . 11192 1 910 . 1 1 76 76 GLY H H 1 8.212 0.030 . 1 . . . . 76 GLY H . 11192 1 911 . 1 1 76 76 GLY HA2 H 1 4.139 0.030 . 2 . . . . 76 GLY HA2 . 11192 1 912 . 1 1 76 76 GLY HA3 H 1 4.211 0.030 . 2 . . . . 76 GLY HA3 . 11192 1 913 . 1 1 76 76 GLY C C 13 170.496 0.300 . 1 . . . . 76 GLY C . 11192 1 914 . 1 1 76 76 GLY CA C 13 44.816 0.300 . 1 . . . . 76 GLY CA . 11192 1 915 . 1 1 76 76 GLY N N 15 109.523 0.300 . 1 . . . . 76 GLY N . 11192 1 916 . 1 1 77 77 ASP H H 1 8.166 0.030 . 1 . . . . 77 ASP H . 11192 1 917 . 1 1 77 77 ASP HA H 1 5.154 0.030 . 1 . . . . 77 ASP HA . 11192 1 918 . 1 1 77 77 ASP HB2 H 1 2.567 0.030 . 2 . . . . 77 ASP HB2 . 11192 1 919 . 1 1 77 77 ASP HB3 H 1 2.513 0.030 . 2 . . . . 77 ASP HB3 . 11192 1 920 . 1 1 77 77 ASP C C 13 175.130 0.300 . 1 . . . . 77 ASP C . 11192 1 921 . 1 1 77 77 ASP CA C 13 53.841 0.300 . 1 . . . . 77 ASP CA . 11192 1 922 . 1 1 77 77 ASP CB C 13 41.796 0.300 . 1 . . . . 77 ASP CB . 11192 1 923 . 1 1 77 77 ASP N N 15 119.499 0.300 . 1 . . . . 77 ASP N . 11192 1 924 . 1 1 78 78 TYR H H 1 9.743 0.030 . 1 . . . . 78 TYR H . 11192 1 925 . 1 1 78 78 TYR HA H 1 5.544 0.030 . 1 . . . . 78 TYR HA . 11192 1 926 . 1 1 78 78 TYR HB2 H 1 2.314 0.030 . 1 . . . . 78 TYR HB2 . 11192 1 927 . 1 1 78 78 TYR HB3 H 1 2.314 0.030 . 1 . . . . 78 TYR HB3 . 11192 1 928 . 1 1 78 78 TYR HD1 H 1 6.923 0.030 . 1 . . . . 78 TYR HD1 . 11192 1 929 . 1 1 78 78 TYR HD2 H 1 6.923 0.030 . 1 . . . . 78 TYR HD2 . 11192 1 930 . 1 1 78 78 TYR HE1 H 1 6.737 0.030 . 1 . . . . 78 TYR HE1 . 11192 1 931 . 1 1 78 78 TYR HE2 H 1 6.737 0.030 . 1 . . . . 78 TYR HE2 . 11192 1 932 . 1 1 78 78 TYR C C 13 175.218 0.300 . 1 . . . . 78 TYR C . 11192 1 933 . 1 1 78 78 TYR CA C 13 57.022 0.300 . 1 . . . . 78 TYR CA . 11192 1 934 . 1 1 78 78 TYR CB C 13 39.859 0.300 . 1 . . . . 78 TYR CB . 11192 1 935 . 1 1 78 78 TYR CD1 C 13 133.099 0.300 . 1 . . . . 78 TYR CD1 . 11192 1 936 . 1 1 78 78 TYR CD2 C 13 133.099 0.300 . 1 . . . . 78 TYR CD2 . 11192 1 937 . 1 1 78 78 TYR CE1 C 13 116.483 0.300 . 1 . . . . 78 TYR CE1 . 11192 1 938 . 1 1 78 78 TYR CE2 C 13 116.483 0.300 . 1 . . . . 78 TYR CE2 . 11192 1 939 . 1 1 78 78 TYR N N 15 127.663 0.300 . 1 . . . . 78 TYR N . 11192 1 940 . 1 1 79 79 THR H H 1 9.227 0.030 . 1 . . . . 79 THR H . 11192 1 941 . 1 1 79 79 THR HA H 1 5.653 0.030 . 1 . . . . 79 THR HA . 11192 1 942 . 1 1 79 79 THR HB H 1 3.810 0.030 . 1 . . . . 79 THR HB . 11192 1 943 . 1 1 79 79 THR HG21 H 1 1.015 0.030 . 1 . . . . 79 THR HG2 . 11192 1 944 . 1 1 79 79 THR HG22 H 1 1.015 0.030 . 1 . . . . 79 THR HG2 . 11192 1 945 . 1 1 79 79 THR HG23 H 1 1.015 0.030 . 1 . . . . 79 THR HG2 . 11192 1 946 . 1 1 79 79 THR C C 13 172.971 0.300 . 1 . . . . 79 THR C . 11192 1 947 . 1 1 79 79 THR CA C 13 58.668 0.300 . 1 . . . . 79 THR CA . 11192 1 948 . 1 1 79 79 THR CB C 13 72.873 0.300 . 1 . . . . 79 THR CB . 11192 1 949 . 1 1 79 79 THR CG2 C 13 22.784 0.300 . 1 . . . . 79 THR CG2 . 11192 1 950 . 1 1 79 79 THR N N 15 113.678 0.300 . 1 . . . . 79 THR N . 11192 1 951 . 1 1 80 80 PHE H H 1 8.760 0.030 . 1 . . . . 80 PHE H . 11192 1 952 . 1 1 80 80 PHE HA H 1 4.628 0.030 . 1 . . . . 80 PHE HA . 11192 1 953 . 1 1 80 80 PHE HB2 H 1 1.027 0.030 . 2 . . . . 80 PHE HB2 . 11192 1 954 . 1 1 80 80 PHE HB3 H 1 1.918 0.030 . 2 . . . . 80 PHE HB3 . 11192 1 955 . 1 1 80 80 PHE HD1 H 1 5.501 0.030 . 1 . . . . 80 PHE HD1 . 11192 1 956 . 1 1 80 80 PHE HD2 H 1 5.501 0.030 . 1 . . . . 80 PHE HD2 . 11192 1 957 . 