data_11160 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 11160 _Entry.Title ; Solution structure of the HMG box of human Myeloid/lymphoid or mixed-lineage leukemia protein 3 homolog ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2010-04-15 _Entry.Accession_date 2010-04-15 _Entry.Last_release_date 2011-05-05 _Entry.Original_release_date 2011-05-05 _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 H. Abe . . . 11160 2 N. Tochio . . . 11160 3 K. Miyamoto . . . 11160 4 S. Koshiba . . . 11160 5 T. Harada . . . 11160 6 S. Watanabe . . . 11160 7 T. Kigawa . . . 11160 8 S. Yokoyama . . . 11160 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)' . 11160 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 11160 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 380 11160 '15N chemical shifts' 89 11160 '1H chemical shifts' 603 11160 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 . . 2011-05-05 2010-04-15 original author . 11160 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 2YUK 'BMRB Entry Tracking System' 11160 stop_ save_ ############### # Citations # ############### save_citation_1 _Citation.Sf_category citations _Citation.Sf_framecode citation_1 _Citation.Entry_ID 11160 _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 HMG box of human Myeloid/lymphoid or mixed-lineage leukemia protein 3 homolog ; _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 H. Abe . . . 11160 1 2 N. Tochio . . . 11160 1 3 K. Miyamoto . . . 11160 1 4 S. Koshiba . . . 11160 1 5 T. Harada . . . 11160 1 6 S. Watanabe . . . 11160 1 7 T. Kigawa . . . 11160 1 8 S. Yokoyama . . . 11160 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 11160 _Assembly.ID 1 _Assembly.Name 'Myeloid/lymphoid or mixed-lineage leukemia protein 3 homolog' _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 E.C.2.1.1.43 _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 'HMG (high mobility group) box, UNP residues 1631-1713' 1 $entity_1 A . yes native no no . . . 11160 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 2yuk . . . . . . 11160 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 11160 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name 'HMG (high mobility group) box, UNP residues 1631-1713' _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 ; GSSGSSGNAQRSTLKWEKEE ALGEMATVAPVLYTNINFPN LKEEFPDWTTRVKQIAKLWR KASSQERAPYVQKARDNRAA LRINKVQMSN ; _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 90 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-11-26 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 2YUK . "Solution Structure Of The Hmg Box Of Human MyeloidLYMPHOID Or Mixed-Lineage Leukemia Protein 3 Homolog" . . . . . 100.00 90 100.00 100.00 7.90e-58 . . . . 11160 1 2 no GB KFP32916 . "Histone-lysine N-methyltransferase 2C, partial [Colius striatus]" . . . . . 92.22 3499 98.80 98.80 1.44e-47 . . . . 11160 1 3 no REF XP_010203152 . "PREDICTED: histone-lysine N-methyltransferase 2C, partial [Colius striatus]" . . . . . 92.22 3564 98.80 98.80 1.50e-47 . . . . 11160 1 4 no REF XP_012426828 . "PREDICTED: histone-lysine N-methyltransferase 2C isoform X1 [Taeniopygia guttata]" . . . . . 92.22 4630 97.59 97.59 6.43e-47 . . . . 11160 1 5 no REF XP_012426830 . "PREDICTED: histone-lysine N-methyltransferase 2C isoform X2 [Taeniopygia guttata]" . . . . . 92.22 4626 97.59 97.59 6.43e-47 . . . . 11160 1 6 no REF XP_012426831 . "PREDICTED: histone-lysine N-methyltransferase 2C isoform X3 [Taeniopygia guttata]" . . . . . 92.22 4614 97.59 97.59 7.42e-47 . . . . 11160 1 7 no REF XP_012426832 . "PREDICTED: histone-lysine N-methyltransferase 2C isoform X4 [Taeniopygia guttata]" . . . . . 92.22 4608 97.59 97.59 6.93e-47 . . . . 11160 1 stop_ loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID 'HMG (high mobility group) box, UNP residues 1631-1713' . 11160 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 . 11160 1 2 . SER . 11160 1 3 . SER . 11160 1 4 . GLY . 11160 1 5 . SER . 11160 1 6 . SER . 11160 1 7 . GLY . 11160 1 8 . ASN . 11160 1 9 . ALA . 11160 1 10 . GLN . 11160 1 11 . ARG . 11160 1 12 . SER . 11160 1 13 . THR . 11160 1 14 . LEU . 11160 1 15 . LYS . 11160 1 16 . TRP . 11160 1 17 . GLU . 11160 1 18 . LYS . 11160 1 19 . GLU . 11160 1 20 . GLU . 11160 1 21 . ALA . 11160 1 22 . LEU . 11160 1 23 . GLY . 11160 1 24 . GLU . 11160 1 25 . MET . 11160 1 26 . ALA . 11160 1 27 . THR . 11160 1 28 . VAL . 11160 1 29 . ALA . 11160 1 30 . PRO . 11160 1 31 . VAL . 11160 1 32 . LEU . 11160 1 33 . TYR . 11160 1 34 . THR . 11160 1 35 . ASN . 11160 1 36 . ILE . 11160 1 37 . ASN . 11160 1 38 . PHE . 11160 1 39 . PRO . 11160 1 40 . ASN . 11160 1 41 . LEU . 11160 1 42 . LYS . 11160 1 43 . GLU . 11160 1 44 . GLU . 11160 1 45 . PHE . 11160 1 46 . PRO . 11160 1 47 . ASP . 11160 1 48 . TRP . 11160 1 49 . THR . 11160 1 50 . THR . 11160 1 51 . ARG . 11160 1 52 . VAL . 11160 1 53 . LYS . 11160 1 54 . GLN . 11160 1 55 . ILE . 11160 1 56 . ALA . 11160 1 57 . LYS . 11160 1 58 . LEU . 11160 1 59 . TRP . 11160 1 60 . ARG . 11160 1 61 . LYS . 11160 1 62 . ALA . 11160 1 63 . SER . 11160 1 64 . SER . 11160 1 65 . GLN . 11160 1 66 . GLU . 11160 1 67 . ARG . 11160 1 68 . ALA . 11160 1 69 . PRO . 11160 1 70 . TYR . 11160 1 71 . VAL . 11160 1 72 . GLN . 11160 1 73 . LYS . 11160 1 74 . ALA . 11160 1 75 . ARG . 11160 1 76 . ASP . 11160 1 77 . ASN . 11160 1 78 . ARG . 11160 1 79 . ALA . 11160 1 80 . ALA . 11160 1 81 . LEU . 11160 1 82 . ARG . 11160 1 83 . ILE . 11160 1 84 . ASN . 11160 1 85 . LYS . 11160 1 86 . VAL . 11160 1 87 . GLN . 11160 1 88 . MET . 11160 1 89 . SER . 11160 1 90 . ASN . 11160 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 11160 1 . SER 2 2 11160 1 . SER 3 3 11160 1 . GLY 4 4 11160 1 . SER 5 5 11160 1 . SER 6 6 11160 1 . GLY 7 7 11160 1 . ASN 8 8 11160 1 . ALA 9 9 11160 1 . GLN 10 10 11160 1 . ARG 11 11 11160 1 . SER 12 12 11160 1 . THR 13 13 11160 1 . LEU 14 14 11160 1 . LYS 15 15 11160 1 . TRP 16 16 11160 1 . GLU 17 17 11160 1 . LYS 18 18 11160 1 . GLU 19 19 11160 1 . GLU 20 20 11160 1 . ALA 21 21 11160 1 . LEU 22 22 11160 1 . GLY 23 23 11160 1 . GLU 24 24 11160 1 . MET 25 25 11160 1 . ALA 26 26 11160 1 . THR 27 27 11160 1 . VAL 28 28 11160 1 . ALA 29 29 11160 1 . PRO 30 30 11160 1 . VAL 31 31 11160 1 . LEU 32 32 11160 1 . TYR 33 33 11160 1 . THR 34 34 11160 1 . ASN 35 35 11160 1 . ILE 36 36 11160 1 . ASN 37 37 11160 1 . PHE 38 38 11160 1 . PRO 39 39 11160 1 . ASN 40 40 11160 1 . LEU 41 41 11160 1 . LYS 42 42 11160 1 . GLU 43 43 11160 1 . GLU 44 44 11160 1 . PHE 45 45 11160 1 . PRO 46 46 11160 1 . ASP 47 47 11160 1 . TRP 48 48 11160 1 . THR 49 49 11160 1 . THR 50 50 11160 1 . ARG 51 51 11160 1 . VAL 52 52 11160 1 . LYS 53 53 11160 1 . GLN 54 54 11160 1 . ILE 55 55 11160 1 . ALA 56 56 11160 1 . LYS 57 57 11160 1 . LEU 58 58 11160 1 . TRP 59 59 11160 1 . ARG 60 60 11160 1 . LYS 61 61 11160 1 . ALA 62 62 11160 1 . SER 63 63 11160 1 . SER 64 64 11160 1 . GLN 65 65 11160 1 . GLU 66 66 11160 1 . ARG 67 67 11160 1 . ALA 68 68 11160 1 . PRO 69 69 11160 1 . TYR 70 70 11160 1 . VAL 71 71 11160 1 . GLN 72 72 11160 1 . LYS 73 73 11160 1 . ALA 74 74 11160 1 . ARG 75 75 11160 1 . ASP 76 76 11160 1 . ASN 77 77 11160 1 . ARG 78 78 11160 1 . ALA 79 79 11160 1 . ALA 80 80 11160 1 . LEU 81 81 11160 1 . ARG 82 82 11160 1 . ILE 83 83 11160 1 . ASN 84 84 11160 1 . LYS 85 85 11160 1 . VAL 86 86 11160 1 . GLN 87 87 11160 1 . MET 88 88 11160 1 . SER 89 89 11160 1 . ASN 90 90 11160 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 11160 _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 . 9606 organism . 'Homo sapiens' human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . . . . . . . . . 11160 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 11160 _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 . . . . . . . . . . . . . . . . P060327-10 . . . . . . 11160 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 11160 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details ; 1.11mM {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 'HMG (high mobility group) box, UNP residues 1631-1713' '[U-13C; U-15N]' . . 1 $entity_1 . protein 1.11 . . mM . . . . 11160 1 2 d-Tris-HCl 'natural abundance' . . . . . buffer 20 . . mM . . . . 11160 1 3 NaCl 'natural abundance' . . . . . salt 100 . . mM . . . . 11160 1 4 d-DTT 'natural abundance' . . . . . salt 1 . . mM . . . . 11160 1 5 NaN3 'natural abundance' . . . . . salt 0.02 . . % . . . . 11160 1 6 H2O . . . . . . solvent 90 . . % . . . . 11160 1 7 D2O . . . . . . solvent 10 . . % . . . . 11160 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 11160 _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 11160 1 pH 7.0 0.05 pH 11160 1 pressure 1 0.001 atm 11160 1 temperature 298 0.1 K 11160 1 stop_ save_ ############################ # Computer software used # ############################ save_XWINNMR _Software.Sf_category software _Software.Sf_framecode XWINNMR _Software.Entry_ID 11160 _Software.ID 1 _Software.Name xwinnmr _Software.Version 3.5 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Bruker . . 11160 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection 11160 1 stop_ save_ save_NMRPipe _Software.Sf_category software _Software.Sf_framecode NMRPipe _Software.Entry_ID 11160 _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.' . . 11160 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 11160 2 stop_ save_ save_NMRView _Software.Sf_category software _Software.Sf_framecode NMRView _Software.Entry_ID 11160 _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.' . . 11160 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 11160 3 stop_ save_ save_Kujira _Software.Sf_category software _Software.Sf_framecode Kujira _Software.Entry_ID 11160 _Software.ID 4 _Software.Name Kujira _Software.Version 0.9747 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Kobayashi, N.' . . 11160 4 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 11160 4 stop_ save_ save_CYANA _Software.Sf_category software _Software.Sf_framecode CYANA _Software.Entry_ID 11160 _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.' . . 11160 5 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'structure solution' 11160 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 11160 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model AVANCE _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 11160 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 Bruker AVANCE . 800 . . . 11160 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 11160 _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 . . . . . . . . . . . . . . . . 11160 1 2 '3D 13C-separated NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $condition_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 11160 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 11160 _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 . . . . . . . . . 11160 1 H 1 DSS 'methyl protons' . . . . ppm 0.0 . indirect 1.0 . . . . . . . . . 11160 1 N 15 DSS 'methyl protons' . . . . ppm 0.0 . indirect 0.101329118 . . . . . . . . . 11160 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 11160 _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 11160 1 2 '3D 13C-separated NOESY' 1 $sample_1 isotropic 11160 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 $XWINNMR . . 11160 1 2 $NMRPipe . . 11160 1 3 $NMRView . . 11160 1 4 $Kujira . . 11160 1 5 $CYANA . . 11160 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 8 8 ASN HA H 1 4.692 0.030 . 1 . . . . 8 ASN HA . 11160 1 2 . 1 1 8 8 ASN HB2 H 1 2.839 0.030 . 2 . . . . 8 ASN HB2 . 11160 1 3 . 1 1 8 8 ASN HB3 H 1 2.762 0.030 . 2 . . . . 8 ASN HB3 . 11160 1 4 . 1 1 8 8 ASN C C 13 175.531 0.300 . 1 . . . . 8 ASN C . 11160 1 5 . 1 1 8 8 ASN CA C 13 53.503 0.300 . 1 . . . . 8 ASN CA . 11160 1 6 . 1 1 8 8 ASN CB C 13 38.893 0.300 . 1 . . . . 8 ASN CB . 11160 1 7 . 1 1 9 9 ALA H H 1 8.329 0.030 . 1 . . . . 9 ALA H . 11160 1 8 . 1 1 9 9 ALA HA H 1 4.267 0.030 . 1 . . . . 9 ALA HA . 11160 1 9 . 1 1 9 9 ALA HB1 H 1 1.397 0.030 . 1 . . . . 9 ALA HB . 11160 1 10 . 1 1 9 9 ALA HB2 H 1 1.397 0.030 . 1 . . . . 9 ALA HB . 11160 1 11 . 1 1 9 9 ALA HB3 H 1 1.397 0.030 . 1 . . . . 9 ALA HB . 11160 1 12 . 1 1 9 9 ALA C C 13 178.081 0.300 . 1 . . . . 9 ALA C . 11160 1 13 . 1 1 9 9 ALA CA C 13 53.118 0.300 . 1 . . . . 9 ALA CA . 11160 1 14 . 1 1 9 9 ALA CB C 13 19.025 0.300 . 1 . . . . 9 ALA CB . 11160 1 15 . 1 1 9 9 ALA N N 15 124.392 0.300 . 1 . . . . 9 ALA N . 11160 1 16 . 1 1 10 10 GLN H H 1 8.305 0.030 . 1 . . . . 10 GLN H . 11160 1 17 . 1 1 10 10 GLN HA H 1 4.271 0.030 . 1 . . . . 10 GLN HA . 11160 1 18 . 1 1 10 10 GLN HB2 H 1 2.117 0.030 . 2 . . . . 10 GLN HB2 . 11160 1 19 . 1 1 10 10 GLN HB3 H 1 2.003 0.030 . 2 . . . . 10 GLN HB3 . 11160 1 20 . 1 1 10 10 GLN HE21 H 1 7.530 0.030 . 2 . . . . 10 GLN HE21 . 11160 1 21 . 1 1 10 10 GLN HE22 H 1 6.858 0.030 . 2 . . . . 10 GLN HE22 . 11160 1 22 . 1 1 10 10 GLN HG2 H 1 2.376 0.030 . 1 . . . . 10 GLN HG2 . 11160 1 23 . 1 1 10 10 GLN HG3 H 1 2.376 0.030 . 1 . . . . 10 GLN HG3 . 11160 1 24 . 1 1 10 10 GLN C C 13 176.450 0.300 . 1 . . . . 10 GLN C . 11160 1 25 . 1 1 10 10 GLN CA C 13 56.310 0.300 . 1 . . . . 10 GLN CA . 11160 1 26 . 1 1 10 10 GLN CB C 13 29.032 0.300 . 1 . . . . 10 GLN CB . 11160 1 27 . 1 1 10 10 GLN CG C 13 33.959 0.300 . 1 . . . . 10 GLN CG . 11160 1 28 . 1 1 10 10 GLN N N 15 118.975 0.300 . 1 . . . . 10 GLN N . 11160 1 29 . 1 1 10 10 GLN NE2 N 15 112.507 0.300 . 1 . . . . 10 GLN NE2 . 11160 1 30 . 1 1 11 11 ARG H H 1 8.246 0.030 . 1 . . . . 11 ARG H . 11160 1 31 . 1 1 11 11 ARG C C 13 176.940 0.300 . 1 . . . . 11 ARG C . 11160 1 32 . 1 1 11 11 ARG CA C 13 56.218 0.300 . 1 . . . . 11 ARG CA . 11160 1 33 . 1 1 11 11 ARG CB C 13 30.382 0.300 . 1 . . . . 11 ARG CB . 11160 1 34 . 1 1 11 11 ARG N N 15 121.478 0.300 . 1 . . . . 11 ARG N . 11160 1 35 . 1 1 12 12 SER HA H 1 4.287 0.030 . 1 . . . . 12 SER HA . 11160 1 36 . 1 1 12 12 SER HB2 H 1 3.824 0.030 . 2 . . . . 12 SER HB2 . 11160 1 37 . 1 1 12 12 SER HB3 H 1 3.745 0.030 . 2 . . . . 12 SER HB3 . 11160 1 38 . 1 1 12 12 SER C C 13 175.508 0.300 . 1 . . . . 12 SER C . 11160 1 39 . 1 1 12 12 SER CA C 13 59.018 0.300 . 1 . . . . 12 SER CA . 11160 1 40 . 1 1 12 12 SER CB C 13 63.403 0.300 . 1 . . . . 12 SER CB . 11160 1 41 . 1 1 13 13 THR H H 1 7.916 0.030 . 1 . . . . 13 THR H . 11160 1 42 . 1 1 13 13 THR HA H 1 3.519 0.030 . 1 . . . . 13 THR HA . 11160 1 43 . 1 1 13 13 THR HB H 1 3.927 0.030 . 1 . . . . 13 THR HB . 11160 1 44 . 1 1 13 13 THR HG21 H 1 0.550 0.030 . 1 . . . . 13 THR HG2 . 11160 1 45 . 1 1 13 13 THR HG22 H 1 0.550 0.030 . 1 . . . . 13 THR HG2 . 11160 1 46 . 1 1 13 13 THR HG23 H 1 0.550 0.030 . 1 . . . . 13 THR HG2 . 11160 1 47 . 1 1 13 13 THR C C 13 175.632 0.300 . 1 . . . . 13 THR C . 11160 1 48 . 1 1 13 13 THR CA C 13 62.059 0.300 . 1 . . . . 13 THR CA . 11160 1 49 . 1 1 13 13 THR CB C 13 69.096 0.300 . 1 . . . . 13 THR CB . 11160 1 50 . 1 1 13 13 THR CG2 C 13 20.856 0.300 . 1 . . . . 13 THR CG2 . 11160 1 51 . 1 1 13 13 THR N N 15 114.486 0.300 . 1 . . . . 13 THR N . 11160 1 52 . 1 1 14 14 LEU H H 1 7.785 0.030 . 1 . . . . 14 LEU H . 11160 1 53 . 1 1 14 14 LEU HA H 1 4.222 0.030 . 1 . . . . 14 LEU HA . 11160 1 54 . 1 1 14 14 LEU HB2 H 1 1.670 0.030 . 2 . . . . 14 LEU HB2 . 11160 1 55 . 1 1 14 14 LEU HB3 H 1 1.508 0.030 . 2 . . . . 14 LEU HB3 . 11160 1 56 . 1 1 14 14 LEU HD11 H 1 0.846 0.030 . 1 . . . . 14 LEU HD1 . 11160 1 57 . 1 1 14 14 LEU HD12 H 1 0.846 0.030 . 1 . . . . 14 LEU HD1 . 11160 1 58 . 1 1 14 14 LEU HD13 H 1 0.846 0.030 . 1 . . . . 14 LEU HD1 . 11160 1 59 . 1 1 14 14 LEU HD21 H 1 0.835 0.030 . 1 . . . . 14 LEU HD2 . 11160 1 60 . 1 1 14 14 LEU HD22 H 1 0.835 0.030 . 1 . . . . 14 LEU HD2 . 11160 1 61 . 1 1 14 14 LEU HD23 H 1 0.835 0.030 . 1 . . . . 14 LEU HD2 . 11160 1 62 . 1 1 14 14 LEU HG H 1 1.619 0.030 . 1 . . . . 14 LEU HG . 11160 1 63 . 1 1 14 14 LEU C C 13 178.844 0.300 . 1 . . . . 14 LEU C . 11160 1 64 . 1 1 14 14 LEU CA C 13 57.109 0.300 . 1 . . . . 14 LEU CA . 11160 1 65 . 1 1 14 14 LEU CB C 13 42.030 0.300 . 1 . . . . 14 LEU CB . 11160 1 66 . 1 1 14 14 LEU CD1 C 13 24.783 0.300 . 2 . . . . 14 LEU CD1 . 11160 1 67 . 1 1 14 14 LEU CD2 C 13 23.641 0.300 . 2 . . . . 14 LEU CD2 . 11160 1 68 . 1 1 14 14 LEU CG C 13 27.036 0.300 . 1 . . . . 14 LEU CG . 11160 1 69 . 1 1 14 14 LEU N N 15 123.568 0.300 . 1 . . . . 14 LEU N . 11160 1 70 . 1 1 15 15 LYS H H 1 8.437 0.030 . 1 . . . . 15 LYS H . 11160 1 71 . 1 1 15 15 LYS HA H 1 4.398 0.030 . 1 . . . . 15 LYS HA . 11160 1 72 . 1 1 15 15 LYS HB2 H 1 2.070 0.030 . 2 . . . . 15 LYS HB2 . 11160 1 73 . 1 1 15 15 LYS HB3 H 1 1.928 0.030 . 2 . . . . 15 LYS HB3 . 11160 1 74 . 1 1 15 15 LYS HD2 H 1 1.702 0.030 . 2 . . . . 15 LYS HD2 . 11160 1 75 . 1 1 15 15 LYS HD3 H 1 1.659 0.030 . 2 . . . . 15 LYS HD3 . 11160 1 76 . 1 1 15 15 LYS HE2 H 1 2.931 0.030 . 1 . . . . 15 LYS HE2 . 11160 1 77 . 1 1 15 15 LYS HE3 H 1 2.931 0.030 . 1 . . . . 15 LYS HE3 . 11160 1 78 . 1 1 15 15 LYS HG2 H 1 1.433 0.030 . 2 . . . . 15 LYS HG2 . 11160 1 79 . 1 1 15 15 LYS HG3 H 1 1.497 0.030 . 2 . . . . 15 LYS HG3 . 11160 1 80 . 1 1 15 15 LYS C C 13 177.964 0.300 . 1 . . . . 15 LYS C . 11160 1 81 . 1 1 15 15 LYS CA C 13 57.296 0.300 . 1 . . . . 15 LYS CA . 11160 1 82 . 1 1 15 15 LYS CB C 13 31.903 0.300 . 1 . . . . 15 LYS CB . 11160 1 83 . 1 1 15 15 LYS CD C 13 29.091 0.300 . 1 . . . . 15 LYS CD . 11160 1 84 . 1 1 15 15 LYS CE C 13 42.057 0.300 . 1 . . . . 15 LYS CE . 11160 1 85 . 1 1 15 15 LYS CG C 13 25.163 0.300 . 1 . . . . 15 LYS CG . 11160 1 86 . 1 1 15 15 LYS N N 15 118.572 0.300 . 1 . . . . 15 LYS N . 11160 1 87 . 1 1 16 16 TRP H H 1 8.513 0.030 . 1 . . . . 16 TRP H . 11160 1 88 . 1 1 16 16 TRP HA H 1 4.482 0.030 . 1 . . . . 16 TRP HA . 11160 1 89 . 1 1 16 16 TRP HB2 H 1 3.717 0.030 . 2 . . . . 16 TRP HB2 . 11160 1 90 . 1 1 16 16 TRP HB3 H 1 3.501 0.030 . 2 . . . . 16 TRP HB3 . 11160 1 91 . 1 1 16 16 TRP HD1 H 1 6.992 0.030 . 1 . . . . 16 TRP HD1 . 11160 1 92 . 1 1 16 16 TRP HE1 H 1 10.250 0.030 . 1 . . . . 16 TRP HE1 . 11160 1 93 . 1 1 16 16 TRP HE3 H 1 7.311 0.030 . 1 . . . . 16 TRP HE3 . 11160 1 94 . 1 1 16 16 TRP HH2 H 1 7.012 0.030 . 1 . . . . 16 TRP HH2 . 11160 1 95 . 1 1 16 16 TRP HZ2 H 1 7.344 0.030 . 1 . . . . 16 TRP HZ2 . 11160 1 96 . 1 1 16 16 TRP HZ3 H 1 6.806 0.030 . 1 . . . . 16 TRP HZ3 . 11160 1 97 . 1 1 16 16 TRP C C 13 177.159 0.300 . 1 . . . . 16 TRP C . 11160 1 98 . 1 1 16 16 TRP CA C 13 59.368 0.300 . 1 . . . . 16 TRP CA . 11160 1 99 . 1 1 16 16 TRP CB C 13 29.112 0.300 . 1 . . . . 16 TRP CB . 11160 1 100 . 1 1 16 16 TRP CD1 C 13 122.983 0.300 . 1 . . . . 16 TRP CD1 . 11160 1 101 . 1 1 16 16 TRP CE3 C 13 120.091 0.300 . 1 . . . . 16 TRP CE3 . 11160 1 102 . 1 1 16 16 TRP CH2 C 13 124.550 0.300 . 1 . . . . 16 TRP CH2 . 11160 1 103 . 1 1 16 16 TRP CZ2 C 13 114.638 0.300 . 1 . . . . 16 TRP CZ2 . 11160 1 104 . 1 1 16 16 TRP CZ3 C 13 121.043 0.300 . 1 . . . . 16 TRP CZ3 . 11160 1 105 . 1 1 16 16 TRP N N 15 119.998 0.300 . 1 . . . . 16 TRP N . 11160 1 106 . 1 1 16 16 TRP NE1 N 15 128.779 0.300 . 1 . . . . 16 TRP NE1 . 11160 1 107 . 1 1 17 17 GLU H H 1 8.345 0.030 . 1 . . . . 17 GLU H . 11160 1 108 . 1 1 17 17 GLU HA H 1 2.998 0.030 . 1 . . . . 17 GLU HA . 11160 1 109 . 1 1 17 17 GLU HB2 H 1 0.954 0.030 . 2 . . . . 17 GLU HB2 . 11160 1 110 . 1 1 17 17 GLU HB3 H 1 1.483 0.030 . 2 . . . . 17 GLU HB3 . 11160 1 111 . 1 1 17 17 GLU HG2 H 1 1.327 0.030 . 2 . . . . 17 GLU HG2 . 11160 1 112 . 1 1 17 17 GLU HG3 H 1 1.610 0.030 . 2 . . . . 17 GLU HG3 . 11160 1 113 . 1 1 17 17 GLU C C 13 179.536 0.300 . 1 . . . . 17 GLU C . 11160 1 114 . 1 1 17 17 GLU CA C 13 59.897 0.300 . 1 . . . . 17 GLU CA . 11160 1 115 . 1 1 17 17 GLU CB C 13 28.735 0.300 . 1 . . . . 17 GLU CB . 11160 1 116 . 1 1 17 17 GLU CG C 13 35.612 0.300 . 1 . . . . 17 GLU CG . 11160 1 117 . 1 1 17 17 GLU N N 15 121.723 0.300 . 1 . . . . 17 GLU N . 11160 1 118 . 1 1 18 18 LYS H H 1 7.728 0.030 . 1 . . . . 18 LYS H . 11160 1 119 . 1 1 18 18 LYS HA H 1 4.059 0.030 . 1 . . . . 18 LYS HA . 11160 1 120 . 1 1 18 18 LYS HB2 H 1 1.921 0.030 . 2 . . . . 18 LYS HB2 . 11160 1 121 . 1 1 18 18 LYS HB3 H 1 1.861 0.030 . 2 . . . . 18 LYS HB3 . 11160 1 122 . 1 1 18 18 LYS HD2 H 1 1.653 0.030 . 1 . . . . 18 LYS HD2 . 11160 1 123 . 1 1 18 18 LYS HD3 H 1 1.653 0.030 . 1 . . . . 18 LYS HD3 . 11160 1 124 . 1 1 18 18 LYS HE2 H 1 2.956 0.030 . 1 . . . . 18 LYS HE2 . 11160 1 125 . 1 1 18 18 LYS HE3 H 1 2.956 0.030 . 1 . . . . 18 LYS HE3 . 11160 1 126 . 1 1 18 18 LYS HG2 H 1 1.437 0.030 . 1 . . . . 18 LYS HG2 . 11160 1 127 . 1 1 18 18 LYS HG3 H 1 1.437 0.030 . 1 . . . . 18 LYS HG3 . 11160 1 128 . 1 1 18 18 LYS C C 13 178.703 0.300 . 1 . . . . 18 LYS C . 11160 1 129 . 1 1 18 18 LYS CA C 13 58.099 0.300 . 1 . . . . 18 LYS CA . 11160 1 130 . 1 1 18 18 LYS CB C 13 31.903 0.300 . 1 . . . . 18 LYS CB . 11160 1 131 . 1 1 18 18 LYS CD C 13 28.966 0.300 . 1 . . . . 18 LYS CD . 11160 1 132 . 1 1 18 18 LYS CE C 13 42.131 0.300 . 1 . . . . 18 LYS CE . 11160 1 133 . 