1 1 80 80 PHE HE1 H 1 6.073 0.030 . 1 . . . . 80 PHE HE1 . 11192 1 958 . 1 1 80 80 PHE HE2 H 1 6.073 0.030 . 1 . . . . 80 PHE HE2 . 11192 1 959 . 1 1 80 80 PHE HZ H 1 5.144 0.030 . 1 . . . . 80 PHE HZ . 11192 1 960 . 1 1 80 80 PHE C C 13 173.796 0.300 . 1 . . . . 80 PHE C . 11192 1 961 . 1 1 80 80 PHE CA C 13 55.788 0.300 . 1 . . . . 80 PHE CA . 11192 1 962 . 1 1 80 80 PHE CB C 13 40.496 0.300 . 1 . . . . 80 PHE CB . 11192 1 963 . 1 1 80 80 PHE CD1 C 13 131.105 0.300 . 1 . . . . 80 PHE CD1 . 11192 1 964 . 1 1 80 80 PHE CD2 C 13 131.105 0.300 . 1 . . . . 80 PHE CD2 . 11192 1 965 . 1 1 80 80 PHE CE1 C 13 128.296 0.300 . 1 . . . . 80 PHE CE1 . 11192 1 966 . 1 1 80 80 PHE CE2 C 13 128.296 0.300 . 1 . . . . 80 PHE CE2 . 11192 1 967 . 1 1 80 80 PHE CZ C 13 126.585 0.300 . 1 . . . . 80 PHE CZ . 11192 1 968 . 1 1 80 80 PHE N N 15 123.478 0.300 . 1 . . . . 80 PHE N . 11192 1 969 . 1 1 81 81 VAL H H 1 8.099 0.030 . 1 . . . . 81 VAL H . 11192 1 970 . 1 1 81 81 VAL HA H 1 4.384 0.030 . 1 . . . . 81 VAL HA . 11192 1 971 . 1 1 81 81 VAL HB H 1 1.825 0.030 . 1 . . . . 81 VAL HB . 11192 1 972 . 1 1 81 81 VAL HG11 H 1 0.843 0.030 . 1 . . . . 81 VAL HG1 . 11192 1 973 . 1 1 81 81 VAL HG12 H 1 0.843 0.030 . 1 . . . . 81 VAL HG1 . 11192 1 974 . 1 1 81 81 VAL HG13 H 1 0.843 0.030 . 1 . . . . 81 VAL HG1 . 11192 1 975 . 1 1 81 81 VAL HG21 H 1 0.712 0.030 . 1 . . . . 81 VAL HG2 . 11192 1 976 . 1 1 81 81 VAL HG22 H 1 0.712 0.030 . 1 . . . . 81 VAL HG2 . 11192 1 977 . 1 1 81 81 VAL HG23 H 1 0.712 0.030 . 1 . . . . 81 VAL HG2 . 11192 1 978 . 1 1 81 81 VAL C C 13 174.165 0.300 . 1 . . . . 81 VAL C . 11192 1 979 . 1 1 81 81 VAL CA C 13 57.799 0.300 . 1 . . . . 81 VAL CA . 11192 1 980 . 1 1 81 81 VAL CB C 13 34.241 0.300 . 1 . . . . 81 VAL CB . 11192 1 981 . 1 1 81 81 VAL CG1 C 13 20.496 0.300 . 2 . . . . 81 VAL CG1 . 11192 1 982 . 1 1 81 81 VAL CG2 C 13 20.837 0.300 . 2 . . . . 81 VAL CG2 . 11192 1 983 . 1 1 81 81 VAL N N 15 126.465 0.300 . 1 . . . . 81 VAL N . 11192 1 984 . 1 1 82 82 PRO HA H 1 4.182 0.030 . 1 . . . . 82 PRO HA . 11192 1 985 . 1 1 82 82 PRO HB2 H 1 1.774 0.030 . 2 . . . . 82 PRO HB2 . 11192 1 986 . 1 1 82 82 PRO HB3 H 1 1.699 0.030 . 2 . . . . 82 PRO HB3 . 11192 1 987 . 1 1 82 82 PRO HD2 H 1 3.915 0.030 . 2 . . . . 82 PRO HD2 . 11192 1 988 . 1 1 82 82 PRO HD3 H 1 3.121 0.030 . 2 . . . . 82 PRO HD3 . 11192 1 989 . 1 1 82 82 PRO HG2 H 1 1.879 0.030 . 2 . . . . 82 PRO HG2 . 11192 1 990 . 1 1 82 82 PRO HG3 H 1 1.380 0.030 . 2 . . . . 82 PRO HG3 . 11192 1 991 . 1 1 82 82 PRO C C 13 175.657 0.300 . 1 . . . . 82 PRO C . 11192 1 992 . 1 1 82 82 PRO CA C 13 61.191 0.300 . 1 . . . . 82 PRO CA . 11192 1 993 . 1 1 82 82 PRO CB C 13 31.735 0.300 . 1 . . . . 82 PRO CB . 11192 1 994 . 1 1 82 82 PRO CD C 13 50.381 0.300 . 1 . . . . 82 PRO CD . 11192 1 995 . 1 1 82 82 PRO CG C 13 26.770 0.300 . 1 . . . . 82 PRO CG . 11192 1 996 . 1 1 83 83 ASP H H 1 9.301 0.030 . 1 . . . . 83 ASP H . 11192 1 997 . 1 1 83 83 ASP HA H 1 4.434 0.030 . 1 . . . . 83 ASP HA . 11192 1 998 . 1 1 83 83 ASP HB2 H 1 2.499 0.030 . 1 . . . . 83 ASP HB2 . 11192 1 999 . 1 1 83 83 ASP HB3 H 1 2.499 0.030 . 1 . . . . 83 ASP HB3 . 11192 1 1000 . 1 1 83 83 ASP C C 13 177.026 0.300 . 1 . . . . 83 ASP C . 11192 1 1001 . 1 1 83 83 ASP CA C 13 55.514 0.300 . 1 . . . . 83 ASP CA . 11192 1 1002 . 1 1 83 83 ASP CB C 13 40.397 0.300 . 1 . . . . 83 ASP CB . 11192 1 1003 . 1 1 83 83 ASP N N 15 125.281 0.300 . 1 . . . . 83 ASP N . 11192 1 1004 . 1 1 84 84 GLY H H 1 8.523 0.030 . 