1 1 18 18 LYS CG C 13 24.970 0.300 . 1 . . . . 18 LYS CG . 11160 1 134 . 1 1 18 18 LYS N N 15 117.935 0.300 . 1 . . . . 18 LYS N . 11160 1 135 . 1 1 19 19 GLU H H 1 7.535 0.030 . 1 . . . . 19 GLU H . 11160 1 136 . 1 1 19 19 GLU HA H 1 3.942 0.030 . 1 . . . . 19 GLU HA . 11160 1 137 . 1 1 19 19 GLU HB2 H 1 2.216 0.030 . 2 . . . . 19 GLU HB2 . 11160 1 138 . 1 1 19 19 GLU HB3 H 1 2.086 0.030 . 2 . . . . 19 GLU HB3 . 11160 1 139 . 1 1 19 19 GLU HG2 H 1 2.289 0.030 . 2 . . . . 19 GLU HG2 . 11160 1 140 . 1 1 19 19 GLU HG3 H 1 2.057 0.030 . 2 . . . . 19 GLU HG3 . 11160 1 141 . 1 1 19 19 GLU C C 13 179.443 0.300 . 1 . . . . 19 GLU C . 11160 1 142 . 1 1 19 19 GLU CA C 13 58.352 0.300 . 1 . . . . 19 GLU CA . 11160 1 143 . 1 1 19 19 GLU CB C 13 29.327 0.300 . 1 . . . . 19 GLU CB . 11160 1 144 . 1 1 19 19 GLU CG C 13 35.931 0.300 . 1 . . . . 19 GLU CG . 11160 1 145 . 1 1 19 19 GLU N N 15 118.013 0.300 . 1 . . . . 19 GLU N . 11160 1 146 . 1 1 20 20 GLU H H 1 7.934 0.030 . 1 . . . . 20 GLU H . 11160 1 147 . 1 1 20 20 GLU HA H 1 4.288 0.030 . 1 . . . . 20 GLU HA . 11160 1 148 . 1 1 20 20 GLU HB2 H 1 2.180 0.030 . 2 . . . . 20 GLU HB2 . 11160 1 149 . 1 1 20 20 GLU HB3 H 1 2.100 0.030 . 2 . . . . 20 GLU HB3 . 11160 1 150 . 1 1 20 20 GLU HG2 H 1 2.517 0.030 . 2 . . . . 20 GLU HG2 . 11160 1 151 . 1 1 20 20 GLU HG3 H 1 2.239 0.030 . 2 . . . . 20 GLU HG3 . 11160 1 152 . 1 1 20 20 GLU C C 13 178.929 0.300 . 1 . . . . 20 GLU C . 11160 1 153 . 1 1 20 20 GLU CA C 13 59.301 0.300 . 1 . . . . 20 GLU CA . 11160 1 154 . 1 1 20 20 GLU CB C 13 29.955 0.300 . 1 . . . . 20 GLU CB . 11160 1 155 . 1 1 20 20 GLU CG C 13 37.684 0.300 . 1 . . . . 20 GLU CG . 11160 1 156 . 1 1 20 20 GLU N N 15 119.875 0.300 . 1 . . . . 20 GLU N . 11160 1 157 . 1 1 21 21 ALA H H 1 7.273 0.030 . 1 . . . . 21 ALA H . 11160 1 158 . 1 1 21 21 ALA HA H 1 4.244 0.030 . 1 . . . . 21 ALA HA . 11160 1 159 . 1 1 21 21 ALA HB1 H 1 1.458 0.030 . 1 . . . . 21 ALA HB . 11160 1 160 . 1 1 21 21 ALA HB2 H 1 1.458 0.030 . 1 . . . . 21 ALA HB . 11160 1 161 . 1 1 21 21 ALA HB3 H 1 1.458 0.030 . 1 . . . . 21 ALA HB . 11160 1 162 . 1 1 21 21 ALA C C 13 178.374 0.300 . 1 . . . . 21 ALA C . 11160 1 163 . 1 1 21 21 ALA CA C 13 53.258 0.300 . 1 . . . . 21 ALA CA . 11160 1 164 . 1 1 21 21 ALA CB C 13 18.452 0.300 . 1 . . . . 21 ALA CB . 11160 1 165 . 1 1 21 21 ALA N N 15 119.167 0.300 . 1 . . . . 21 ALA N . 11160 1 166 . 1 1 22 22 LEU H H 1 7.258 0.030 . 1 . . . . 22 LEU H . 11160 1 167 . 1 1 22 22 LEU HA H 1 4.186 0.030 . 1 . . . . 22 LEU HA . 11160 1 168 . 1 1 22 22 LEU HB2 H 1 1.141 0.030 . 2 . . . . 22 LEU HB2 . 11160 1 169 . 1 1 22 22 LEU HB3 H 1 1.783 0.030 . 2 . . . . 22 LEU HB3 . 11160 1 170 . 1 1 22 22 LEU HD11 H 1 0.874 0.030 . 1 . . . . 22 LEU HD1 . 11160 1 171 . 1 1 22 22 LEU HD12 H 1 0.874 0.030 . 1 . . . . 22 LEU HD1 . 11160 1 172 . 1 1 22 22 LEU HD13 H 1 0.874 0.030 . 1 . . . . 22 LEU HD1 . 11160 1 173 . 1 1 22 22 LEU HD21 H 1 0.770 0.030 . 1 . . . . 22 LEU HD2 . 11160 1 174 . 1 1 22 22 LEU HD22 H 1 0.770 0.030 . 1 . . . . 22 LEU HD2 . 11160 1 175 . 1 1 22 22 LEU HD23 H 1 0.770 0.030 . 1 . . . . 22 LEU HD2 . 11160 1 176 . 1 1 22 22 LEU HG H 1 1.720 0.030 . 1 . . . . 22 LEU HG . 11160 1 177 . 1 1 22 22 LEU C C 13 179.362 0.300 . 1 . . . . 22 LEU C . 11160 1 178 . 1 1 22 22 LEU CA C 13 54.977 0.300 . 1 . . . . 22 LEU CA . 11160 1 179 . 1 1 22 22 LEU CB C 13 42.188 0.300 . 1 . . . . 22 LEU CB . 11160 1 180 . 1 1 22 22 LEU CD1 C 13 25.875 0.300 . 2 . . . . 22 LEU CD1 . 11160 1 181 . 1 1 22 22 LEU CD2 C 13 22.446 0.300 . 2 . . . . 22 LEU CD2 . 11160 1 182 . 1 1 22 22 LEU CG C 13 26.569 0.300 . 1 . . . . 22 LEU CG . 11160 1 183 . 1 1 22 22 LEU N N 15 116.138 0.300 . 1 . . . . 22 LEU N . 11160 1 184 . 1 1 23 23 GLY H H 1 7.550 0.030 . 1 . . . . 23 GLY H . 11160 1 185 . 1 1 23 23 GLY HA2 H 1 3.930 0.030 . 2 . . . . 23 GLY HA2 . 11160 1 186 . 1 1 23 23 GLY HA3 H 1 3.839 0.030 . 2 . . . . 23 GLY HA3 . 11160 1 187 . 1 1 23 23 GLY C C 13 176.763 0.300 . 1 . . . . 23 GLY C . 11160 1 188 . 1 1 23 23 GLY CA C 13 47.399 0.300 . 1 . . . . 23 GLY CA . 11160 1 189 . 1 1 23 23 GLY N N 15 110.105 0.300 . 1 . . . . 23 GLY N . 11160 1 190 . 1 1 24 24 GLU H H 1 9.465 0.030 . 1 . . . . 24 GLU H . 11160 1 191 . 1 1 24 24 GLU HA H 1 4.080 0.030 . 1 . . . . 24 GLU HA . 11160 1 192 . 1 1 24 24 GLU HB2 H 1 2.184 0.030 . 2 . . . . 24 GLU HB2 . 11160 1 193 . 1 1 24 24 GLU HB3 H 1 2.075 0.030 . 2 . . . . 24 GLU HB3 . 11160 1 194 . 1 1 24 24 GLU HG2 H 1 2.327 0.030 . 2 . . . . 24 GLU HG2 . 11160 1 195 . 1 1 24 24 GLU HG3 H 1 2.239 0.030 . 2 . . . . 24 GLU HG3 . 11160 1 196 . 1 1 24 24 GLU C C 13 175.067 0.300 . 1 . . . . 24 GLU C . 11160 1 197 . 1 1 24 24 GLU CA C 13 58.029 0.300 . 1 . . . . 24 GLU CA . 11160 1 198 . 1 1 24 24 GLU CB C 13 28.811 0.300 . 1 . . . . 24 GLU CB . 11160 1 199 . 1 1 24 24 GLU CG C 13 36.592 0.300 . 1 . . . . 24 GLU CG . 11160 1 200 . 1 1 24 24 GLU N N 15 127.402 0.300 . 1 . . . . 24 GLU N . 11160 1 201 . 1 1 25 25 MET H H 1 7.949 0.030 . 1 . . . . 25 MET H . 11160 1 202 . 1 1 25 25 MET HA H 1 4.653 0.030 . 1 . . . . 25 MET HA . 11160 1 203 . 1 1 25 25 MET HB2 H 1 2.017 0.030 . 2 . . . . 25 MET HB2 . 11160 1 204 . 1 1 25 25 MET HB3 H 1 2.333 0.030 . 2 . . . . 25 MET HB3 . 11160 1 205 . 1 1 25 25 MET HE1 H 1 1.999 0.030 . 1 . . . . 25 MET HE . 11160 1 206 . 1 1 25 25 MET HE2 H 1 1.999 0.030 . 1 . . . . 25 MET HE . 11160 1 207 . 1 1 25 25 MET HE3 H 1 1.999 0.030 . 1 . . . . 25 MET HE . 11160 1 208 . 1 1 25 25 MET HG2 H 1 2.697 0.030 . 2 . . . . 25 MET HG2 . 11160 1 209 . 1 1 25 25 MET HG3 H 1 2.388 0.030 . 2 . . . . 25 MET HG3 . 11160 1 210 . 1 1 25 25 MET C C 13 175.084 0.300 . 1 . . . . 25 MET C . 11160 1 211 . 1 1 25 25 MET CA C 13 53.704 0.300 . 1 . . . . 25 MET CA . 11160 1 212 . 1 1 25 25 MET CB C 13 30.546 0.300 . 1 . . . . 25 MET CB . 11160 1 213 . 1 1 25 25 MET CE C 13 16.123 0.300 . 1 . . . . 25 MET CE . 11160 1 214 . 1 1 25 25 MET CG C 13 32.247 0.300 . 1 . . . . 25 MET CG . 11160 1 215 . 1 1 25 25 MET N N 15 116.254 0.300 . 1 . . . . 25 MET N . 11160 1 216 . 1 1 26 26 ALA H H 1 6.735 0.030 . 1 . . . . 26 ALA H . 11160 1 217 . 1 1 26 26 ALA HA H 1 4.178 0.030 . 1 . . . . 26 ALA HA . 11160 1 218 . 1 1 26 26 ALA HB1 H 1 1.362 0.030 . 1 . . . . 26 ALA HB . 11160 1 219 . 1 1 26 26 ALA HB2 H 1 1.362 0.030 . 1 . . . . 26 ALA HB . 11160 1 220 . 1 1 26 26 ALA HB3 H 1 1.362 0.030 . 1 . . . . 26 ALA HB . 11160 1 221 . 1 1 26 26 ALA C C 13 177.393 0.300 . 1 . . . . 26 ALA C . 11160 1 222 . 1 1 26 26 ALA CA C 13 53.574 0.300 . 1 . . . . 26 ALA CA . 11160 1 223 . 1 1 26 26 ALA CB C 13 18.941 0.300 . 1 . . . . 26 ALA CB . 11160 1 224 . 1 1 26 26 ALA N N 15 119.781 0.300 . 1 . . . . 26 ALA N . 11160 1 225 . 1 1 27 27 THR H H 1 10.188 0.030 . 1 . . . . 27 THR H . 11160 1 226 . 1 1 27 27 THR HA H 1 4.604 0.030 . 1 . . . . 27 THR HA . 11160 1 227 . 1 1 27 27 THR HB H 1 4.320 0.030 . 1 . . . . 27 THR HB . 11160 1 228 . 1 1 27 27 THR HG21 H 1 1.181 0.030 . 1 . . . . 27 THR HG2 . 11160 1 229 . 1 1 27 27 THR HG22 H 1 1.181 0.030 . 1 . . . . 27 THR HG2 . 11160 1 230 . 1 1 27 27 THR HG23 H 1 1.181 0.030 . 1 . . . . 27 THR HG2 . 11160 1 231 . 1 1 27 27 THR C C 13 173.567 0.300 . 1 . . . . 27 THR C . 11160 1 232 . 1 1 27 27 THR CA C 13 61.782 0.300 . 1 . . . . 27 THR CA . 11160 1 233 . 1 1 27 27 THR CB C 13 70.105 0.300 . 1 . . . . 27 THR CB . 11160 1 234 . 1 1 27 27 THR CG2 C 13 21.868 0.300 . 1 . . . . 27 THR CG2 . 11160 1 235 . 1 1 27 27 THR N N 15 110.963 0.300 . 1 . . . . 27 THR N . 11160 1 236 . 1 1 28 28 VAL H H 1 6.650 0.030 . 1 . . . . 28 VAL H . 11160 1 237 . 1 1 28 28 VAL HA H 1 4.154 0.030 . 1 . . . . 28 VAL HA . 11160 1 238 . 1 1 28 28 VAL HB H 1 1.275 0.030 . 1 . . . . 28 VAL HB . 11160 1 239 . 1 1 28 28 VAL HG11 H 1 0.184 0.030 . 1 . . . . 28 VAL HG1 . 11160 1 240 . 1 1 28 28 VAL HG12 H 1 0.184 0.030 . 1 . . . . 28 VAL HG1 . 11160 1 241 . 1 1 28 28 VAL HG13 H 1 0.184 0.030 . 1 . . . . 28 VAL HG1 . 11160 1 242 . 1 1 28 28 VAL HG21 H 1 0.679 0.030 . 1 . . . . 28 VAL HG2 . 11160 1 243 . 1 1 28 28 VAL HG22 H 1 0.679 0.030 . 1 . . . . 28 VAL HG2 . 11160 1 244 . 1 1 28 28 VAL HG23 H 1 0.679 0.030 . 1 . . . . 28 VAL HG2 . 11160 1 245 . 1 1 28 28 VAL C C 13 176.031 0.300 . 1 . . . . 28 VAL C . 11160 1 246 . 1 1 28 28 VAL CA C 13 60.038 0.300 . 1 . . . . 28 VAL CA . 11160 1 247 . 1 1 28 28 VAL CB C 13 34.014 0.300 . 1 . . . . 28 VAL CB . 11160 1 248 . 1 1 28 28 VAL CG1 C 13 20.875 0.300 . 2 . . . . 28 VAL CG1 . 11160 1 249 . 1 1 28 28 VAL CG2 C 13 20.715 0.300 . 2 . . . . 28 VAL CG2 . 11160 1 250 . 1 1 28 28 VAL N N 15 121.391 0.300 . 1 . . . . 28 VAL N . 11160 1 251 . 1 1 29 29 ALA H H 1 9.157 0.030 . 1 . . . . 29 ALA H . 11160 1 252 . 1 1 29 29 ALA HA H 1 3.725 0.030 . 1 . . . . 29 ALA HA . 11160 1 253 . 1 1 29 29 ALA HB1 H 1 1.177 0.030 . 1 . . . . 29 ALA HB . 11160 1 254 . 1 1 29 29 ALA HB2 H 1 1.177 0.030 . 1 . . . . 29 ALA HB . 11160 1 255 . 1 1 29 29 ALA HB3 H 1 1.177 0.030 . 1 . . . . 29 ALA HB . 11160 1 256 . 1 1 29 29 ALA C C 13 173.760 0.300 . 1 . . . . 29 ALA C . 11160 1 257 . 1 1 29 29 ALA CA C 13 57.146 0.300 . 1 . . . . 29 ALA CA . 11160 1 258 . 1 1 29 29 ALA CB C 13 16.843 0.300 . 1 . . . . 29 ALA CB . 11160 1 259 . 1 1 29 29 ALA N N 15 131.246 0.300 . 1 . . . . 29 ALA N . 11160 1 260 . 1 1 30 30 PRO HA H 1 2.939 0.030 . 1 . . . . 30 PRO HA . 11160 1 261 . 1 1 30 30 PRO HB2 H 1 0.626 0.030 . 2 . . . . 30 PRO HB2 . 11160 1 262 . 1 1 30 30 PRO HB3 H 1 1.144 0.030 . 2 . . . . 30 PRO HB3 . 11160 1 263 . 1 1 30 30 PRO HD2 H 1 3.107 0.030 . 2 . . . . 30 PRO HD2 . 11160 1 264 . 1 1 30 30 PRO HD3 H 1 2.376 0.030 . 2 . . . . 30 PRO HD3 . 11160 1 265 . 1 1 30 30 PRO HG2 H 1 1.116 0.030 . 2 . . . . 30 PRO HG2 . 11160 1 266 . 1 1 30 30 PRO HG3 H 1 0.458 0.030 . 2 . . . . 30 PRO HG3 . 11160 1 267 . 1 1 30 30 PRO CA C 13 65.510 0.300 . 1 . . . . 30 PRO CA . 11160 1 268 . 1 1 30 30 PRO CB C 13 30.084 0.300 . 1 . . . . 30 PRO CB . 11160 1 269 . 1 1 30 30 PRO CD C 13 48.662 0.300 . 1 . . . . 30 PRO CD . 11160 1 270 . 1 1 30 30 PRO CG C 13 26.968 0.300 . 1 . . . . 30 PRO CG . 11160 1 271 . 1 1 31 31 VAL H H 1 5.453 0.030 . 1 . . . . 31 VAL H . 11160 1 272 . 1 1 31 31 VAL HA H 1 3.672 0.030 . 1 . . . . 31 VAL HA . 11160 1 273 . 1 1 31 31 VAL HB H 1 1.380 0.030 . 1 . . . . 31 VAL HB . 11160 1 274 . 1 1 31 31 VAL HG11 H 1 0.805 0.030 . 1 . . . . 31 VAL HG1 . 11160 1 275 . 1 1 31 31 VAL HG12 H 1 0.805 0.030 . 1 . . . . 31 VAL HG1 . 11160 1 276 . 1 1 31 31 VAL HG13 H 1 0.805 0.030 . 1 . . . . 31 VAL HG1 . 11160 1 277 . 1 1 31 31 VAL HG21 H 1 0.270 0.030 . 1 . . . . 31 VAL HG2 . 11160 1 278 . 1 1 31 31 VAL HG22 H 1 0.270 0.030 . 1 . . . . 31 VAL HG2 . 11160 1 279 . 1 1 31 31 VAL HG23 H 1 0.270 0.030 . 1 . . . . 31 VAL HG2 . 11160 1 280 . 1 1 31 31 VAL C C 13 176.546 0.300 . 1 . . . . 31 VAL C . 11160 1 281 . 1 1 31 31 VAL CA C 13 63.589 0.300 . 1 . . . . 31 VAL CA . 11160 1 282 . 1 1 31 31 VAL CB C 13 32.084 0.300 . 1 . . . . 31 VAL CB . 11160 1 283 . 1 1 31 31 VAL CG1 C 13 21.353 0.300 . 2 . . . . 31 VAL CG1 . 11160 1 284 . 1 1 31 31 VAL CG2 C 13 22.429 0.300 . 2 . . . . 31 VAL CG2 . 11160 1 285 . 1 1 31 31 VAL N N 15 111.271 0.300 . 1 . . . . 31 VAL N . 11160 1 286 . 1 1 32 32 LEU H H 1 7.873 0.030 . 1 . . . . 32 LEU H . 11160 1 287 . 1 1 32 32 LEU HA H 1 3.860 0.030 . 1 . . . . 32 LEU HA . 11160 1 288 . 1 1 32 32 LEU HB2 H 1 2.043 0.030 . 2 . . . . 32 LEU HB2 . 11160 1 289 . 1 1 32 32 LEU HB3 H 1 1.283 0.030 . 2 . . . . 32 LEU HB3 . 11160 1 290 . 1 1 32 32 LEU HD11 H 1 1.108 0.030 . 1 . . . . 32 LEU HD1 . 11160 1 291 . 1 1 32 32 LEU HD12 H 1 1.108 0.030 . 1 . . . . 32 LEU HD1 . 11160 1 292 . 1 1 32 32 LEU HD13 H 1 1.108 0.030 . 1 . . . . 32 LEU HD1 . 11160 1 293 . 1 1 32 32 LEU HD21 H 1 1.081 0.030 . 1 . . . . 32 LEU HD2 . 11160 1 294 . 1 1 32 32 LEU HD22 H 1 1.081 0.030 . 1 . . . . 32 LEU HD2 . 11160 1 295 . 1 1 32 32 LEU HD23 H 1 1.081 0.030 . 1 . . . . 32 LEU HD2 . 11160 1 296 . 1 1 32 32 LEU HG H 1 1.752 0.030 . 1 . . . . 32 LEU HG . 11160 1 297 . 1 1 32 32 LEU C C 13 177.601 0.300 . 1 . . . . 32 LEU C . 11160 1 298 . 1 1 32 32 LEU CA C 13 58.506 0.300 . 1 . . . . 32 LEU CA . 11160 1 299 . 1 1 32 32 LEU CB C 13 42.126 0.300 . 1 . . . . 32 LEU CB . 11160 1 300 . 1 1 32 32 LEU CD1 C 13 24.339 0.300 . 2 . . . . 32 LEU CD1 . 11160 1 301 . 1 1 32 32 LEU CD2 C 13 27.222 0.300 . 2 . . . . 32 LEU CD2 . 11160 1 302 . 1 1 32 32 LEU CG C 13 27.354 0.300 . 1 . . . . 32 LEU CG . 11160 1 303 . 1 1 32 32 LEU N N 15 121.258 0.300 . 1 . . . . 32 LEU N . 11160 1 304 . 1 1 33 33 TYR H H 1 8.253 0.030 . 1 . . . . 33 TYR H . 11160 1 305 . 1 1 33 33 TYR HA H 1 3.586 0.030 . 1 . . . . 33 TYR HA . 11160 1 306 . 1 1 33 33 TYR HB2 H 1 3.240 0.030 . 2 . . . . 33 TYR HB2 . 11160 1 307 . 1 1 33 33 TYR HB3 H 1 2.750 0.030 . 2 . . . . 33 TYR HB3 . 11160 1 308 . 1 1 33 33 TYR HD1 H 1 6.420 0.030 . 1 . . . . 33 TYR HD1 . 11160 1 309 . 1 1 33 33 TYR HD2 H 1 6.420 0.030 . 1 . . . . 33 TYR HD2 . 11160 1 310 . 1 1 33 33 TYR HE1 H 1 6.657 0.030 . 1 . . . . 33 TYR HE1 . 11160 1 311 . 1 1 33 33 TYR HE2 H 1 6.657 0.030 . 1 . . . . 33 TYR HE2 . 11160 1 312 . 1 1 33 33 TYR C C 13 178.997 0.300 . 1 . . . . 33 TYR C . 11160 1 313 . 1 1 33 33 TYR CA C 13 61.642 0.300 . 1 . . . . 33 TYR CA . 11160 1 314 . 1 1 33 33 TYR CB C 13 38.970 0.300 . 1 . . . . 33 TYR CB . 11160 1 315 . 1 1 33 33 TYR CD1 C 13 132.895 0.300 . 1 . . . . 33 TYR CD1 . 11160 1 316 . 1 1 33 33 TYR CD2 C 13 132.895 0.300 . 1 . . . . 33 TYR CD2 . 11160 1 317 . 1 1 33 33 TYR CE1 C 13 117.510 0.300 . 1 . . . . 33 TYR CE1 . 11160 1 318 . 1 1 33 33 TYR CE2 C 13 117.510 0.300 . 1 . . . . 33 TYR CE2 . 11160 1 319 . 1 1 33 33 TYR N N 15 114.986 0.300 . 1 . . . . 33 TYR N . 11160 1 320 . 1 1 34 34 THR H H 1 8.101 0.030 . 1 . . . . 34 THR H . 11160 1 321 . 1 1 34 34 THR HA H 1 4.126 0.030 . 1 . . . . 34 THR HA . 11160 1 322 . 1 1 34 34 THR HB H 1 4.345 0.030 . 1 . . . . 34 THR HB . 11160 1 323 . 1 1 34 34 THR HG21 H 1 1.449 0.030 . 1 . . . . 34 THR HG2 . 11160 1 324 . 1 1 34 34 THR HG22 H 1 1.449 0.030 . 1 . . . . 34 THR HG2 . 11160 1 325 . 1 1 34 34 THR HG23 H 1 1.449 0.030 . 1 . . . . 34 THR HG2 . 11160 1 326 . 1 1 34 34 THR C C 13 177.185 0.300 . 1 . . . . 34 THR C . 11160 1 327 . 1 1 34 34 THR CA C 13 66.343 0.300 . 1 . . . . 34 THR CA . 11160 1 328 . 1 1 34 34 THR CB C 13 67.685 0.300 . 1 . . . . 34 THR CB . 11160 1 329 . 1 1 34 34 THR CG2 C 13 24.678 0.300 . 1 . . . . 34 THR CG2 . 11160 1 330 . 1 1 34 34 THR N N 15 112.645 0.300 . 1 . . . . 34 THR N . 11160 1 331 . 1 1 35 35 ASN H H 1 9.287 0.030 . 1 . . . . 35 ASN H . 11160 1 332 . 1 1 35 35 ASN HA H 1 4.453 0.030 . 1 . . . . 35 ASN HA . 11160 1 333 . 1 1 35 35 ASN HB2 H 1 2.582 0.030 . 2 . . . . 35 ASN HB2 . 11160 1 334 . 1 1 35 35 ASN HB3 H 1 3.089 0.030 . 2 . . . . 35 ASN HB3 . 11160 1 335 . 1 1 35 35 ASN HD21 H 1 6.610 0.030 . 2 . . . . 35 ASN HD21 . 11160 1 336 . 1 1 35 35 ASN HD22 H 1 7.866 0.030 . 2 . . . . 35 ASN HD22 . 11160 1 337 . 1 1 35 35 ASN C C 13 178.099 0.300 . 1 . . . . 35 ASN C . 11160 1 338 . 1 1 35 35 ASN CA C 13 55.012 0.300 . 1 . . . . 35 ASN CA . 11160 1 339 . 1 1 35 35 ASN CB C 13 37.178 0.300 . 1 . . . . 35 ASN CB . 11160 1 340 . 1 1 35 35 ASN N N 15 123.450 0.300 . 1 . . . . 35 ASN N . 11160 1 341 . 1 1 35 35 ASN ND2 N 15 106.322 0.300 . 1 . . . . 35 ASN ND2 . 11160 1 342 . 1 1 36 36 ILE H H 1 7.628 0.030 . 1 . . . . 36 ILE H . 11160 1 343 . 1 1 36 36 ILE HA H 1 3.816 0.030 . 1 . . . . 36 ILE HA . 11160 1 344 . 1 1 36 36 ILE HB H 1 1.699 0.030 . 1 . . . . 36 ILE HB . 11160 1 345 . 1 1 36 36 ILE HD11 H 1 1.024 0.030 . 1 . . . . 36 ILE HD1 . 11160 1 346 . 1 1 36 36 ILE HD12 H 1 1.024 0.030 . 1 . . . . 36 ILE HD1 . 11160 1 347 . 1 1 36 36 ILE HD13 H 1 1.024 0.030 . 1 . . . . 36 ILE HD1 . 11160 1 348 . 1 1 36 36 ILE HG12 H 1 1.272 0.030 . 2 . . . . 36 ILE HG12 . 11160 1 349 . 1 1 36 36 ILE HG13 H 1 1.780 0.030 . 2 . . . . 36 ILE HG13 . 11160 1 350 . 1 1 36 36 ILE HG21 H 1 0.906 0.030 . 1 . . . . 36 ILE HG2 . 11160 1 351 . 1 1 36 36 ILE HG22 H 1 0.906 0.030 . 1 . . . . 36 ILE HG2 . 11160 1 352 . 1 1 36 36 ILE HG23 H 1 0.906 0.030 . 1 . . . . 36 ILE HG2 . 11160 1 353 . 1 1 36 36 ILE C C 13 177.061 0.300 . 1 . . . . 36 ILE C . 11160 1 354 . 1 1 36 36 ILE CA C 13 63.783 0.300 . 1 . . . . 36 ILE CA . 11160 1 355 . 1 1 36 36 ILE CB C 13 39.211 0.300 . 1 . . . . 36 ILE CB . 11160 1 356 . 1 1 36 36 ILE CD1 C 13 13.350 0.300 . 1 . . . . 36 ILE CD1 . 11160 1 357 . 1 1 36 36 ILE CG1 C 13 29.231 0.300 . 1 . . . . 36 ILE CG1 . 11160 1 358 . 1 1 36 36 ILE CG2 C 13 16.707 0.300 . 1 . . . . 36 ILE CG2 . 11160 1 359 . 1 1 36 36 ILE N N 15 115.073 0.300 . 1 . . . . 36 ILE N . 11160 1 360 . 1 1 37 37 ASN H H 1 7.801 0.030 . 1 . . . . 37 ASN H . 11160 1 361 . 1 1 37 37 ASN HA H 1 4.294 0.030 . 1 . . . . 37 ASN HA . 11160 1 362 . 1 1 37 37 ASN HB2 H 1 1.872 0.030 . 2 . . . . 37 ASN HB2 . 11160 1 363 . 1 1 37 37 ASN HB3 H 1 1.757 0.030 . 2 . . . . 37 ASN HB3 . 11160 1 364 . 1 1 37 37 ASN HD21 H 1 6.973 0.030 . 2 . . . . 37 ASN HD21 . 11160 1 365 . 1 1 37 37 ASN HD22 H 1 6.393 0.030 . 2 . . . . 37 ASN HD22 . 11160 1 366 . 1 1 37 37 ASN C C 13 174.154 0.300 . 1 . . . . 37 ASN C . 11160 1 367 . 1 1 37 37 ASN CA C 13 55.643 0.300 . 1 . . . . 37 ASN CA . 11160 1 368 . 1 1 37 37 ASN CB C 13 40.573 0.300 . 1 . . . . 37 ASN CB . 11160 1 369 . 1 1 37 37 ASN N N 15 113.567 0.300 . 1 . . . . 37 ASN N . 11160 1 370 . 1 1 37 37 ASN ND2 N 15 115.175 0.300 . 1 . . . . 37 ASN ND2 . 11160 1 371 . 1 1 38 38 PHE H H 1 8.587 0.030 . 1 . . . . 38 PHE H . 11160 1 372 . 1 1 38 38 PHE HA H 1 5.049 0.030 . 1 . . . . 38 PHE HA . 11160 1 373 . 1 1 38 38 PHE HB2 H 1 2.807 0.030 . 2 . . . . 38 PHE HB2 . 11160 1 374 . 1 1 38 38 PHE HB3 H 1 3.214 0.030 . 2 . . . . 38 PHE HB3 . 11160 1 375 . 1 1 38 38 PHE HD1 H 1 7.056 0.030 . 1 . . . . 38 PHE HD1 . 11160 1 376 . 1 1 38 38 PHE HD2 H 1 7.056 0.030 . 1 . . . . 38 PHE HD2 . 11160 1 377 . 1 1 38 38 PHE HE1 H 1 7.222 0.030 . 1 . . . . 38 PHE HE1 . 11160 1 378 . 1 1 38 38 PHE HE2 H 1 7.222 0.030 . 1 . . . . 38 PHE HE2 . 11160 1 379 . 1 1 38 38 PHE HZ H 1 7.356 0.030 . 1 . . . . 38 PHE HZ . 11160 1 380 . 1 1 38 38 PHE C C 13 174.076 0.300 . 1 . . . . 38 PHE C . 11160 1 381 . 1 1 38 38 PHE CA C 13 55.798 0.300 . 1 . . . . 38 PHE CA . 11160 1 382 . 1 1 38 38 PHE CB C 13 39.663 0.300 . 1 . . . . 38 PHE CB . 11160 1 383 . 1 1 38 38 PHE CD1 C 13 132.152 0.300 . 1 . . . . 38 PHE CD1 . 11160 1 384 . 1 1 38 38 PHE CD2 C 13 132.152 0.300 . 1 . . . . 38 PHE CD2 . 11160 1 385 . 1 1 38 38 PHE CE1 C 13 131.221 0.300 . 1 . . . . 38 PHE CE1 . 11160 1 386 . 1 1 38 38 PHE CE2 C 13 131.221 0.300 . 1 . . . . 38 PHE CE2 . 11160 1 387 . 1 1 38 38 PHE CZ C 13 130.278 0.300 . 1 . . . . 38 PHE CZ . 11160 1 388 . 1 1 38 38 PHE N N 15 117.436 0.300 . 1 . . . . 38 PHE N . 11160 1 389 . 1 1 39 39 PRO HA H 1 4.501 0.030 . 1 . . . . 39 PRO HA . 11160 1 390 . 1 1 39 39 PRO HB2 H 1 2.034 0.030 . 2 . . . . 39 PRO HB2 . 11160 1 391 . 1 1 39 39 PRO HB3 H 1 2.374 0.030 . 2 . . . . 39 PRO HB3 . 11160 1 392 . 1 1 39 39 PRO HD2 H 1 3.504 0.030 . 2 . . . . 39 PRO HD2 . 11160 1 393 . 1 1 39 39 PRO HD3 H 1 3.141 0.030 . 2 . . . . 39 PRO HD3 . 11160 1 394 . 1 1 39 39 PRO HG2 H 1 1.843 0.030 . 2 . . . . 39 PRO HG2 . 11160 1 395 . 1 1 39 39 PRO HG3 H 1 1.974 0.030 . 2 . . . . 39 PRO HG3 . 11160 1 396 . 1 1 39 39 PRO C C 13 177.323 0.300 . 1 . . . . 39 PRO C . 11160 1 397 . 1 1 39 39 PRO CA C 13 64.665 0.300 . 1 . . . . 39 PRO CA . 11160 1 398 . 1 1 39 39 PRO CB C 13 31.946 0.300 . 1 . . . . 39 PRO CB . 11160 1 399 . 1 1 39 39 PRO CD C 13 50.435 0.300 . 1 . . . . 39 PRO CD . 11160 1 400 . 1 1 39 39 PRO CG C 13 27.140 0.300 . 1 . . . . 39 PRO CG . 11160 1 401 . 1 1 40 40 ASN H H 1 8.797 0.030 . 1 . . . . 40 ASN H . 11160 1 402 . 1 1 40 40 ASN HA H 1 5.113 0.030 . 1 . . . . 40 ASN HA . 11160 1 403 . 1 1 40 40 ASN HB2 H 1 2.759 0.030 . 2 . . . . 40 ASN HB2 . 11160 1 404 . 1 1 40 40 ASN HB3 H 1 3.035 0.030 . 2 . . . . 40 ASN HB3 . 11160 1 405 . 1 1 40 40 ASN HD21 H 1 6.958 0.030 . 2 . . . . 40 ASN HD21 . 11160 1 406 . 1 1 40 40 ASN HD22 H 1 7.768 0.030 . 2 . . . . 40 ASN HD22 . 11160 1 407 . 1 1 40 40 ASN C C 13 176.689 0.300 . 1 . . . . 40 ASN C . 11160 1 408 . 1 1 40 40 ASN CA C 13 52.909 0.300 . 1 . . . . 40 ASN CA . 11160 1 409 . 1 1 40 40 ASN CB C 13 38.585 0.300 . 1 . . . . 40 ASN CB . 11160 1 410 . 1 1 40 40 ASN N N 15 116.707 0.300 . 1 . . . . 40 ASN N . 11160 1 411 . 1 1 40 40 ASN ND2 N 15 113.632 0.300 . 1 . . . . 40 ASN ND2 . 11160 1 412 . 1 1 41 41 LEU H H 1 7.826 0.030 . 1 . . . . 41 LEU H . 11160 1 413 . 1 1 41 41 LEU HA H 1 4.244 0.030 . 1 . . . . 41 LEU HA . 11160 1 414 . 1 1 41 41 LEU HB2 H 1 2.150 0.030 . 2 . . . . 41 LEU HB2 . 11160 1 415 . 1 1 41 41 LEU HB3 H 1 1.866 0.030 . 2 . . . . 41 LEU HB3 . 11160 1 416 . 1 1 41 41 LEU HD11 H 1 0.983 0.030 . 1 . . . . 41 LEU HD1 . 11160 1 417 . 1 1 41 41 LEU HD12 H 1 0.983 0.030 . 1 . . . . 41 LEU HD1 . 11160 1 418 . 1 1 41 41 LEU HD13 H 1 0.983 0.030 . 1 . . . . 41 LEU HD1 . 11160 1 419 . 1 1 41 41 LEU HD21 H 1 0.880 0.030 . 1 . . . . 41 LEU HD2 . 11160 1 420 . 1 1 41 41 LEU HD22 H 1 0.880 0.030 . 