1 . . . . 84 GLY H . 11192 1 1005 . 1 1 84 84 GLY HA2 H 1 3.930 0.030 . 2 . . . . 84 GLY HA2 . 11192 1 1006 . 1 1 84 84 GLY HA3 H 1 3.521 0.030 . 2 . . . . 84 GLY HA3 . 11192 1 1007 . 1 1 84 84 GLY C C 13 173.445 0.300 . 1 . . . . 84 GLY C . 11192 1 1008 . 1 1 84 84 GLY CA C 13 45.228 0.300 . 1 . . . . 84 GLY CA . 11192 1 1009 . 1 1 84 84 GLY N N 15 110.386 0.300 . 1 . . . . 84 GLY N . 11192 1 1010 . 1 1 85 85 TYR H H 1 7.245 0.030 . 1 . . . . 85 TYR H . 11192 1 1011 . 1 1 85 85 TYR HA H 1 4.616 0.030 . 1 . . . . 85 TYR HA . 11192 1 1012 . 1 1 85 85 TYR HB2 H 1 2.437 0.030 . 2 . . . . 85 TYR HB2 . 11192 1 1013 . 1 1 85 85 TYR HB3 H 1 2.962 0.030 . 2 . . . . 85 TYR HB3 . 11192 1 1014 . 1 1 85 85 TYR HD1 H 1 6.983 0.030 . 1 . . . . 85 TYR HD1 . 11192 1 1015 . 1 1 85 85 TYR HD2 H 1 6.983 0.030 . 1 . . . . 85 TYR HD2 . 11192 1 1016 . 1 1 85 85 TYR HE1 H 1 6.797 0.030 . 1 . . . . 85 TYR HE1 . 11192 1 1017 . 1 1 85 85 TYR HE2 H 1 6.797 0.030 . 1 . . . . 85 TYR HE2 . 11192 1 1018 . 1 1 85 85 TYR C C 13 174.358 0.300 . 1 . . . . 85 TYR C . 11192 1 1019 . 1 1 85 85 TYR CA C 13 57.230 0.300 . 1 . . . . 85 TYR CA . 11192 1 1020 . 1 1 85 85 TYR CB C 13 41.611 0.300 . 1 . . . . 85 TYR CB . 11192 1 1021 . 1 1 85 85 TYR CD1 C 13 133.516 0.300 . 1 . . . . 85 TYR CD1 . 11192 1 1022 . 1 1 85 85 TYR CD2 C 13 133.516 0.300 . 1 . . . . 85 TYR CD2 . 11192 1 1023 . 1 1 85 85 TYR CE1 C 13 118.220 0.300 . 1 . . . . 85 TYR CE1 . 11192 1 1024 . 1 1 85 85 TYR CE2 C 13 118.220 0.300 . 1 . . . . 85 TYR CE2 . 11192 1 1025 . 1 1 85 85 TYR N N 15 116.808 0.300 . 1 . . . . 85 TYR N . 11192 1 1026 . 1 1 86 86 ALA H H 1 8.613 0.030 . 1 . . . . 86 ALA H . 11192 1 1027 . 1 1 86 86 ALA HA H 1 4.511 0.030 . 1 . . . . 86 ALA HA . 11192 1 1028 . 1 1 86 86 ALA HB1 H 1 1.295 0.030 . 1 . . . . 86 ALA HB . 11192 1 1029 . 1 1 86 86 ALA HB2 H 1 1.295 0.030 . 1 . . . . 86 ALA HB . 11192 1 1030 . 1 1 86 86 ALA HB3 H 1 1.295 0.030 . 1 . . . . 86 ALA HB . 11192 1 1031 . 1 1 86 86 ALA C C 13 175.885 0.300 . 1 . . . . 86 ALA C . 11192 1 1032 . 1 1 86 86 ALA CA C 13 50.961 0.300 . 1 . . . . 86 ALA CA . 11192 1 1033 . 1 1 86 86 ALA CB C 13 17.173 0.300 . 1 . . . . 86 ALA CB . 11192 1 1034 . 1 1 86 86 ALA N N 15 125.670 0.300 . 1 . . . . 86 ALA N . 11192 1 1035 . 1 1 87 87 LEU H H 1 7.513 0.030 . 1 . . . . 87 LEU H . 11192 1 1036 . 1 1 87 87 LEU HA H 1 4.527 0.030 . 1 . . . . 87 LEU HA . 11192 1 1037 . 1 1 87 87 LEU HB2 H 1 1.438 0.030 . 2 . . . . 87 LEU HB2 . 11192 1 1038 . 1 1 87 87 LEU HB3 H 1 1.404 0.030 . 2 . . . . 87 LEU HB3 . 11192 1 1039 . 1 1 87 87 LEU HD11 H 1 0.777 0.030 . 1 . . . . 87 LEU HD1 . 11192 1 1040 . 1 1 87 87 LEU HD12 H 1 0.777 0.030 . 1 . . . . 87 LEU HD1 . 11192 1 1041 . 1 1 87 87 LEU HD13 H 1 0.777 0.030 . 1 . . . . 87 LEU HD1 . 11192 1 1042 . 1 1 87 87 LEU HD21 H 1 0.784 0.030 . 1 . . . . 87 LEU HD2 . 11192 1 1043 . 1 1 87 87 LEU HD22 H 1 0.784 0.030 . 1 . . . . 87 LEU HD2 . 11192 1 1044 . 1 1 87 87 LEU HD23 H 1 0.784 0.030 . 1 . . . . 87 LEU HD2 . 11192 1 1045 . 1 1 87 87 LEU HG H 1 1.442 0.030 . 1 . . . . 87 LEU HG . 11192 1 1046 . 1 1 87 87 LEU C C 13 174.446 0.300 . 1 . . . . 87 LEU C . 11192 1 1047 . 1 1 87 87 LEU CA C 13 54.135 0.300 . 1 . . . . 87 LEU CA . 11192 1 1048 . 1 1 87 87 LEU CB C 13 45.250 0.300 . 1 . . . . 87 LEU CB . 11192 1 1049 . 1 1 87 87 LEU CD1 C 13 24.824 0.300 . 2 . . . . 87 LEU CD1 . 11192 1 1050 . 1 1 87 87 LEU CD2 C 13 25.115 0.300 . 2 . . . . 87 LEU CD2 . 11192 1 1051 . 