1 . . . . 41 LEU HD2 . 11160 1 421 . 1 1 41 41 LEU HD23 H 1 0.880 0.030 . 1 . . . . 41 LEU HD2 . 11160 1 422 . 1 1 41 41 LEU HG H 1 1.902 0.030 . 1 . . . . 41 LEU HG . 11160 1 423 . 1 1 41 41 LEU C C 13 178.517 0.300 . 1 . . . . 41 LEU C . 11160 1 424 . 1 1 41 41 LEU CA C 13 58.836 0.300 . 1 . . . . 41 LEU CA . 11160 1 425 . 1 1 41 41 LEU CB C 13 42.608 0.300 . 1 . . . . 41 LEU CB . 11160 1 426 . 1 1 41 41 LEU CD1 C 13 25.080 0.300 . 2 . . . . 41 LEU CD1 . 11160 1 427 . 1 1 41 41 LEU CD2 C 13 25.883 0.300 . 2 . . . . 41 LEU CD2 . 11160 1 428 . 1 1 41 41 LEU CG C 13 26.895 0.300 . 1 . . . . 41 LEU CG . 11160 1 429 . 1 1 41 41 LEU N N 15 123.597 0.300 . 1 . . . . 41 LEU N . 11160 1 430 . 1 1 42 42 LYS H H 1 8.580 0.030 . 1 . . . . 42 LYS H . 11160 1 431 . 1 1 42 42 LYS HA H 1 3.970 0.030 . 1 . . . . 42 LYS HA . 11160 1 432 . 1 1 42 42 LYS HB2 H 1 1.834 0.030 . 1 . . . . 42 LYS HB2 . 11160 1 433 . 1 1 42 42 LYS HB3 H 1 1.834 0.030 . 1 . . . . 42 LYS HB3 . 11160 1 434 . 1 1 42 42 LYS HD2 H 1 1.720 0.030 . 1 . . . . 42 LYS HD2 . 11160 1 435 . 1 1 42 42 LYS HD3 H 1 1.720 0.030 . 1 . . . . 42 LYS HD3 . 11160 1 436 . 1 1 42 42 LYS HE2 H 1 3.029 0.030 . 1 . . . . 42 LYS HE2 . 11160 1 437 . 1 1 42 42 LYS HE3 H 1 3.029 0.030 . 1 . . . . 42 LYS HE3 . 11160 1 438 . 1 1 42 42 LYS HG2 H 1 1.393 0.030 . 2 . . . . 42 LYS HG2 . 11160 1 439 . 1 1 42 42 LYS HG3 H 1 1.486 0.030 . 2 . . . . 42 LYS HG3 . 11160 1 440 . 1 1 42 42 LYS C C 13 177.098 0.300 . 1 . . . . 42 LYS C . 11160 1 441 . 1 1 42 42 LYS CA C 13 59.052 0.300 . 1 . . . . 42 LYS CA . 11160 1 442 . 1 1 42 42 LYS CB C 13 31.671 0.300 . 1 . . . . 42 LYS CB . 11160 1 443 . 1 1 42 42 LYS CD C 13 29.611 0.300 . 1 . . . . 42 LYS CD . 11160 1 444 . 1 1 42 42 LYS CE C 13 41.844 0.300 . 1 . . . . 42 LYS CE . 11160 1 445 . 1 1 42 42 LYS CG C 13 24.998 0.300 . 1 . . . . 42 LYS CG . 11160 1 446 . 1 1 42 42 LYS N N 15 115.118 0.300 . 1 . . . . 42 LYS N . 11160 1 447 . 1 1 43 43 GLU H H 1 7.553 0.030 . 1 . . . . 43 GLU H . 11160 1 448 . 1 1 43 43 GLU HA H 1 4.077 0.030 . 1 . . . . 43 GLU HA . 11160 1 449 . 1 1 43 43 GLU HB2 H 1 2.077 0.030 . 1 . . . . 43 GLU HB2 . 11160 1 450 . 1 1 43 43 GLU HB3 H 1 2.077 0.030 . 1 . . . . 43 GLU HB3 . 11160 1 451 . 1 1 43 43 GLU HG2 H 1 2.245 0.030 . 2 . . . . 43 GLU HG2 . 11160 1 452 . 1 1 43 43 GLU HG3 H 1 2.289 0.030 . 2 . . . . 43 GLU HG3 . 11160 1 453 . 1 1 43 43 GLU C C 13 177.953 0.300 . 1 . . . . 43 GLU C . 11160 1 454 . 1 1 43 43 GLU CA C 13 58.128 0.300 . 1 . . . . 43 GLU CA . 11160 1 455 . 1 1 43 43 GLU CB C 13 29.588 0.300 . 1 . . . . 43 GLU CB . 11160 1 456 . 1 1 43 43 GLU CG C 13 36.568 0.300 . 1 . . . . 43 GLU CG . 11160 1 457 . 1 1 43 43 GLU N N 15 117.550 0.300 . 1 . . . . 43 GLU N . 11160 1 458 . 1 1 44 44 GLU H H 1 7.406 0.030 . 1 . . . . 44 GLU H . 11160 1 459 . 1 1 44 44 GLU HA H 1 3.857 0.030 . 1 . . . . 44 GLU HA . 11160 1 460 . 1 1 44 44 GLU HB2 H 1 1.588 0.030 . 2 . . . . 44 GLU HB2 . 11160 1 461 . 1 1 44 44 GLU HB3 H 1 1.877 0.030 . 2 . . . . 44 GLU HB3 . 11160 1 462 . 1 1 44 44 GLU HG2 H 1 2.101 0.030 . 2 . . . . 44 GLU HG2 . 11160 1 463 . 1 1 44 44 GLU HG3 H 1 1.672 0.030 . 2 . . . . 44 GLU HG3 . 11160 1 464 . 1 1 44 44 GLU C C 13 176.440 0.300 . 1 . . . . 44 GLU C . 11160 1 465 . 1 1 44 44 GLU CA C 13 57.953 0.300 . 1 . . . . 44 GLU CA . 11160 1 466 . 1 1 44 44 GLU CB C 13 31.192 0.300 . 1 . . . . 44 GLU CB . 11160 1 467 . 1 1 44 44 GLU CG C 13 36.430 0.300 . 1 . . . . 44 GLU CG . 11160 1 468 . 1 1 44 44 GLU N N 15 118.433 0.300 . 1 . . . . 44 GLU N . 11160 1 469 . 1 1 45 45 PHE H H 1 8.175 0.030 . 1 . . . . 45 PHE H . 11160 1 470 . 1 1 45 45 PHE HA H 1 4.928 0.030 . 1 . . . . 45 PHE HA . 11160 1 471 . 1 1 45 45 PHE HB2 H 1 2.691 0.030 . 2 . . . . 45 PHE HB2 . 11160 1 472 . 1 1 45 45 PHE HB3 H 1 2.808 0.030 . 2 . . . . 45 PHE HB3 . 11160 1 473 . 1 1 45 45 PHE HD1 H 1 7.225 0.030 . 1 . . . . 45 PHE HD1 . 11160 1 474 . 1 1 45 45 PHE HD2 H 1 7.225 0.030 . 1 . . . . 45 PHE HD2 . 11160 1 475 . 1 1 45 45 PHE HE1 H 1 7.255 0.030 . 1 . . . . 45 PHE HE1 . 11160 1 476 . 1 1 45 45 PHE HE2 H 1 7.255 0.030 . 1 . . . . 45 PHE HE2 . 11160 1 477 . 1 1 45 45 PHE HZ H 1 7.153 0.030 . 1 . . . . 45 PHE HZ . 11160 1 478 . 1 1 45 45 PHE C C 13 171.794 0.300 . 1 . . . . 45 PHE C . 11160 1 479 . 1 1 45 45 PHE CA C 13 54.497 0.300 . 1 . . . . 45 PHE CA . 11160 1 480 . 1 1 45 45 PHE CB C 13 39.089 0.300 . 1 . . . . 45 PHE CB . 11160 1 481 . 1 1 45 45 PHE CD1 C 13 132.321 0.300 . 1 . . . . 45 PHE CD1 . 11160 1 482 . 1 1 45 45 PHE CD2 C 13 132.321 0.300 . 1 . . . . 45 PHE CD2 . 11160 1 483 . 1 1 45 45 PHE CE1 C 13 131.324 0.300 . 1 . . . . 45 PHE CE1 . 11160 1 484 . 1 1 45 45 PHE CE2 C 13 131.324 0.300 . 1 . . . . 45 PHE CE2 . 11160 1 485 . 1 1 45 45 PHE CZ C 13 130.145 0.300 . 1 . . . . 45 PHE CZ . 11160 1 486 . 1 1 45 45 PHE N N 15 115.209 0.300 . 1 . . . . 45 PHE N . 11160 1 487 . 1 1 46 46 PRO HA H 1 4.606 0.030 . 1 . . . . 46 PRO HA . 11160 1 488 . 1 1 46 46 PRO HB2 H 1 2.388 0.030 . 2 . . . . 46 PRO HB2 . 11160 1 489 . 1 1 46 46 PRO HB3 H 1 2.009 0.030 . 2 . . . . 46 PRO HB3 . 11160 1 490 . 1 1 46 46 PRO HD2 H 1 3.656 0.030 . 2 . . . . 46 PRO HD2 . 11160 1 491 . 1 1 46 46 PRO HD3 H 1 3.216 0.030 . 2 . . . . 46 PRO HD3 . 11160 1 492 . 1 1 46 46 PRO HG2 H 1 1.989 0.030 . 1 . . . . 46 PRO HG2 . 11160 1 493 . 1 1 46 46 PRO HG3 H 1 1.989 0.030 . 1 . . . . 46 PRO HG3 . 11160 1 494 . 1 1 46 46 PRO C C 13 177.796 0.300 . 1 . . . . 46 PRO C . 11160 1 495 . 1 1 46 46 PRO CA C 13 64.870 0.300 . 1 . . . . 46 PRO CA . 11160 1 496 . 1 1 46 46 PRO CB C 13 32.322 0.300 . 1 . . . . 46 PRO CB . 11160 1 497 . 1 1 46 46 PRO CD C 13 50.178 0.300 . 1 . . . . 46 PRO CD . 11160 1 498 . 1 1 46 46 PRO CG C 13 27.161 0.300 . 1 . . . . 46 PRO CG . 11160 1 499 . 1 1 47 47 ASP H H 1 8.279 0.030 . 1 . . . . 47 ASP H . 11160 1 500 . 1 1 47 47 ASP HA H 1 4.910 0.030 . 1 . . . . 47 ASP HA . 11160 1 501 . 1 1 47 47 ASP HB2 H 1 2.844 0.030 . 2 . . . . 47 ASP HB2 . 11160 1 502 . 1 1 47 47 ASP HB3 H 1 2.722 0.030 . 2 . . . . 47 ASP HB3 . 11160 1 503 . 1 1 47 47 ASP C C 13 176.323 0.300 . 1 . . . . 47 ASP C . 11160 1 504 . 1 1 47 47 ASP CA C 13 52.802 0.300 . 1 . . . . 47 ASP CA . 11160 1 505 . 1 1 47 47 ASP CB C 13 41.955 0.300 . 1 . . . . 47 ASP CB . 11160 1 506 . 1 1 47 47 ASP N N 15 118.122 0.300 . 1 . . . . 47 ASP N . 11160 1 507 . 1 1 48 48 TRP H H 1 9.530 0.030 . 1 . . . . 48 TRP H . 11160 1 508 . 1 1 48 48 TRP HA H 1 4.492 0.030 . 1 . . . . 48 TRP HA . 11160 1 509 . 1 1 48 48 TRP HB2 H 1 3.593 0.030 . 2 . . . . 48 TRP HB2 . 11160 1 510 . 1 1 48 48 TRP HB3 H 1 3.202 0.030 . 2 . . . . 48 TRP HB3 . 11160 1 511 . 1 1 48 48 TRP HD1 H 1 7.112 0.030 . 1 . . . . 48 TRP HD1 . 11160 1 512 . 1 1 48 48 TRP HE1 H 1 9.928 0.030 . 1 . . . . 48 TRP HE1 . 11160 1 513 . 1 1 48 48 TRP HE3 H 1 7.616 0.030 . 1 . . . . 48 TRP HE3 . 11160 1 514 . 1 1 48 48 TRP HH2 H 1 6.915 0.030 . 1 . . . . 48 TRP HH2 . 11160 1 515 . 1 1 48 48 TRP HZ2 H 1 7.513 0.030 . 1 . . . . 48 TRP HZ2 . 11160 1 516 . 1 1 48 48 TRP HZ3 H 1 7.117 0.030 . 1 . . . . 48 TRP HZ3 . 11160 1 517 . 1 1 48 48 TRP C C 13 175.391 0.300 . 1 . . . . 48 TRP C . 11160 1 518 . 1 1 48 48 TRP CA C 13 60.344 0.300 . 1 . . . . 48 TRP CA . 11160 1 519 . 1 1 48 48 TRP CB C 13 29.977 0.300 . 1 . . . . 48 TRP CB . 11160 1 520 . 1 1 48 48 TRP CD1 C 13 127.061 0.300 . 1 . . . . 48 TRP CD1 . 11160 1 521 . 1 1 48 48 TRP CE3 C 13 121.442 0.300 . 1 . . . . 48 TRP CE3 . 11160 1 522 . 1 1 48 48 TRP CH2 C 13 122.714 0.300 . 1 . . . . 48 TRP CH2 . 11160 1 523 . 1 1 48 48 TRP CZ2 C 13 114.420 0.300 . 1 . . . . 48 TRP CZ2 . 11160 1 524 . 1 1 48 48 TRP CZ3 C 13 121.442 0.300 . 1 . . . . 48 TRP CZ3 . 11160 1 525 . 1 1 48 48 TRP N N 15 129.532 0.300 . 1 . . . . 48 TRP N . 11160 1 526 . 1 1 48 48 TRP NE1 N 15 127.506 0.300 . 1 . . . . 48 TRP NE1 . 11160 1 527 . 1 1 49 49 THR H H 1 8.249 0.030 . 1 . . . . 49 THR H . 11160 1 528 . 1 1 49 49 THR HA H 1 3.502 0.030 . 1 . . . . 49 THR HA . 11160 1 529 . 1 1 49 49 THR HB H 1 4.165 0.030 . 1 . . . . 49 THR HB . 11160 1 530 . 1 1 49 49 THR HG21 H 1 1.244 0.030 . 1 . . . . 49 THR HG2 . 11160 1 531 . 1 1 49 49 THR HG22 H 1 1.244 0.030 . 1 . . . . 49 THR HG2 . 11160 1 532 . 1 1 49 49 THR HG23 H 1 1.244 0.030 . 1 . . . . 49 THR HG2 . 11160 1 533 . 1 1 49 49 THR C C 13 176.355 0.300 . 1 . . . . 49 THR C . 11160 1 534 . 1 1 49 49 THR CA C 13 66.271 0.300 . 1 . . . . 49 THR CA . 11160 1 535 . 1 1 49 49 THR CB C 13 68.574 0.300 . 1 . . . . 49 THR CB . 11160 1 536 . 1 1 49 49 THR CG2 C 13 22.024 0.300 . 1 . . . . 49 THR CG2 . 11160 1 537 . 1 1 49 49 THR N N 15 109.356 0.300 . 1 . . . . 49 THR N . 11160 1 538 . 1 1 50 50 THR H H 1 7.337 0.030 . 1 . . . . 50 THR H . 11160 1 539 . 1 1 50 50 THR HA H 1 4.051 0.030 . 1 . . . . 50 THR HA . 11160 1 540 . 1 1 50 50 THR HB H 1 4.342 0.030 . 1 . . . . 50 THR HB . 11160 1 541 . 1 1 50 50 THR HG21 H 1 1.328 0.030 . 1 . . . . 50 THR HG2 . 11160 1 542 . 1 1 50 50 THR HG22 H 1 1.328 0.030 . 1 . . . . 50 THR HG2 . 11160 1 543 . 1 1 50 50 THR HG23 H 1 1.328 0.030 . 1 . . . . 50 THR HG2 . 11160 1 544 . 1 1 50 50 THR C C 13 176.437 0.300 . 1 . . . . 50 THR C . 11160 1 545 . 1 1 50 50 THR CA C 13 64.729 0.300 . 1 . . . . 50 THR CA . 11160 1 546 . 1 1 50 50 THR CB C 13 68.650 0.300 . 1 . . . . 50 THR CB . 11160 1 547 . 1 1 50 50 THR CG2 C 13 22.908 0.300 . 1 . . . . 50 THR CG2 . 11160 1 548 . 1 1 50 50 THR N N 15 113.659 0.300 . 1 . . . . 50 THR N . 11160 1 549 . 1 1 51 51 ARG H H 1 8.821 0.030 . 1 . . . . 51 ARG H . 11160 1 550 . 1 1 51 51 ARG HA H 1 3.431 0.030 . 1 . . . . 51 ARG HA . 11160 1 551 . 1 1 51 51 ARG HB2 H 1 1.975 0.030 . 2 . . . . 51 ARG HB2 . 11160 1 552 . 1 1 51 51 ARG HB3 H 1 2.346 0.030 . 2 . . . . 51 ARG HB3 . 11160 1 553 . 1 1 51 51 ARG HD2 H 1 3.237 0.030 . 2 . . . . 51 ARG HD2 . 11160 1 554 . 1 1 51 51 ARG HD3 H 1 3.702 0.030 . 2 . . . . 51 ARG HD3 . 11160 1 555 . 1 1 51 51 ARG HG2 H 1 1.608 0.030 . 2 . . . . 51 ARG HG2 . 11160 1 556 . 1 1 51 51 ARG HG3 H 1 1.354 0.030 . 2 . . . . 51 ARG HG3 . 11160 1 557 . 1 1 51 51 ARG C C 13 177.865 0.300 . 1 . . . . 51 ARG C . 11160 1 558 . 1 1 51 51 ARG CA C 13 61.682 0.300 . 1 . . . . 51 ARG CA . 11160 1 559 . 1 1 51 51 ARG CB C 13 31.012 0.300 . 1 . . . . 51 ARG CB . 11160 1 560 . 1 1 51 51 ARG CD C 13 42.835 0.300 . 1 . . . . 51 ARG CD . 11160 1 561 . 1 1 51 51 ARG CG C 13 31.211 0.300 . 1 . . . . 51 ARG CG . 11160 1 562 . 1 1 51 51 ARG N N 15 126.979 0.300 . 1 . . . . 51 ARG N . 11160 1 563 . 1 1 52 52 VAL H H 1 8.487 0.030 . 1 . . . . 52 VAL H . 11160 1 564 . 