1 1 87 87 LEU CG C 13 26.825 0.300 . 1 . . . . 87 LEU CG . 11192 1 1052 . 1 1 87 87 LEU N N 15 121.598 0.300 . 1 . . . . 87 LEU N . 11192 1 1053 . 1 1 88 88 SER H H 1 8.112 0.030 . 1 . . . . 88 SER H . 11192 1 1054 . 1 1 88 88 SER HA H 1 4.745 0.030 . 1 . . . . 88 SER HA . 11192 1 1055 . 1 1 88 88 SER HB2 H 1 3.554 0.030 . 2 . . . . 88 SER HB2 . 11192 1 1056 . 1 1 88 88 SER HB3 H 1 3.642 0.030 . 2 . . . . 88 SER HB3 . 11192 1 1057 . 1 1 88 88 SER C C 13 172.708 0.300 . 1 . . . . 88 SER C . 11192 1 1058 . 1 1 88 88 SER CA C 13 57.077 0.300 . 1 . . . . 88 SER CA . 11192 1 1059 . 1 1 88 88 SER CB C 13 64.532 0.300 . 1 . . . . 88 SER CB . 11192 1 1060 . 1 1 88 88 SER N N 15 114.326 0.300 . 1 . . . . 88 SER N . 11192 1 1061 . 1 1 89 89 LEU H H 1 8.737 0.030 . 1 . . . . 89 LEU H . 11192 1 1062 . 1 1 89 89 LEU HA H 1 4.883 0.030 . 1 . . . . 89 LEU HA . 11192 1 1063 . 1 1 89 89 LEU HB2 H 1 1.800 0.030 . 2 . . . . 89 LEU HB2 . 11192 1 1064 . 1 1 89 89 LEU HB3 H 1 1.939 0.030 . 2 . . . . 89 LEU HB3 . 11192 1 1065 . 1 1 89 89 LEU HD11 H 1 1.017 0.030 . 1 . . . . 89 LEU HD1 . 11192 1 1066 . 1 1 89 89 LEU HD12 H 1 1.017 0.030 . 1 . . . . 89 LEU HD1 . 11192 1 1067 . 1 1 89 89 LEU HD13 H 1 1.017 0.030 . 1 . . . . 89 LEU HD1 . 11192 1 1068 . 1 1 89 89 LEU HD21 H 1 0.932 0.030 . 1 . . . . 89 LEU HD2 . 11192 1 1069 . 1 1 89 89 LEU HD22 H 1 0.932 0.030 . 1 . . . . 89 LEU HD2 . 11192 1 1070 . 1 1 89 89 LEU HD23 H 1 0.932 0.030 . 1 . . . . 89 LEU HD2 . 11192 1 1071 . 1 1 89 89 LEU HG H 1 1.752 0.030 . 1 . . . . 89 LEU HG . 11192 1 1072 . 1 1 89 89 LEU C C 13 175.393 0.300 . 1 . . . . 89 LEU C . 11192 1 1073 . 1 1 89 89 LEU CA C 13 54.362 0.300 . 1 . . . . 89 LEU CA . 11192 1 1074 . 1 1 89 89 LEU CB C 13 42.098 0.300 . 1 . . . . 89 LEU CB . 11192 1 1075 . 1 1 89 89 LEU CD1 C 13 24.254 0.300 . 2 . . . . 89 LEU CD1 . 11192 1 1076 . 1 1 89 89 LEU CD2 C 13 25.182 0.300 . 2 . . . . 89 LEU CD2 . 11192 1 1077 . 1 1 89 89 LEU CG C 13 28.040 0.300 . 1 . . . . 89 LEU CG . 11192 1 1078 . 1 1 89 89 LEU N N 15 126.704 0.300 . 1 . . . . 89 LEU N . 11192 1 1079 . 1 1 90 90 SER H H 1 8.764 0.030 . 1 . . . . 90 SER H . 11192 1 1080 . 1 1 90 90 SER HA H 1 5.672 0.030 . 1 . . . . 90 SER HA . 11192 1 1081 . 1 1 90 90 SER HB2 H 1 3.648 0.030 . 2 . . . . 90 SER HB2 . 11192 1 1082 . 1 1 90 90 SER HB3 H 1 3.710 0.030 . 2 . . . . 90 SER HB3 . 11192 1 1083 . 1 1 90 90 SER C C 13 172.813 0.300 . 1 . . . . 90 SER C . 11192 1 1084 . 1 1 90 90 SER CA C 13 56.913 0.300 . 1 . . . . 90 SER CA . 11192 1 1085 . 1 1 90 90 SER CB C 13 66.526 0.300 . 1 . . . . 90 SER CB . 11192 1 1086 . 1 1 90 90 SER N N 15 116.262 0.300 . 1 . . . . 90 SER N . 11192 1 1087 . 1 1 91 91 ALA H H 1 9.242 0.030 . 1 . . . . 91 ALA H . 11192 1 1088 . 1 1 91 91 ALA HA H 1 4.673 0.030 . 1 . . . . 91 ALA HA . 11192 1 1089 . 1 1 91 91 ALA HB1 H 1 1.369 0.030 . 1 . . . . 91 ALA HB . 11192 1 1090 . 1 1 91 91 ALA HB2 H 1 1.369 0.030 . 1 . . . . 91 ALA HB . 11192 1 1091 . 1 1 91 91 ALA HB3 H 1 1.369 0.030 . 1 . . . . 91 ALA HB . 11192 1 1092 . 1 1 91 91 ALA C C 13 174.516 0.300 . 1 . . . . 91 ALA C . 11192 1 1093 . 1 1 91 91 ALA CA C 13 51.784 0.300 . 1 . . . . 91 ALA CA . 11192 1 1094 . 1 1 91 91 ALA CB C 13 23.500 0.300 . 1 . . . . 91 ALA CB . 11192 1 1095 . 1 1 91 91 ALA N N 15 125.708 0.300 . 1 . . . . 91 ALA N . 11192 1 1096 . 1 1 92 92 LYS H H 1 9.100 0.030 . 1 . . . . 92 LYS H . 11192 1 1097 . 1 1 92 92 LYS HA H 1 5.254 0.030 . 1 . . . . 92 LYS HA . 11192 1 1098 . 