1 1 52 52 VAL HA H 1 3.373 0.030 . 1 . . . . 52 VAL HA . 11160 1 565 . 1 1 52 52 VAL HB H 1 0.418 0.030 . 1 . . . . 52 VAL HB . 11160 1 566 . 1 1 52 52 VAL HG11 H 1 0.428 0.030 . 1 . . . . 52 VAL HG1 . 11160 1 567 . 1 1 52 52 VAL HG12 H 1 0.428 0.030 . 1 . . . . 52 VAL HG1 . 11160 1 568 . 1 1 52 52 VAL HG13 H 1 0.428 0.030 . 1 . . . . 52 VAL HG1 . 11160 1 569 . 1 1 52 52 VAL HG21 H 1 0.672 0.030 . 1 . . . . 52 VAL HG2 . 11160 1 570 . 1 1 52 52 VAL HG22 H 1 0.672 0.030 . 1 . . . . 52 VAL HG2 . 11160 1 571 . 1 1 52 52 VAL HG23 H 1 0.672 0.030 . 1 . . . . 52 VAL HG2 . 11160 1 572 . 1 1 52 52 VAL C C 13 177.053 0.300 . 1 . . . . 52 VAL C . 11160 1 573 . 1 1 52 52 VAL CA C 13 65.169 0.300 . 1 . . . . 52 VAL CA . 11160 1 574 . 1 1 52 52 VAL CB C 13 29.686 0.300 . 1 . . . . 52 VAL CB . 11160 1 575 . 1 1 52 52 VAL CG1 C 13 19.695 0.300 . 2 . . . . 52 VAL CG1 . 11160 1 576 . 1 1 52 52 VAL CG2 C 13 23.590 0.300 . 2 . . . . 52 VAL CG2 . 11160 1 577 . 1 1 52 52 VAL N N 15 118.304 0.300 . 1 . . . . 52 VAL N . 11160 1 578 . 1 1 53 53 LYS H H 1 6.399 0.030 . 1 . . . . 53 LYS H . 11160 1 579 . 1 1 53 53 LYS HA H 1 3.967 0.030 . 1 . . . . 53 LYS HA . 11160 1 580 . 1 1 53 53 LYS HB2 H 1 1.874 0.030 . 2 . . . . 53 LYS HB2 . 11160 1 581 . 1 1 53 53 LYS HB3 H 1 1.752 0.030 . 2 . . . . 53 LYS HB3 . 11160 1 582 . 1 1 53 53 LYS HD2 H 1 1.670 0.030 . 2 . . . . 53 LYS HD2 . 11160 1 583 . 1 1 53 53 LYS HD3 H 1 1.620 0.030 . 2 . . . . 53 LYS HD3 . 11160 1 584 . 1 1 53 53 LYS HE2 H 1 2.930 0.030 . 1 . . . . 53 LYS HE2 . 11160 1 585 . 1 1 53 53 LYS HE3 H 1 2.930 0.030 . 1 . . . . 53 LYS HE3 . 11160 1 586 . 1 1 53 53 LYS HG2 H 1 1.554 0.030 . 2 . . . . 53 LYS HG2 . 11160 1 587 . 1 1 53 53 LYS HG3 H 1 1.307 0.030 . 2 . . . . 53 LYS HG3 . 11160 1 588 . 1 1 53 53 LYS C C 13 179.461 0.300 . 1 . . . . 53 LYS C . 11160 1 589 . 1 1 53 53 LYS CA C 13 58.871 0.300 . 1 . . . . 53 LYS CA . 11160 1 590 . 1 1 53 53 LYS CB C 13 32.051 0.300 . 1 . . . . 53 LYS CB . 11160 1 591 . 1 1 53 53 LYS CD C 13 29.487 0.300 . 1 . . . . 53 LYS CD . 11160 1 592 . 1 1 53 53 LYS CE C 13 42.043 0.300 . 1 . . . . 53 LYS CE . 11160 1 593 . 1 1 53 53 LYS CG C 13 25.471 0.300 . 1 . . . . 53 LYS CG . 11160 1 594 . 1 1 53 53 LYS N N 15 120.245 0.300 . 1 . . . . 53 LYS N . 11160 1 595 . 1 1 54 54 GLN H H 1 7.297 0.030 . 1 . . . . 54 GLN H . 11160 1 596 . 1 1 54 54 GLN HA H 1 3.906 0.030 . 1 . . . . 54 GLN HA . 11160 1 597 . 1 1 54 54 GLN HB2 H 1 1.593 0.030 . 2 . . . . 54 GLN HB2 . 11160 1 598 . 1 1 54 54 GLN HB3 H 1 1.403 0.030 . 2 . . . . 54 GLN HB3 . 11160 1 599 . 1 1 54 54 GLN HE21 H 1 6.671 0.030 . 2 . . . . 54 GLN HE21 . 11160 1 600 . 1 1 54 54 GLN HE22 H 1 6.789 0.030 . 2 . . . . 54 GLN HE22 . 11160 1 601 . 1 1 54 54 GLN HG2 H 1 1.008 0.030 . 2 . . . . 54 GLN HG2 . 11160 1 602 . 1 1 54 54 GLN HG3 H 1 1.586 0.030 . 2 . . . . 54 GLN HG3 . 11160 1 603 . 1 1 54 54 GLN C C 13 177.635 0.300 . 1 . . . . 54 GLN C . 11160 1 604 . 1 1 54 54 GLN CA C 13 57.565 0.300 . 1 . . . . 54 GLN CA . 11160 1 605 . 1 1 54 54 GLN CB C 13 26.492 0.300 . 1 . . . . 54 GLN CB . 11160 1 606 . 1 1 54 54 GLN CG C 13 30.906 0.300 . 1 . . . . 54 GLN CG . 11160 1 607 . 1 1 54 54 GLN N N 15 120.716 0.300 . 1 . . . . 54 GLN N . 11160 1 608 . 1 1 54 54 GLN NE2 N 15 110.178 0.300 . 1 . . . . 54 GLN NE2 . 11160 1 609 . 1 1 55 55 ILE H H 1 8.432 0.030 . 1 . . . . 55 ILE H . 11160 1 610 . 1 1 55 55 ILE HA H 1 3.508 0.030 . 1 . . . . 55 ILE HA . 11160 1 611 . 1 1 55 55 ILE HB H 1 1.939 0.030 . 1 . . . . 55 ILE HB . 11160 1 612 . 1 1 55 55 ILE HD11 H 1 0.991 0.030 . 1 . . . . 55 ILE HD1 . 11160 1 613 . 1 1 55 55 ILE HD12 H 1 0.991 0.030 . 1 . . . . 55 ILE HD1 . 11160 1 614 . 1 1 55 55 ILE HD13 H 1 0.991 0.030 . 1 . . . . 55 ILE HD1 . 11160 1 615 . 1 1 55 55 ILE HG12 H 1 1.256 0.030 . 2 . . . . 55 ILE HG12 . 11160 1 616 . 1 1 55 55 ILE HG13 H 1 1.710 0.030 . 2 . . . . 55 ILE HG13 . 11160 1 617 . 1 1 55 55 ILE HG21 H 1 0.689 0.030 . 1 . . . . 55 ILE HG2 . 11160 1 618 . 1 1 55 55 ILE HG22 H 1 0.689 0.030 . 1 . . . . 55 ILE HG2 . 11160 1 619 . 1 1 55 55 ILE HG23 H 1 0.689 0.030 . 1 . . . . 55 ILE HG2 . 11160 1 620 . 1 1 55 55 ILE C C 13 177.753 0.300 . 1 . . . . 55 ILE C . 11160 1 621 . 1 1 55 55 ILE CA C 13 66.391 0.300 . 1 . . . . 55 ILE CA . 11160 1 622 . 1 1 55 55 ILE CB C 13 38.478 0.300 . 1 . . . . 55 ILE CB . 11160 1 623 . 1 1 55 55 ILE CD1 C 13 14.160 0.300 . 1 . . . . 55 ILE CD1 . 11160 1 624 . 1 1 55 55 ILE CG1 C 13 28.341 0.300 . 1 . . . . 55 ILE CG1 . 11160 1 625 . 1 1 55 55 ILE CG2 C 13 16.644 0.300 . 1 . . . . 55 ILE CG2 . 11160 1 626 . 1 1 55 55 ILE N N 15 120.770 0.300 . 1 . . . . 55 ILE N . 11160 1 627 . 1 1 56 56 ALA H H 1 7.558 0.030 . 1 . . . . 56 ALA H . 11160 1 628 . 1 1 56 56 ALA HA H 1 4.159 0.030 . 1 . . . . 56 ALA HA . 11160 1 629 . 1 1 56 56 ALA HB1 H 1 1.550 0.030 . 1 . . . . 56 ALA HB . 11160 1 630 . 1 1 56 56 ALA HB2 H 1 1.550 0.030 . 1 . . . . 56 ALA HB . 11160 1 631 . 1 1 56 56 ALA HB3 H 1 1.550 0.030 . 1 . . . . 56 ALA HB . 11160 1 632 . 1 1 56 56 ALA C C 13 180.087 0.300 . 1 . . . . 56 ALA C . 11160 1 633 . 1 1 56 56 ALA CA C 13 55.501 0.300 . 1 . . . . 56 ALA CA . 11160 1 634 . 1 1 56 56 ALA CB C 13 18.244 0.300 . 1 . . . . 56 ALA CB . 11160 1 635 . 1 1 56 56 ALA N N 15 118.811 0.300 . 1 . . . . 56 ALA N . 11160 1 636 . 1 1 57 57 LYS H H 1 7.797 0.030 . 1 . . . . 57 LYS H . 11160 1 637 . 1 1 57 57 LYS HA H 1 3.915 0.030 . 1 . . . . 57 LYS HA . 11160 1 638 . 1 1 57 57 LYS HB2 H 1 1.837 0.030 . 1 . . . . 57 LYS HB2 . 11160 1 639 . 1 1 57 57 LYS HB3 H 1 1.837 0.030 . 1 . . . . 57 LYS HB3 . 11160 1 640 . 1 1 57 57 LYS HD2 H 1 1.593 0.030 . 1 . . . . 57 LYS HD2 . 11160 1 641 . 1 1 57 57 LYS HD3 H 1 1.593 0.030 . 1 . . . . 57 LYS HD3 . 11160 1 642 . 1 1 57 57 LYS HE2 H 1 2.873 0.030 . 1 . . . . 57 LYS HE2 . 11160 1 643 . 1 1 57 57 LYS HE3 H 1 2.873 0.030 . 1 . . . . 57 LYS HE3 . 11160 1 644 . 1 1 57 57 LYS HG2 H 1 1.510 0.030 . 2 . . . . 57 LYS HG2 . 11160 1 645 . 1 1 57 57 LYS HG3 H 1 1.202 0.030 . 2 . . . . 57 LYS HG3 . 11160 1 646 . 1 1 57 57 LYS C C 13 178.947 0.300 . 1 . . . . 57 LYS C . 11160 1 647 . 1 1 57 57 LYS CA C 13 59.783 0.300 . 1 . . . . 57 LYS CA . 11160 1 648 . 1 1 57 57 LYS CB C 13 32.742 0.300 . 1 . . . . 57 LYS CB . 11160 1 649 . 1 1 57 57 LYS CD C 13 29.588 0.300 . 1 . . . . 57 LYS CD . 11160 1 650 . 1 1 57 57 LYS CE C 13 41.885 0.300 . 1 . . . . 57 LYS CE . 11160 1 651 . 1 1 57 57 LYS CG C 13 24.998 0.300 . 1 . . . . 57 LYS CG . 11160 1 652 . 1 1 57 57 LYS N N 15 119.620 0.300 . 1 . . . . 57 LYS N . 11160 1 653 . 1 1 58 58 LEU H H 1 8.504 0.030 . 1 . . . . 58 LEU H . 11160 1 654 . 1 1 58 58 LEU HA H 1 3.910 0.030 . 1 . . . . 58 LEU HA . 11160 1 655 . 1 1 58 58 LEU HB2 H 1 1.848 0.030 . 2 . . . . 58 LEU HB2 . 11160 1 656 . 1 1 58 58 LEU HB3 H 1 1.251 0.030 . 2 . . . . 58 LEU HB3 . 11160 1 657 . 1 1 58 58 LEU HD11 H 1 0.104 0.030 . 1 . . . . 58 LEU HD1 . 11160 1 658 . 1 1 58 58 LEU HD12 H 1 0.104 0.030 . 1 . . . . 58 LEU HD1 . 11160 1 659 . 1 1 58 58 LEU HD13 H 1 0.104 0.030 . 1 . . . . 58 LEU HD1 . 11160 1 660 . 1 1 58 58 LEU HD21 H 1 0.529 0.030 . 1 . . . . 58 LEU HD2 . 11160 1 661 . 1 1 58 58 LEU HD22 H 1 0.529 0.030 . 1 . . . . 58 LEU HD2 . 11160 1 662 . 1 1 58 58 LEU HD23 H 1 0.529 0.030 . 1 . . . . 58 LEU HD2 . 11160 1 663 . 1 1 58 58 LEU HG H 1 1.621 0.030 . 1 . . . . 58 LEU HG . 11160 1 664 . 1 1 58 58 LEU C C 13 179.722 0.300 . 1 . . . . 58 LEU C . 11160 1 665 . 1 1 58 58 LEU CA C 13 57.878 0.300 . 1 . . . . 58 LEU CA . 11160 1 666 . 1 1 58 58 LEU CB C 13 41.226 0.300 . 1 . . . . 58 LEU CB . 11160 1 667 . 1 1 58 58 LEU CD1 C 13 24.925 0.300 . 2 . . . . 58 LEU CD1 . 11160 1 668 . 1 1 58 58 LEU CD2 C 13 21.703 0.300 . 2 . . . . 58 LEU CD2 . 11160 1 669 . 1 1 58 58 LEU CG C 13 26.737 0.300 . 1 . . . . 58 LEU CG . 11160 1 670 . 1 1 58 58 LEU N N 15 120.494 0.300 . 1 . . . . 58 LEU N . 11160 1 671 . 1 1 59 59 TRP H H 1 8.243 0.030 . 1 . . . . 59 TRP H . 11160 1 672 . 1 1 59 59 TRP HA H 1 4.233 0.030 . 1 . . . . 59 TRP HA . 11160 1 673 . 1 1 59 59 TRP HB2 H 1 3.339 0.030 . 2 . . . . 59 TRP HB2 . 11160 1 674 . 1 1 59 59 TRP HB3 H 1 3.266 0.030 . 2 . . . . 59 TRP HB3 . 11160 1 675 . 1 1 59 59 TRP HD1 H 1 7.196 0.030 . 1 . . . . 59 TRP HD1 . 11160 1 676 . 1 1 59 59 TRP HE1 H 1 10.094 0.030 . 1 . . . . 59 TRP HE1 . 11160 1 677 . 1 1 59 59 TRP HE3 H 1 6.814 0.030 . 1 . . . . 59 TRP HE3 . 11160 1 678 . 1 1 59 59 TRP HH2 H 1 7.176 0.030 . 1 . . . . 59 TRP HH2 . 11160 1 679 . 1 1 59 59 TRP HZ2 H 1 7.307 0.030 . 1 . . . . 59 TRP HZ2 . 11160 1 680 . 1 1 59 59 TRP HZ3 H 1 6.430 0.030 . 1 . . . . 59 TRP HZ3 . 11160 1 681 . 1 1 59 59 TRP C C 13 177.725 0.300 . 1 . . . . 59 TRP C . 11160 1 682 . 1 1 59 59 TRP CA C 13 58.911 0.300 . 1 . . . . 59 TRP CA . 11160 1 683 . 1 1 59 59 TRP CB C 13 30.392 0.300 . 1 . . . . 59 TRP CB . 11160 1 684 . 1 1 59 59 TRP CD1 C 13 127.551 0.300 . 1 . . . . 59 TRP CD1 . 11160 1 685 . 1 1 59 59 TRP CE3 C 13 120.704 0.300 . 1 . . . . 59 TRP CE3 . 11160 1 686 . 1 1 59 59 TRP CH2 C 13 124.451 0.300 . 1 . . . . 59 TRP CH2 . 11160 1 687 . 1 1 59 59 TRP CZ2 C 13 113.739 0.300 . 1 . . . . 59 TRP CZ2 . 11160 1 688 . 1 1 59 59 TRP CZ3 C 13 120.750 0.300 . 1 . . . . 59 TRP CZ3 . 11160 1 689 . 1 1 59 59 TRP N N 15 120.335 0.300 . 1 . . . . 59 TRP N . 11160 1 690 . 1 1 59 59 TRP NE1 N 15 128.750 0.300 . 1 . . . . 59 TRP NE1 . 11160 1 691 . 1 1 60 60 ARG H H 1 7.988 0.030 . 1 . . . . 60 ARG H . 11160 1 692 . 1 1 60 60 ARG HA H 1 3.756 0.030 . 1 . . . . 60 ARG HA . 11160 1 693 . 1 1 60 60 ARG HB2 H 1 1.956 0.030 . 2 . . . . 60 ARG HB2 . 11160 1 694 . 1 1 60 60 ARG HB3 H 1 1.922 0.030 . 2 . . . . 60 ARG HB3 . 11160 1 695 . 1 1 60 60 ARG HD2 H 1 3.212 0.030 . 1 . . . . 60 ARG HD2 . 11160 1 696 . 1 1 60 60 ARG HD3 H 1 3.212 0.030 . 1 . . . . 60 ARG HD3 . 11160 1 697 . 1 1 60 60 ARG HG2 H 1 1.798 0.030 . 2 . . . . 60 ARG HG2 . 11160 1 698 . 1 1 60 60 ARG HG3 H 1 1.660 0.030 . 2 . . . . 60 ARG HG3 . 11160 1 699 . 1 1 60 60 ARG C C 13 177.472 0.300 . 1 . . . . 60 ARG C . 11160 1 700 . 1 1 60 60 ARG CA C 13 58.590 0.300 . 1 . . . . 60 ARG CA . 11160 1 701 . 1 1 60 60 ARG CB C 13 30.157 0.300 . 1 . . . . 60 ARG CB . 11160 1 702 . 1 1 60 60 ARG CD C 13 43.642 0.300 . 1 . . . . 60 ARG CD . 11160 1 703 . 1 1 60 60 ARG CG C 13 27.853 0.300 . 1 . . . . 60 ARG CG . 11160 1 704 . 1 1 60 60 ARG N N 15 116.650 0.300 . 1 . . . . 60 ARG N . 11160 1 705 . 1 1 61 61 LYS H H 1 7.380 0.030 . 1 . . . . 61 LYS H . 11160 1 706 . 1 1 61 61 LYS HA H 1 4.045 0.030 . 1 . . . . 61 LYS HA . 11160 1 707 . 1 1 61 61 LYS HB2 H 1 1.883 0.030 . 1 . . . . 61 LYS HB2 . 11160 1 708 . 1 1 61 61 LYS HB3 H 1 1.883 0.030 . 1 . . . . 61 LYS HB3 . 11160 1 709 . 1 1 61 61 LYS HD2 H 1 1.662 0.030 . 1 . . . . 61 LYS HD2 . 11160 1 710 . 1 1 61 61 LYS HD3 H 1 1.662 0.030 . 1 . . . . 61 LYS HD3 . 11160 1 711 . 1 1 61 61 LYS HE2 H 1 2.989 0.030 . 1 . . . . 61 LYS HE2 . 11160 1 712 . 1 1 61 61 LYS HE3 H 1 2.989 0.030 . 1 . . . . 61 LYS HE3 . 11160 1 713 . 1 1 61 61 LYS HG2 H 1 1.542 0.030 . 2 . . . . 61 LYS HG2 . 11160 1 714 . 1 1 61 61 LYS HG3 H 1 1.575 0.030 . 2 . . . . 61 LYS HG3 . 11160 1 715 . 1 1 61 61 LYS C C 13 176.557 0.300 . 1 . . . . 61 LYS C . 11160 1 716 . 1 1 61 61 LYS CA C 13 56.923 0.300 . 1 . . . . 61 LYS CA . 11160 1 717 . 1 1 61 61 LYS CB C 13 33.044 0.300 . 1 . . . . 61 LYS CB . 11160 1 718 . 1 1 61 61 LYS CD C 13 29.199 0.300 . 1 . . . . 61 LYS CD . 11160 1 719 . 1 1 61 61 LYS CE C 13 41.939 0.300 . 1 . . . . 61 LYS CE . 11160 1 720 . 1 1 61 61 LYS CG C 13 24.751 0.300 . 1 . . . . 61 LYS CG . 11160 1 721 . 1 1 61 61 LYS N N 15 115.961 0.300 . 1 . . . . 61 LYS N . 11160 1 722 . 1 1 62 62 ALA H H 1 6.967 0.030 . 1 . . . . 62 ALA H . 11160 1 723 . 1 1 62 62 ALA HA H 1 4.255 0.030 . 1 . . . . 62 ALA HA . 11160 1 724 . 1 1 62 62 ALA HB1 H 1 0.872 0.030 . 1 . . . . 62 ALA HB . 11160 1 725 . 1 1 62 62 ALA HB2 H 1 0.872 0.030 . 1 . . . . 62 ALA HB . 11160 1 726 . 1 1 62 62 ALA HB3 H 1 0.872 0.030 . 1 . . . . 62 ALA HB . 11160 1 727 . 1 1 62 62 ALA C C 13 176.925 0.300 . 1 . . . . 62 ALA C . 11160 1 728 . 1 1 62 62 ALA CA C 13 51.820 0.300 . 1 . . . . 62 ALA CA . 11160 1 729 . 1 1 62 62 ALA CB C 13 17.899 0.300 . 1 . . . . 62 ALA CB . 11160 1 730 . 1 1 62 62 ALA N N 15 123.955 0.300 . 1 . . . . 62 ALA N . 11160 1 731 . 1 1 63 63 SER H H 1 8.663 0.030 . 1 . . . . 63 SER H . 11160 1 732 . 1 1 63 63 SER HA H 1 4.343 0.030 . 1 . . . . 63 SER HA . 11160 1 733 . 1 1 63 63 SER HB2 H 1 4.086 0.030 . 2 . . . . 63 SER HB2 . 11160 1 734 . 1 1 63 63 SER HB3 H 1 4.369 0.030 . 2 . . . . 63 SER HB3 . 11160 1 735 . 1 1 63 63 SER C C 13 175.144 0.300 . 1 . . . . 63 SER C . 11160 1 736 . 1 1 63 63 SER CA C 13 57.417 0.300 . 1 . . . . 63 SER CA . 11160 1 737 . 1 1 63 63 SER CB C 13 65.271 0.300 . 1 . . . . 63 SER CB . 11160 1 738 . 1 1 63 63 SER N N 15 119.272 0.300 . 1 . . . . 63 SER N . 11160 1 739 . 1 1 64 64 SER H H 1 9.069 0.030 . 1 . . . . 64 SER H . 11160 1 740 . 1 1 64 64 SER HA H 1 3.902 0.030 . 1 . . . . 64 SER HA . 11160 1 741 . 1 1 64 64 SER HB2 H 1 3.899 0.030 . 2 . . . . 64 SER HB2 . 11160 1 742 . 1 1 64 64 SER HB3 H 1 3.816 0.030 . 2 . . . . 64 SER HB3 . 11160 1 743 . 1 1 64 64 SER C C 13 177.292 0.300 . 1 . . . . 64 SER C . 11160 1 744 . 1 1 64 64 SER CA C 13 62.314 0.300 . 1 . . . . 64 SER CA . 11160 1 745 . 1 1 64 64 SER CB C 13 62.441 0.300 . 1 . . . . 64 SER CB . 11160 1 746 . 1 1 64 64 SER N N 15 116.689 0.300 . 1 . . . . 64 SER N . 11160 1 747 . 1 1 65 65 GLN H H 1 8.425 0.030 . 1 . . . . 65 GLN H . 11160 1 748 . 1 1 65 65 GLN HA H 1 4.124 0.030 . 1 . . . . 65 GLN HA . 11160 1 749 . 1 1 65 65 GLN HB2 H 1 2.096 0.030 . 2 . . . . 65 GLN HB2 . 11160 1 750 . 1 1 65 65 GLN HB3 H 1 2.015 0.030 . 2 . . . . 65 GLN HB3 . 11160 1 751 . 1 1 65 65 GLN HE21 H 1 7.555 0.030 . 2 . . . . 65 GLN HE21 . 11160 1 752 . 1 1 65 65 GLN HE22 H 1 6.876 0.030 . 2 . . . . 65 GLN HE22 . 11160 1 753 . 1 1 65 65 GLN HG2 H 1 2.465 0.030 . 1 . . . . 65 GLN HG2 . 11160 1 754 . 1 1 65 65 GLN HG3 H 1 2.465 0.030 . 1 . . . . 65 GLN HG3 . 11160 1 755 . 1 1 65 65 GLN C C 13 178.284 0.300 . 1 . . . . 65 GLN C . 11160 1 756 . 1 1 65 65 GLN CA C 13 59.081 0.300 . 1 . . . . 65 GLN CA . 11160 1 757 . 1 1 65 65 GLN CB C 13 28.204 0.300 . 1 . . . . 65 GLN CB . 11160 1 758 . 1 1 65 65 GLN CG C 13 34.123 0.300 . 1 . . . . 65 GLN CG . 11160 1 759 . 1 1 65 65 GLN N N 15 120.230 0.300 . 1 . . . . 65 GLN N . 11160 1 760 . 1 1 65 65 GLN NE2 N 15 112.000 0.300 . 1 . . . . 65 GLN NE2 . 11160 1 761 . 1 1 66 66 GLU H H 1 7.707 0.030 . 1 . . . . 66 GLU H . 11160 1 762 . 1 1 66 66 GLU HA H 1 4.183 0.030 . 1 . . . . 66 GLU HA . 11160 1 763 . 1 1 66 66 GLU HB2 H 1 2.054 0.030 . 2 . . . . 66 GLU HB2 . 11160 1 764 . 1 1 66 66 GLU HB3 H 1 2.246 0.030 . 2 . . . . 66 GLU HB3 . 11160 1 765 . 1 1 66 66 GLU HG2 H 1 2.386 0.030 . 2 . . . . 66 GLU HG2 . 11160 1 766 . 1 1 66 66 GLU HG3 H 1 2.492 0.030 . 2 . . . . 66 GLU HG3 . 11160 1 767 . 1 1 66 66 GLU C C 13 178.758 0.300 . 1 . . . . 66 GLU C . 11160 1 768 . 1 1 66 66 GLU CA C 13 58.359 0.300 . 1 . . . . 66 GLU CA . 11160 1 769 . 1 1 66 66 GLU CB C 13 29.988 0.300 . 1 . . . . 66 GLU CB . 11160 1 770 . 1 1 66 66 GLU CG C 13 37.025 0.300 . 1 . . . . 66 GLU CG . 11160 1 771 . 1 1 66 66 GLU N N 15 121.110 0.300 . 1 . . . . 66 GLU N . 11160 1 772 . 1 1 67 67 ARG H H 1 8.115 0.030 . 1 . . . . 67 ARG H . 11160 1 773 . 1 1 67 67 ARG HA H 1 3.792 0.030 . 1 . . . . 67 ARG HA . 11160 1 774 . 1 1 67 67 ARG HB2 H 1 1.507 0.030 . 2 . . . . 67 ARG HB2 . 11160 1 775 . 1 1 67 67 ARG HB3 H 1 1.414 0.030 . 2 . . . . 67 ARG HB3 . 11160 1 776 . 1 1 67 67 ARG HD2 H 1 1.901 0.030 . 2 . . . . 67 ARG HD2 . 11160 1 777 . 1 1 67 67 ARG HD3 H 1 2.015 0.030 . 2 . . . . 67 ARG HD3 . 11160 1 778 . 1 1 67 67 ARG HG2 H 1 1.006 0.030 . 2 . . . . 67 ARG HG2 . 11160 1 779 . 1 1 67 67 ARG HG3 H 1 -0.742 0.030 . 2 . . . . 67 ARG HG3 . 11160 1 780 . 1 1 67 67 ARG C C 13 179.295 0.300 . 1 . . . . 67 ARG C . 11160 1 781 . 1 1 67 67 ARG CA C 13 59.106 0.300 . 1 . . . . 67 ARG CA . 11160 1 782 . 1 1 67 67 ARG CB C 13 32.380 0.300 . 1 . . . . 67 ARG CB . 11160 1 783 . 1 1 67 67 ARG CD C 13 43.368 0.300 . 1 . . . . 67 ARG CD . 11160 1 784 . 1 1 67 67 ARG CG C 13 26.870 0.300 . 1 . . . . 67 ARG CG . 11160 1 785 . 1 1 67 67 ARG N N 15 114.125 0.300 . 1 . . . . 67 ARG N . 11160 1 786 . 1 1 68 68 ALA H H 1 7.382 0.030 . 1 . . . . 68 ALA H . 11160 1 787 . 1 1 68 68 ALA HA H 1 4.285 0.030 . 1 . . . . 68 ALA HA . 11160 1 788 . 1 1 68 68 ALA HB1 H 1 1.586 0.030 . 1 . . . . 68 ALA HB . 11160 1 789 . 1 1 68 68 ALA HB2 H 1 1.586 0.030 . 1 . . . . 68 ALA HB . 11160 1 790 . 1 1 68 68 ALA HB3 H 1 1.586 0.030 . 1 . . . . 68 ALA HB . 11160 1 791 . 1 1 68 68 ALA C C 13 176.624 0.300 . 1 . . . . 68 ALA C . 11160 1 792 . 1 1 68 68 ALA CA C 13 57.545 0.300 . 1 . . . . 68 ALA CA . 11160 1 793 . 1 1 68 68 ALA CB C 13 15.937 0.300 . 1 . . . . 68 ALA CB . 11160 1 794 . 1 1 68 68 ALA N N 15 120.274 0.300 . 1 . . . . 68 ALA N . 11160 1 795 . 1 1 69 69 PRO HA H 1 4.403 0.030 . 1 . . . . 69 PRO HA . 11160 1 796 . 1 1 69 69 PRO HB2 H 1 2.226 0.030 . 2 . . . . 69 PRO HB2 . 11160 1 797 . 1 1 69 69 PRO HB3 H 1 1.316 0.030 . 2 . . . . 69 PRO HB3 . 11160 1 798 . 1 1 69 69 PRO HD2 H 1 3.754 0.030 . 2 . . . . 69 PRO HD2 . 11160 1 799 . 1 1 69 69 PRO HD3 H 1 3.954 0.030 . 2 . . . . 69 PRO HD3 . 11160 1 800 . 1 1 69 69 PRO HG2 H 1 2.013 0.030 . 1 . . . . 69 PRO HG2 . 11160 1 801 . 1 1 69 69 PRO HG3 H 1 2.013 0.030 . 1 . . . . 69 PRO HG3 . 11160 1 802 . 1 1 69 69 PRO C C 13 179.392 0.300 . 1 . . . . 69 PRO C . 11160 1 803 . 1 1 69 69 PRO CA C 13 65.698 0.300 . 1 . . . . 69 PRO CA . 11160 1 804 . 1 1 69 69 PRO CB C 13 31.167 0.300 . 1 . . . . 69 PRO CB . 11160 1 805 . 1 1 69 69 PRO CD C 13 50.537 0.300 . 1 . . . . 69 PRO CD . 11160 1 806 . 1 1 69 69 PRO CG C 13 28.376 0.300 . 1 . . . . 69 PRO CG . 11160 1 807 . 1 1 70 70 TYR H H 1 7.657 0.030 . 1 . . . . 70 TYR H . 11160 1 808 . 1 1 70 70 TYR HA H 1 4.115 0.030 . 1 . . . . 70 TYR HA . 11160 1 809 . 1 1 70 70 TYR HB2 H 1 3.604 0.030 . 2 . . . . 70 TYR HB2 . 11160 1 810 . 1 1 70 70 TYR HB3 H 1 3.215 0.030 . 2 . . . . 70 TYR HB3 . 11160 1 811 . 1 1 70 70 TYR HD1 H 1 7.478 0.030 . 1 . . . . 70 TYR HD1 . 11160 1 812 . 1 1 70 70 TYR HD2 H 1 7.478 0.030 . 1 . . . . 70 TYR HD2 . 11160 1 813 . 1 1 70 70 TYR HE1 H 1 7.171 0.030 . 1 . . . . 70 TYR HE1 . 11160 1 814 . 1 1 70 70 TYR HE2 H 1 7.171 0.030 . 1 . . . . 70 TYR HE2 . 11160 1 815 . 1 1 70 70 TYR C C 13 177.384 0.300 . 1 . . . . 70 TYR C . 11160 1 816 . 1 1 70 70 TYR CA C 13 61.931 0.300 . 1 . . . . 70 TYR CA . 11160 1 817 . 1 1 70 70 TYR CB C 13 38.343 0.300 . 1 . . . . 70 TYR CB . 11160 1 818 . 1 1 70 70 TYR CD1 C 13 133.370 0.300 . 1 . . . . 70 TYR CD1 . 11160 1 819 . 1 1 70 70 TYR CD2 C 13 133.370 0.300 . 1 . . . . 70 TYR CD2 . 11160 1 820 . 1 1 70 70 TYR CE1 C 13 119.500 0.300 . 1 . . . . 70 TYR CE1 . 11160 1 821 . 1 1 70 70 TYR CE2 C 13 119.500 0.300 . 1 . . . . 70 TYR CE2 . 11160 1 822 . 1 1 70 70 TYR N N 15 116.851 0.300 . 1 . . . . 70 TYR N . 11160 1 823 . 1 1 71 71 VAL H H 1 8.114 0.030 . 1 . . . . 71 VAL H . 11160 1 824 . 1 1 71 71 VAL HA H 1 3.669 0.030 . 1 . . . . 71 VAL HA . 11160 1 825 . 1 1 71 71 VAL HB H 1 2.363 0.030 . 1 . . . . 71 VAL HB . 11160 1 826 . 1 1 71 71 VAL HG11 H 1 1.319 0.030 . 1 . . . . 71 VAL HG1 . 11160 1 827 . 1 1 71 71 VAL HG12 H 1 1.319 0.030 . 1 . . . . 71 VAL HG1 . 11160 1 828 . 1 1 71 71 VAL HG13 H 1 1.319 0.030 . 1 . . . . 71 VAL HG1 . 11160 1 829 . 1 1 71 71 VAL HG21 H 1 1.051 0.030 . 1 . . . . 71 VAL HG2 . 11160 1 830 . 1 1 71 71 VAL HG22 H 1 1.051 0.030 . 1 . . . . 71 VAL HG2 . 11160 1 831 . 1 1 71 71 VAL HG23 H 1 1.051 0.030 . 1 . . . . 71 VAL HG2 . 11160 1 832 . 1 1 71 71 VAL C C 13 179.112 0.300 . 1 . . . . 71 VAL C . 11160 1 833 . 1 1 71 71 VAL CA C 13 67.080 0.300 . 1 . . . . 71 VAL CA . 11160 1 834 . 1 1 71 71 VAL CB C 13 32.101 0.300 . 1 . . . . 71 VAL CB . 11160 1 835 . 1 1 71 71 VAL CG1 C 13 22.379 0.300 . 2 . . . . 71 VAL CG1 . 11160 1 836 . 1 1 71 71 VAL CG2 C 13 20.880 0.300 . 2 . . . . 71 VAL CG2 . 11160 1 837 . 1 1 71 71 VAL N N 15 121.364 0.300 . 1 . . . . 71 VAL N . 11160 1 838 . 1 1 72 72 GLN H H 1 7.688 0.030 . 1 . . . . 72 GLN H . 11160 1 839 . 1 1 72 72 GLN HA H 1 3.935 0.030 . 1 . . . . 72 GLN HA . 11160 1 840 . 1 1 72 72 GLN HB2 H 1 2.146 0.030 . 2 . . . . 72 GLN HB2 . 11160 1 841 . 1 1 72 72 GLN HB3 H 1 2.028 0.030 . 2 . . . . 72 GLN HB3 . 11160 1 842 . 1 1 72 72 GLN HE21 H 1 6.890 0.030 . 2 . . . . 72 GLN HE21 . 11160 1 843 . 1 1 72 72 GLN HE22 H 1 7.803 0.030 . 2 . . . . 72 GLN HE22 . 11160 1 844 . 1 1 72 72 GLN HG2 H 1 2.386 0.030 . 2 . . . . 72 GLN HG2 . 11160 1 845 . 1 1 72 72 GLN HG3 H 1 2.352 0.030 . 2 . . . . 72 GLN HG3 . 11160 1 846 . 1 1 72 72 GLN C C 13 177.083 0.300 . 1 . . . . 72 GLN C . 11160 1 847 . 1 1 72 72 GLN CA C 13 58.660 0.300 . 1 . . . . 72 GLN CA . 11160 1 848 . 1 1 72 72 GLN CB C 13 28.325 0.300 . 1 . . . . 72 GLN CB . 11160 1 849 . 1 1 72 72 GLN CG C 13 33.285 0.300 . 1 . . . . 72 GLN CG . 11160 1 850 . 1 1 72 72 GLN N N 15 118.076 0.300 . 1 . . . . 72 GLN N . 11160 1 851 . 1 1 72 72 GLN NE2 N 15 115.137 0.300 . 