1 1 92 92 LYS HB2 H 1 1.672 0.030 . 2 . . . . 92 LYS HB2 . 11192 1 1099 . 1 1 92 92 LYS HB3 H 1 1.807 0.030 . 2 . . . . 92 LYS HB3 . 11192 1 1100 . 1 1 92 92 LYS HD2 H 1 1.720 0.030 . 1 . . . . 92 LYS HD2 . 11192 1 1101 . 1 1 92 92 LYS HD3 H 1 1.720 0.030 . 1 . . . . 92 LYS HD3 . 11192 1 1102 . 1 1 92 92 LYS HE2 H 1 2.812 0.030 . 2 . . . . 92 LYS HE2 . 11192 1 1103 . 1 1 92 92 LYS HG2 H 1 1.405 0.030 . 2 . . . . 92 LYS HG2 . 11192 1 1104 . 1 1 92 92 LYS HG3 H 1 1.519 0.030 . 2 . . . . 92 LYS HG3 . 11192 1 1105 . 1 1 92 92 LYS C C 13 175.376 0.300 . 1 . . . . 92 LYS C . 11192 1 1106 . 1 1 92 92 LYS CA C 13 54.938 0.300 . 1 . . . . 92 LYS CA . 11192 1 1107 . 1 1 92 92 LYS CB C 13 35.284 0.300 . 1 . . . . 92 LYS CB . 11192 1 1108 . 1 1 92 92 LYS CD C 13 28.759 0.300 . 1 . . . . 92 LYS CD . 11192 1 1109 . 1 1 92 92 LYS CE C 13 42.010 0.300 . 1 . . . . 92 LYS CE . 11192 1 1110 . 1 1 92 92 LYS CG C 13 24.989 0.300 . 1 . . . . 92 LYS CG . 11192 1 1111 . 1 1 92 92 LYS N N 15 120.550 0.300 . 1 . . . . 92 LYS N . 11192 1 1112 . 1 1 93 93 LEU H H 1 8.966 0.030 . 1 . . . . 93 LEU H . 11192 1 1113 . 1 1 93 93 LEU HA H 1 5.076 0.030 . 1 . . . . 93 LEU HA . 11192 1 1114 . 1 1 93 93 LEU HB2 H 1 2.451 0.030 . 2 . . . . 93 LEU HB2 . 11192 1 1115 . 1 1 93 93 LEU HB3 H 1 1.828 0.030 . 2 . . . . 93 LEU HB3 . 11192 1 1116 . 1 1 93 93 LEU HD11 H 1 0.784 0.030 . 1 . . . . 93 LEU HD1 . 11192 1 1117 . 1 1 93 93 LEU HD12 H 1 0.784 0.030 . 1 . . . . 93 LEU HD1 . 11192 1 1118 . 1 1 93 93 LEU HD13 H 1 0.784 0.030 . 1 . . . . 93 LEU HD1 . 11192 1 1119 . 1 1 93 93 LEU HD21 H 1 0.697 0.030 . 1 . . . . 93 LEU HD2 . 11192 1 1120 . 1 1 93 93 LEU HD22 H 1 0.697 0.030 . 1 . . . . 93 LEU HD2 . 11192 1 1121 . 1 1 93 93 LEU HD23 H 1 0.697 0.030 . 1 . . . . 93 LEU HD2 . 11192 1 1122 . 1 1 93 93 LEU HG H 1 1.459 0.030 . 1 . . . . 93 LEU HG . 11192 1 1123 . 1 1 93 93 LEU C C 13 175.446 0.300 . 1 . . . . 93 LEU C . 11192 1 1124 . 1 1 93 93 LEU CA C 13 55.211 0.300 . 1 . . . . 93 LEU CA . 11192 1 1125 . 1 1 93 93 LEU CB C 13 44.456 0.300 . 1 . . . . 93 LEU CB . 11192 1 1126 . 1 1 93 93 LEU CD1 C 13 26.749 0.300 . 2 . . . . 93 LEU CD1 . 11192 1 1127 . 1 1 93 93 LEU CD2 C 13 23.905 0.300 . 2 . . . . 93 LEU CD2 . 11192 1 1128 . 1 1 93 93 LEU CG C 13 29.200 0.300 . 1 . . . . 93 LEU CG . 11192 1 1129 . 1 1 93 93 LEU N N 15 123.641 0.300 . 1 . . . . 93 LEU N . 11192 1 1130 . 1 1 94 94 ASN H H 1 9.270 0.030 . 1 . . . . 94 ASN H . 11192 1 1131 . 1 1 94 94 ASN HA H 1 5.144 0.030 . 1 . . . . 94 ASN HA . 11192 1 1132 . 1 1 94 94 ASN HB2 H 1 2.731 0.030 . 2 . . . . 94 ASN HB2 . 11192 1 1133 . 1 1 94 94 ASN HB3 H 1 3.051 0.030 . 2 . . . . 94 ASN HB3 . 11192 1 1134 . 1 1 94 94 ASN HD21 H 1 6.995 0.030 . 2 . . . . 94 ASN HD21 . 11192 1 1135 . 1 1 94 94 ASN HD22 H 1 7.068 0.030 . 2 . . . . 94 ASN HD22 . 11192 1 1136 . 1 1 94 94 ASN C C 13 172.480 0.300 . 1 . . . . 94 ASN C . 11192 1 1137 . 1 1 94 94 ASN CA C 13 52.305 0.300 . 1 . . . . 94 ASN CA . 11192 1 1138 . 1 1 94 94 ASN CB C 13 40.588 0.300 . 1 . . . . 94 ASN CB . 11192 1 1139 . 1 1 94 94 ASN N N 15 125.048 0.300 . 1 . . . . 94 ASN N . 11192 1 1140 . 1 1 94 94 ASN ND2 N 15 113.815 0.300 . 1 . . . . 94 ASN ND2 . 11192 1 1141 . 1 1 95 95 PHE H H 1 9.398 0.030 . 1 . . . . 95 PHE H . 11192 1 1142 . 1 1 95 95 PHE HA H 1 4.875 0.030 . 1 . . . . 95 PHE HA . 11192 1 1143 . 1 1 95 95 PHE HB2 H 1 2.608 0.030 . 2 . . . . 95 PHE HB2 . 11192 1 1144 . 1 1 95 95 PHE HB3 H 1 3.154 0.030 . 2 . . . . 95 PHE HB3 . 11192 1 1145 . 1 1 95 95 PHE HD1 H 1 6.912 0.030 . 1 . . . . 95 PHE HD1 . 11192 1 1146 . 1 1 95 95 PHE HD2 H 1 6.912 0.030 . 1 . . . . 95 PHE HD2 . 11192 1 1147 . 1 1 95 95 PHE HE1 H 1 7.055 0.030 . 1 . . . . 95 PHE HE1 . 11192 1 1148 . 1 1 95 95 PHE HE2 H 1 7.055 0.030 . 1 . . . . 95 PHE HE2 . 11192 1 1149 . 1 1 95 95 PHE HZ H 1 7.271 0.030 . 1 . . . . 95 PHE HZ . 11192 1 1150 . 1 1 95 95 PHE C C 13 174.252 0.300 . 1 . . . . 95 PHE C . 11192 1 1151 . 1 1 95 95 PHE CA C 13 57.192 0.300 . 1 . . . . 95 PHE CA . 11192 1 1152 . 1 1 95 95 PHE CB C 13 41.576 0.300 . 1 . . . . 95 PHE CB . 11192 1 1153 . 1 1 95 95 PHE CD1 C 13 131.628 0.300 . 1 . . . . 95 PHE CD1 . 11192 1 1154 . 1 1 95 95 PHE CD2 C 13 131.628 0.300 . 1 . . . . 95 PHE CD2 . 11192 1 1155 . 1 1 95 95 PHE CE1 C 13 130.318 0.300 . 1 . . . . 95 PHE CE1 . 11192 1 1156 . 1 1 95 95 PHE CE2 C 13 130.318 0.300 . 1 . . . . 95 PHE CE2 . 11192 1 1157 . 1 1 95 95 PHE CZ C 13 129.245 0.300 . 1 . . . . 95 PHE CZ . 11192 1 1158 . 1 1 95 95 PHE N N 15 126.161 0.300 . 1 . . . . 95 PHE N . 11192 1 1159 . 1 1 96 96 LEU H H 1 8.199 0.030 . 1 . . . . 96 LEU H . 11192 1 1160 . 1 1 96 96 LEU HA H 1 4.354 0.030 . 1 . . . . 96 LEU HA . 11192 1 1161 . 1 1 96 96 LEU HB2 H 1 1.027 0.030 . 2 . . . . 96 LEU HB2 . 11192 1 1162 . 1 1 96 96 LEU HB3 H 1 1.301 0.030 . 2 . . . . 96 LEU HB3 . 11192 1 1163 . 1 1 96 96 LEU HD11 H 1 0.779 0.030 . 1 . . . . 96 LEU HD1 . 11192 1 1164 . 1 1 96 96 LEU HD12 H 1 0.779 0.030 . 1 . . . . 96 LEU HD1 . 11192 1 1165 . 1 1 96 96 LEU HD13 H 1 0.779 0.030 . 1 . . . . 96 LEU HD1 . 11192 1 1166 . 1 1 96 96 LEU HD21 H 1 0.724 0.030 . 1 . . . . 96 LEU HD2 . 11192 1 1167 . 1 1 96 96 LEU HD22 H 1 0.724 0.030 . 1 . . . . 96 LEU HD2 . 11192 1 1168 . 1 1 96 96 LEU HD23 H 1 0.724 0.030 . 1 . . . . 96 LEU HD2 . 11192 1 1169 . 1 1 96 96 LEU HG H 1 1.244 0.030 . 1 . . . . 96 LEU HG . 11192 1 1170 . 1 1 96 96 LEU C C 13 173.656 0.300 . 1 . . . . 96 LEU C . 11192 1 1171 . 1 1 96 96 LEU CA C 13 53.594 0.300 . 1 . . . . 96 LEU CA . 11192 1 1172 . 1 1 96 96 LEU CB C 13 43.153 0.300 . 1 . . . . 96 LEU CB . 11192 1 1173 . 1 1 96 96 LEU CD1 C 13 23.916 0.300 . 2 . . . . 96 LEU CD1 . 11192 1 1174 . 1 1 96 96 LEU CD2 C 13 24.431 0.300 . 2 . . . . 96 LEU CD2 . 11192 1 1175 . 1 1 96 96 LEU CG C 13 26.493 0.300 . 1 . . . . 96 LEU CG . 11192 1 1176 . 1 1 96 96 LEU N N 15 131.059 0.300 . 1 . . . . 96 LEU N . 11192 1 1177 . 1 1 97 97 GLU H H 1 8.307 0.030 . 1 . . . . 97 GLU H . 11192 1 1178 . 1 1 97 97 GLU HA H 1 4.219 0.030 . 1 . . . . 97 GLU HA . 11192 1 1179 . 1 1 97 97 GLU HB2 H 1 2.007 0.030 . 2 . . . . 97 GLU HB2 . 11192 1 1180 . 1 1 97 97 GLU HB3 H 1 2.059 0.030 . 2 . . . . 97 GLU HB3 . 11192 1 1181 . 1 1 97 97 GLU HG2 H 1 2.234 0.030 . 2 . . . . 97 GLU HG2 . 11192 1 1182 . 1 1 97 97 GLU HG3 H 1 2.323 0.030 . 2 . . . . 97 GLU HG3 . 11192 1 1183 . 1 1 97 97 GLU C C 13 175.464 0.300 . 1 . . . . 97 GLU C . 11192 1 1184 . 1 1 97 97 GLU CA C 13 55.569 0.300 . 1 . . . . 97 GLU CA . 11192 1 1185 . 1 1 97 97 GLU CB C 13 30.887 0.300 . 1 . . . . 97 GLU CB . 11192 1 1186 . 1 1 97 97 GLU CG C 13 36.203 0.300 . 1 . . . . 97 GLU CG . 11192 1 1187 . 1 1 97 97 GLU N N 15 124.717 0.300 . 1 . . . . 97 GLU N . 11192 1 1188 . 1 1 98 98 ILE H H 1 8.212 0.030 . 1 . . . . 98 ILE H . 11192 1 1189 . 1 1 98 98 ILE HA H 1 4.168 0.030 . 1 . . . . 98 ILE HA . 11192 1 1190 . 1 1 98 98 ILE HB H 1 1.836 0.030 . 1 . . . . 98 ILE HB . 11192 1 1191 . 1 1 98 98 ILE HD11 H 1 0.830 0.030 . 1 . . . . 98 ILE HD1 . 11192 1 1192 . 1 1 98 98 ILE HD12 H 1 0.830 0.030 . 1 . . . . 98 ILE HD1 . 11192 1 1193 . 1 1 98 98 ILE HD13 H 1 0.830 0.030 . 1 . . . . 98 ILE HD1 . 11192 1 1194 . 1 1 98 98 ILE HG12 H 1 1.184 0.030 . 2 . . . . 98 ILE HG12 . 11192 1 1195 . 1 1 98 98 ILE HG13 H 1 1.440 0.030 . 2 . . . . 98 ILE HG13 . 11192 1 1196 . 1 1 98 98 ILE HG21 H 1 0.868 0.030 . 1 . . . . 98 ILE HG2 . 11192 1 1197 . 1 1 98 98 ILE HG22 H 1 0.868 0.030 . 1 . . . . 98 ILE HG2 . 11192 1 1198 . 1 1 98 98 ILE HG23 H 1 0.868 0.030 . 1 . . . . 98 ILE HG2 . 11192 1 1199 . 1 1 98 98 ILE C C 13 175.622 0.300 . 1 . . . . 98 ILE C . 11192 1 1200 . 1 1 98 98 ILE CA C 13 60.451 0.300 . 1 . . . . 98 ILE CA . 11192 1 1201 . 1 1 98 98 ILE CB C 13 38.399 0.300 . 1 . . . . 98 ILE CB . 11192 1 1202 . 1 1 98 98 ILE CD1 C 13 12.357 0.300 . 1 . . . . 98 ILE CD1 . 11192 1 1203 . 1 1 98 98 ILE CG1 C 13 26.932 0.300 . 1 . . . . 98 ILE CG1 . 11192 1 1204 . 1 1 98 98 ILE CG2 C 13 17.243 0.300 . 1 . . . . 98 ILE CG2 . 11192 1 1205 . 1 1 98 98 ILE N N 15 123.651 0.300 . 1 . . . . 98 ILE N . 11192 1 1206 . 1 1 99 99 LYS H H 1 8.494 0.030 . 1 . . . . 99 LYS H . 11192 1 1207 . 1 1 99 99 LYS HA H 1 4.432 0.030 . 1 . . . . 99 LYS HA . 11192 1 1208 . 1 1 99 99 LYS HB2 H 1 1.736 0.030 . 2 . . . . 99 LYS HB2 . 11192 1 1209 . 1 1 99 99 LYS HB3 H 1 1.806 0.030 . 2 . . . . 99 LYS HB3 . 11192 1 1210 . 1 1 99 99 LYS HG2 H 1 1.376 0.030 . 2 . . . . 99 LYS HG2 . 11192 1 1211 . 1 1 99 99 LYS HG3 H 1 1.424 0.030 . 2 . . . . 99 LYS HG3 . 11192 1 1212 . 1 1 99 99 LYS C C 13 176.096 0.300 . 1 . . . . 99 LYS C . 11192 1 1213 . 1 1 99 99 LYS CA C 13 55.733 0.300 . 1 . . . . 99 LYS CA . 11192 1 1214 . 1 1 99 99 LYS CB C 13 33.040 0.300 . 1 . . . . 99 LYS CB . 11192 1 1215 . 1 1 99 99 LYS CD C 13 29.160 0.300 . 1 . . . . 99 LYS CD . 11192 1 1216 . 1 1 99 99 LYS CE C 13 42.072 0.300 . 1 . . . . 99 LYS CE . 11192 1 1217 . 1 1 99 99 LYS CG C 13 24.604 0.300 . 1 . . . . 99 LYS CG . 11192 1 1218 . 1 1 99 99 LYS N N 15 126.692 0.300 . 1 . . . . 99 LYS N . 11192 1 1219 . 1 1 100 100 VAL H H 1 8.314 0.030 . 1 . . . . 100 VAL H . 11192 1 1220 . 1 1 100 100 VAL HA H 1 4.183 0.030 . 1 . . . . 100 VAL HA . 11192 1 1221 . 1 1 100 100 VAL HB H 1 2.099 0.030 . 1 . . . . 100 VAL HB . 11192 1 1222 . 1 1 100 100 VAL HG11 H 1 0.943 0.030 . 1 . . . . 100 VAL HG1 . 11192 1 1223 . 1 1 100 100 VAL HG12 H 1 0.943 0.030 . 1 . . . . 100 VAL HG1 . 11192 1 1224 . 1 1 100 100 VAL HG13 H 1 0.943 0.030 . 1 . . . . 100 VAL HG1 . 11192 1 1225 . 1 1 100 100 VAL HG21 H 1 0.943 0.030 . 1 . . . . 100 VAL HG2 . 11192 1 1226 . 1 1 100 100 VAL HG22 H 1 0.943 0.030 . 1 . . . . 100 VAL HG2 . 11192 1 1227 . 1 1 100 100 VAL HG23 H 1 0.943 0.030 . 1 . . . . 100 VAL HG2 . 11192 1 1228 . 1 1 100 100 VAL C C 13 175.903 0.300 . 1 . . . . 100 VAL C . 11192 1 1229 . 1 1 100 100 VAL CA C 13 61.908 0.300 . 1 . . . . 100 VAL CA . 11192 1 1230 . 1 1 100 100 VAL CB C 13 32.699 0.300 . 1 . . . . 100 VAL CB . 11192 1 1231 . 1 1 100 100 VAL CG1 C 13 20.914 0.300 . 2 . . . . 100 VAL CG1 . 11192 1 1232 . 1 1 100 100 VAL CG2 C 13 20.138 0.300 . 2 . . . . 100 VAL CG2 . 11192 1 1233 . 1 1 100 100 VAL N N 15 122.239 0.300 . 1 . . . . 100 VAL N . 11192 1 1234 . 1 1 101 101 SER H H 1 8.443 0.030 . 1 . . . . 101 SER H . 11192 1 1235 . 1 1 101 101 SER HA H 1 4.528 0.030 . 1 . . . . 101 SER HA . 11192 1 1236 . 1 1 101 101 SER HB2 H 1 3.863 0.030 . 1 . . . . 101 SER HB2 . 11192 1 1237 . 1 1 101 101 SER HB3 H 1 3.863 0.030 . 1 . . . . 101 SER HB3 . 11192 1 1238 . 1 1 101 101 SER C C 13 174.252 0.300 . 1 . . . . 101 SER C . 11192 1 1239 . 1 1 101 101 SER CA C 13 58.037 0.300 . 1 . . . . 101 SER CA . 11192 1 1240 . 1 1 101 101 SER CB C 13 63.776 0.300 . 1 . . . . 101 SER CB . 11192 1 1241 . 1 1 101 101 SER N N 15 119.909 0.300 . 1 . . . . 101 SER N . 11192 1 1242 . 1 1 102 102 GLY H H 1 8.264 0.030 . 1 . . . . 102 GLY H . 11192 1 1243 . 1 1 102 102 GLY HA2 H 1 4.190 0.030 . 2 . . . . 102 GLY HA2 . 11192 1 1244 . 1 1 102 102 GLY HA3 H 1 4.098 0.030 . 2 . . . . 102 GLY HA3 . 11192 1 1245 . 1 1 102 102 GLY C C 13 171.567 0.300 . 1 . . . . 102 GLY C . 11192 1 1246 . 1 1 102 102 GLY CA C 13 44.485 0.300 . 1 . . . . 102 GLY CA . 11192 1 1247 . 1 1 102 102 GLY N N 15 110.848 0.300 . 1 . . . . 102 GLY N . 11192 1 1248 . 1 1 103 103 PRO HA H 1 4.496 0.030 . 1 . . . . 103 PRO HA . 11192 1 1249 . 1 1 103 103 PRO HB2 H 1 2.306 0.030 . 2 . . . . 103 PRO HB2 . 11192 1 1250 . 1 1 103 103 PRO HB3 H 1 1.987 0.030 . 2 . . . . 103 PRO HB3 . 11192 1 1251 . 1 1 103 103 PRO HD2 H 1 3.637 0.030 . 1 . . . . 103 PRO HD2 . 11192 1 1252 . 1 1 103 103 PRO HD3 H 1 3.637 0.030 . 1 . . . . 103 PRO HD3 . 11192 1 1253 . 1 1 103 103 PRO HG2 H 1 2.026 0.030 . 1 . . . . 103 PRO HG2 . 11192 1 1254 . 1 1 103 103 PRO HG3 H 1 2.026 0.030 . 1 . . . . 103 PRO HG3 . 11192 1 1255 . 1 1 103 103 PRO C C 13 177.184 0.300 . 1 . . . . 103 PRO C . 11192 1 1256 . 1 1 103 103 PRO CA C 13 63.057 0.300 . 1 . . . . 103 PRO CA . 11192 1 1257 . 1 1 103 103 PRO CB C 13 31.994 0.300 . 1 . . . . 103 PRO CB . 11192 1 1258 . 1 1 103 103 PRO CD C 13 49.597 0.300 . 1 . . . . 103 PRO CD . 11192 1 1259 . 1 1 103 103 PRO CG C 13 26.928 0.300 . 1 . . . . 103 PRO CG . 11192 1 1260 . 1 1 104 104 SER H H 1 8.527 0.030 . 1 . . . . 104 SER H . 11192 1 1261 . 1 1 104 104 SER HA H 1 4.525 0.030 . 1 . . . . 104 SER HA . 11192 1 1262 . 1 1 104 104 SER HB2 H 1 3.924 0.030 . 1 . . . . 104 SER HB2 . 11192 1 1263 . 1 1 104 104 SER HB3 H 1 3.924 0.030 . 1 . . . . 104 SER HB3 . 11192 1 1264 . 1 1 104 104 SER C C 13 174.428 0.300 . 1 . . . . 104 SER C . 11192 1 1265 . 1 1 104 104 SER CA C 13 58.174 0.300 . 1 . . . . 104 SER CA . 11192 1 1266 . 1 1 104 104 SER CB C 13 63.586 0.300 . 1 . . . . 104 SER CB . 11192 1 1267 . 1 1 104 104 SER N N 15 116.270 0.300 . 1 . . . . 104 SER N . 11192 1 1268 . 1 1 105 105 SER H H 1 8.327 0.030 . 1 . . . . 105 SER H . 11192 1 1269 . 1 1 105 105 SER HA H 1 4.511 0.030 . 1 . . . . 105 SER HA . 11192 1 1270 . 1 1 105 105 SER HB2 H 1 3.909 0.030 . 1 . . . . 105 SER HB2 . 11192 1 1271 . 1 1 105 105 SER HB3 H 1 3.909 0.030 . 1 . . . . 105 SER HB3 . 11192 1 1272 . 1 1 105 105 SER C C 13 173.726 0.300 . 1 . . . . 105 SER C . 11192 1 1273 . 1 1 105 105 SER CA C 13 58.202 0.300 . 1 . . . . 105 SER CA . 11192 1 1274 . 1 1 105 105 SER CB C 13 63.722 0.300 . 1 . . . . 105 SER CB . 11192 1 1275 . 1 1 105 105 SER N N 15 117.720 0.300 . 1 . . . . 105 SER N . 11192 1 1276 . 1 1 106 106 GLY H H 1 8.050 0.030 . 1 . . . . 106 GLY H . 11192 1 1277 . 1 1 106 106 GLY HA2 H 1 3.789 0.030 . 1 . . . . 106 GLY HA2 . 11192 1 1278 . 1 1 106 106 GLY HA3 H 1 3.789 0.030 . 1 . . . . 106 GLY HA3 . 11192 1 1279 . 1 1 106 106 GLY C C 13 178.852 0.300 . 1 . . . . 106 GLY C . 11192 1 1280 . 1 1 106 106 GLY CA C 13 45.855 0.300 . 1 . . . . 106 GLY CA . 11192 1 1281 . 1 1 106 106 GLY N N 15 116.800 0.300 . 1 . . . . 106 GLY N . 11192 1 stop_ save_