1 . . . . 72 GLN NE2 . 11160 1 852 . 1 1 73 73 LYS H H 1 8.159 0.030 . 1 . . . . 73 LYS H . 11160 1 853 . 1 1 73 73 LYS HA H 1 4.110 0.030 . 1 . . . . 73 LYS HA . 11160 1 854 . 1 1 73 73 LYS HB2 H 1 1.816 0.030 . 1 . . . . 73 LYS HB2 . 11160 1 855 . 1 1 73 73 LYS HB3 H 1 1.816 0.030 . 1 . . . . 73 LYS HB3 . 11160 1 856 . 1 1 73 73 LYS HD2 H 1 1.659 0.030 . 1 . . . . 73 LYS HD2 . 11160 1 857 . 1 1 73 73 LYS HD3 H 1 1.659 0.030 . 1 . . . . 73 LYS HD3 . 11160 1 858 . 1 1 73 73 LYS HE2 H 1 3.151 0.030 . 2 . . . . 73 LYS HE2 . 11160 1 859 . 1 1 73 73 LYS HE3 H 1 3.085 0.030 . 2 . . . . 73 LYS HE3 . 11160 1 860 . 1 1 73 73 LYS HG2 H 1 1.486 0.030 . 2 . . . . 73 LYS HG2 . 11160 1 861 . 1 1 73 73 LYS HG3 H 1 1.631 0.030 . 2 . . . . 73 LYS HG3 . 11160 1 862 . 1 1 73 73 LYS C C 13 177.796 0.300 . 1 . . . . 73 LYS C . 11160 1 863 . 1 1 73 73 LYS CA C 13 59.174 0.300 . 1 . . . . 73 LYS CA . 11160 1 864 . 1 1 73 73 LYS CB C 13 32.595 0.300 . 1 . . . . 73 LYS CB . 11160 1 865 . 1 1 73 73 LYS CD C 13 29.043 0.300 . 1 . . . . 73 LYS CD . 11160 1 866 . 1 1 73 73 LYS CE C 13 41.967 0.300 . 1 . . . . 73 LYS CE . 11160 1 867 . 1 1 73 73 LYS CG C 13 24.847 0.300 . 1 . . . . 73 LYS CG . 11160 1 868 . 1 1 73 73 LYS N N 15 119.920 0.300 . 1 . . . . 73 LYS N . 11160 1 869 . 1 1 74 74 ALA H H 1 8.266 0.030 . 1 . . . . 74 ALA H . 11160 1 870 . 1 1 74 74 ALA HA H 1 4.183 0.030 . 1 . . . . 74 ALA HA . 11160 1 871 . 1 1 74 74 ALA HB1 H 1 1.246 0.030 . 1 . . . . 74 ALA HB . 11160 1 872 . 1 1 74 74 ALA HB2 H 1 1.246 0.030 . 1 . . . . 74 ALA HB . 11160 1 873 . 1 1 74 74 ALA HB3 H 1 1.246 0.030 . 1 . . . . 74 ALA HB . 11160 1 874 . 1 1 74 74 ALA C C 13 179.337 0.300 . 1 . . . . 74 ALA C . 11160 1 875 . 1 1 74 74 ALA CA C 13 55.527 0.300 . 1 . . . . 74 ALA CA . 11160 1 876 . 1 1 74 74 ALA CB C 13 16.739 0.300 . 1 . . . . 74 ALA CB . 11160 1 877 . 1 1 74 74 ALA N N 15 120.343 0.300 . 1 . . . . 74 ALA N . 11160 1 878 . 1 1 75 75 ARG H H 1 7.429 0.030 . 1 . . . . 75 ARG H . 11160 1 879 . 1 1 75 75 ARG HA H 1 3.988 0.030 . 1 . . . . 75 ARG HA . 11160 1 880 . 1 1 75 75 ARG HB2 H 1 2.103 0.030 . 2 . . . . 75 ARG HB2 . 11160 1 881 . 1 1 75 75 ARG HB3 H 1 2.020 0.030 . 2 . . . . 75 ARG HB3 . 11160 1 882 . 1 1 75 75 ARG HD2 H 1 3.213 0.030 . 1 . . . . 75 ARG HD2 . 11160 1 883 . 1 1 75 75 ARG HD3 H 1 3.213 0.030 . 1 . . . . 75 ARG HD3 . 11160 1 884 . 1 1 75 75 ARG HG2 H 1 1.652 0.030 . 2 . . . . 75 ARG HG2 . 11160 1 885 . 1 1 75 75 ARG HG3 H 1 1.879 0.030 . 2 . . . . 75 ARG HG3 . 11160 1 886 . 1 1 75 75 ARG C C 13 179.787 0.300 . 1 . . . . 75 ARG C . 11160 1 887 . 1 1 75 75 ARG CA C 13 59.748 0.300 . 1 . . . . 75 ARG CA . 11160 1 888 . 1 1 75 75 ARG CB C 13 29.728 0.300 . 1 . . . . 75 ARG CB . 11160 1 889 . 1 1 75 75 ARG CD C 13 43.801 0.300 . 1 . . . . 75 ARG CD . 11160 1 890 . 1 1 75 75 ARG CG C 13 27.362 0.300 . 1 . . . . 75 ARG CG . 11160 1 891 . 1 1 75 75 ARG N N 15 118.010 0.300 . 1 . . . . 75 ARG N . 11160 1 892 . 1 1 76 76 ASP H H 1 8.513 0.030 . 1 . . . . 76 ASP H . 11160 1 893 . 1 1 76 76 ASP HA H 1 4.407 0.030 . 1 . . . . 76 ASP HA . 11160 1 894 . 1 1 76 76 ASP HB2 H 1 2.710 0.030 . 2 . . . . 76 ASP HB2 . 11160 1 895 . 1 1 76 76 ASP HB3 H 1 2.883 0.030 . 2 . . . . 76 ASP HB3 . 11160 1 896 . 1 1 76 76 ASP C C 13 179.444 0.300 . 1 . . . . 76 ASP C . 11160 1 897 . 1 1 76 76 ASP CA C 13 57.432 0.300 . 1 . . . . 76 ASP CA . 11160 1 898 . 1 1 76 76 ASP CB C 13 39.661 0.300 . 1 . . . . 76 ASP CB . 11160 1 899 . 1 1 76 76 ASP N N 15 123.506 0.300 . 1 . . . . 76 ASP N . 11160 1 900 . 1 1 77 77 ASN H H 1 8.889 0.030 . 1 . . . . 77 ASN H . 11160 1 901 . 1 1 77 77 ASN HA H 1 4.427 0.030 . 1 . . . . 77 ASN HA . 11160 1 902 . 1 1 77 77 ASN HB2 H 1 2.575 0.030 . 2 . . . . 77 ASN HB2 . 11160 1 903 . 1 1 77 77 ASN HB3 H 1 2.960 0.030 . 2 . . . . 77 ASN HB3 . 11160 1 904 . 1 1 77 77 ASN HD21 H 1 8.162 0.030 . 2 . . . . 77 ASN HD21 . 11160 1 905 . 1 1 77 77 ASN HD22 H 1 6.634 0.030 . 2 . . . . 77 ASN HD22 . 11160 1 906 . 1 1 77 77 ASN C C 13 177.905 0.300 . 1 . . . . 77 ASN C . 11160 1 907 . 1 1 77 77 ASN CA C 13 55.047 0.300 . 1 . . . . 77 ASN CA . 11160 1 908 . 1 1 77 77 ASN CB C 13 37.109 0.300 . 1 . . . . 77 ASN CB . 11160 1 909 . 1 1 77 77 ASN N N 15 121.570 0.300 . 1 . . . . 77 ASN N . 11160 1 910 . 1 1 77 77 ASN ND2 N 15 110.716 0.300 . 1 . . . . 77 ASN ND2 . 11160 1 911 . 1 1 78 78 ARG H H 1 8.244 0.030 . 1 . . . . 78 ARG H . 11160 1 912 . 1 1 78 78 ARG HA H 1 3.977 0.030 . 1 . . . . 78 ARG HA . 11160 1 913 . 1 1 78 78 ARG HB2 H 1 2.075 0.030 . 1 . . . . 78 ARG HB2 . 11160 1 914 . 1 1 78 78 ARG HB3 H 1 2.075 0.030 . 1 . . . . 78 ARG HB3 . 11160 1 915 . 1 1 78 78 ARG HD2 H 1 3.377 0.030 . 2 . . . . 78 ARG HD2 . 11160 1 916 . 1 1 78 78 ARG HD3 H 1 3.287 0.030 . 2 . . . . 78 ARG HD3 . 11160 1 917 . 1 1 78 78 ARG HG2 H 1 1.918 0.030 . 2 . . . . 78 ARG HG2 . 11160 1 918 . 1 1 78 78 ARG HG3 H 1 1.711 0.030 . 2 . . . . 78 ARG HG3 . 11160 1 919 . 1 1 78 78 ARG C C 13 178.398 0.300 . 1 . . . . 78 ARG C . 11160 1 920 . 1 1 78 78 ARG CA C 13 59.537 0.300 . 1 . . . . 78 ARG CA . 11160 1 921 . 1 1 78 78 ARG CB C 13 30.409 0.300 . 1 . . . . 78 ARG CB . 11160 1 922 . 1 1 78 78 ARG CD C 13 43.643 0.300 . 1 . . . . 78 ARG CD . 11160 1 923 . 1 1 78 78 ARG CG C 13 28.294 0.300 . 1 . . . . 78 ARG CG . 11160 1 924 . 1 1 78 78 ARG N N 15 121.479 0.300 . 1 . . . . 78 ARG N . 11160 1 925 . 1 1 79 79 ALA H H 1 7.916 0.030 . 1 . . . . 79 ALA H . 11160 1 926 . 1 1 79 79 ALA HA H 1 4.190 0.030 . 1 . . . . 79 ALA HA . 11160 1 927 . 1 1 79 79 ALA HB1 H 1 1.551 0.030 . 1 . . . . 79 ALA HB . 11160 1 928 . 1 1 79 79 ALA HB2 H 1 1.551 0.030 . 1 . . . . 79 ALA HB . 11160 1 929 . 1 1 79 79 ALA HB3 H 1 1.551 0.030 . 1 . . . . 79 ALA HB . 11160 1 930 . 1 1 79 79 ALA C C 13 179.356 0.300 . 1 . . . . 79 ALA C . 11160 1 931 . 1 1 79 79 ALA CA C 13 54.280 0.300 . 1 . . . . 79 ALA CA . 11160 1 932 . 1 1 79 79 ALA CB C 13 18.271 0.300 . 1 . . . . 79 ALA CB . 11160 1 933 . 1 1 79 79 ALA N N 15 121.413 0.300 . 1 . . . . 79 ALA N . 11160 1 934 . 1 1 80 80 ALA H H 1 7.786 0.030 . 1 . . . . 80 ALA H . 11160 1 935 . 1 1 80 80 ALA HA H 1 4.192 0.030 . 1 . . . . 80 ALA HA . 11160 1 936 . 1 1 80 80 ALA HB1 H 1 1.496 0.030 . 1 . . . . 80 ALA HB . 11160 1 937 . 1 1 80 80 ALA HB2 H 1 1.496 0.030 . 1 . . . . 80 ALA HB . 11160 1 938 . 1 1 80 80 ALA HB3 H 1 1.496 0.030 . 1 . . . . 80 ALA HB . 11160 1 939 . 1 1 80 80 ALA C C 13 178.924 0.300 . 1 . . . . 80 ALA C . 11160 1 940 . 1 1 80 80 ALA CA C 13 53.806 0.300 . 1 . . . . 80 ALA CA . 11160 1 941 . 1 1 80 80 ALA CB C 13 18.573 0.300 . 1 . . . . 80 ALA CB . 11160 1 942 . 1 1 80 80 ALA N N 15 120.293 0.300 . 1 . . . . 80 ALA N . 11160 1 943 . 1 1 81 81 LEU H H 1 7.637 0.030 . 1 . . . . 81 LEU H . 11160 1 944 . 1 1 81 81 LEU HA H 1 4.231 0.030 . 1 . . . . 81 LEU HA . 11160 1 945 . 1 1 81 81 LEU HB2 H 1 1.618 0.030 . 2 . . . . 81 LEU HB2 . 11160 1 946 . 1 1 81 81 LEU HB3 H 1 1.784 0.030 . 2 . . . . 81 LEU HB3 . 11160 1 947 . 1 1 81 81 LEU HD11 H 1 0.951 0.030 . 1 . . . . 81 LEU HD1 . 11160 1 948 . 1 1 81 81 LEU HD12 H 1 0.951 0.030 . 1 . . . . 81 LEU HD1 . 11160 1 949 . 1 1 81 81 LEU HD13 H 1 0.951 0.030 . 1 . . . . 81 LEU HD1 . 11160 1 950 . 1 1 81 81 LEU HD21 H 1 0.880 0.030 . 1 . . . . 81 LEU HD2 . 11160 1 951 . 1 1 81 81 LEU HD22 H 1 0.880 0.030 . 1 . . . . 81 LEU HD2 . 11160 1 952 . 1 1 81 81 LEU HD23 H 1 0.880 0.030 . 1 . . . . 81 LEU HD2 . 11160 1 953 . 1 1 81 81 LEU HG H 1 1.793 0.030 . 1 . . . . 81 LEU HG . 11160 1 954 . 1 1 81 81 LEU C C 13 177.935 0.300 . 1 . . . . 81 LEU C . 11160 1 955 . 1 1 81 81 LEU CA C 13 55.970 0.300 . 1 . . . . 81 LEU CA . 11160 1 956 . 1 1 81 81 LEU CB C 13 42.172 0.300 . 1 . . . . 81 LEU CB . 11160 1 957 . 1 1 81 81 LEU CD1 C 13 25.400 0.300 . 2 . . . . 81 LEU CD1 . 11160 1 958 . 1 1 81 81 LEU CD2 C 13 23.354 0.300 . 2 . . . . 81 LEU CD2 . 11160 1 959 . 1 1 81 81 LEU CG C 13 26.849 0.300 . 1 . . . . 81 LEU CG . 11160 1 960 . 1 1 81 81 LEU N N 15 118.064 0.300 . 1 . . . . 81 LEU N . 11160 1 961 . 1 1 82 82 ARG H H 1 7.819 0.030 . 1 . . . . 82 ARG H . 11160 1 962 . 1 1 82 82 ARG HA H 1 4.281 0.030 . 1 . . . . 82 ARG HA . 11160 1 963 . 1 1 82 82 ARG HB2 H 1 1.875 0.030 . 2 . . . . 82 ARG HB2 . 11160 1 964 . 1 1 82 82 ARG HB3 H 1 1.914 0.030 . 2 . . . . 82 ARG HB3 . 11160 1 965 . 1 1 82 82 ARG HD2 H 1 3.221 0.030 . 1 . . . . 82 ARG HD2 . 11160 1 966 . 1 1 82 82 ARG HD3 H 1 3.221 0.030 . 1 . . . . 82 ARG HD3 . 11160 1 967 . 1 1 82 82 ARG HG2 H 1 1.724 0.030 . 2 . . . . 82 ARG HG2 . 11160 1 968 . 1 1 82 82 ARG HG3 H 1 1.625 0.030 . 2 . . . . 82 ARG HG3 . 11160 1 969 . 1 1 82 82 ARG C C 13 176.677 0.300 . 1 . . . . 82 ARG C . 11160 1 970 . 1 1 82 82 ARG CA C 13 56.715 0.300 . 1 . . . . 82 ARG CA . 11160 1 971 . 1 1 82 82 ARG CB C 13 30.240 0.300 . 1 . . . . 82 ARG CB . 11160 1 972 . 1 1 82 82 ARG CD C 13 43.408 0.300 . 1 . . . . 82 ARG CD . 11160 1 973 . 1 1 82 82 ARG CG C 13 27.330 0.300 . 1 . . . . 82 ARG CG . 11160 1 974 . 1 1 82 82 ARG N N 15 119.538 0.300 . 1 . . . . 82 ARG N . 11160 1 975 . 1 1 83 83 ILE H H 1 7.860 0.030 . 1 . . . . 83 ILE H . 11160 1 976 . 1 1 83 83 ILE HA H 1 4.110 0.030 . 1 . . . . 83 ILE HA . 11160 1 977 . 1 1 83 83 ILE HB H 1 1.887 0.030 . 1 . . . . 83 ILE HB . 11160 1 978 . 1 1 83 83 ILE HD11 H 1 0.866 0.030 . 1 . . . . 83 ILE HD1 . 11160 1 979 . 1 1 83 83 ILE HD12 H 1 0.866 0.030 . 1 . . . . 83 ILE HD1 . 11160 1 980 . 1 1 83 83 ILE HD13 H 1 0.866 0.030 . 1 . . . . 83 ILE HD1 . 11160 1 981 . 1 1 83 83 ILE HG12 H 1 1.211 0.030 . 2 . . . . 83 ILE HG12 . 11160 1 982 . 1 1 83 83 ILE HG13 H 1 1.502 0.030 . 2 . . . . 83 ILE HG13 . 11160 1 983 . 1 1 83 83 ILE HG21 H 1 0.909 0.030 . 1 . . . . 83 ILE HG2 . 11160 1 984 . 1 1 83 83 ILE HG22 H 1 0.909 0.030 . 1 . . . . 83 ILE HG2 . 11160 1 985 . 1 1 83 83 ILE HG23 H 1 0.909 0.030 . 1 . . . . 83 ILE HG2 . 11160 1 986 . 1 1 83 83 ILE C C 13 176.147 0.300 . 1 . . . . 83 ILE C . 11160 1 987 . 1 1 83 83 ILE CA C 13 61.650 0.300 . 1 . . . . 83 ILE CA . 11160 1 988 . 1 1 83 83 ILE CB C 13 38.598 0.300 . 1 . . . . 83 ILE CB . 11160 1 989 . 1 1 83 83 ILE CD1 C 13 12.970 0.300 . 1 . . . . 83 ILE CD1 . 11160 1 990 . 1 1 83 83 ILE CG1 C 13 27.591 0.300 . 1 . . . . 83 ILE CG1 . 11160 1 991 . 1 1 83 83 ILE CG2 C 13 17.471 0.300 . 1 . . . . 83 ILE CG2 . 11160 1 992 . 1 1 83 83 ILE N N 15 120.037 0.300 . 1 . . . . 83 ILE N . 11160 1 993 . 1 1 84 84 ASN H H 1 8.339 0.030 . 1 . . . . 84 ASN H . 11160 1 994 . 1 1 84 84 ASN HA H 1 4.785 0.030 . 1 . . . . 84 ASN HA . 11160 1 995 . 1 1 84 84 ASN HB2 H 1 2.759 0.030 . 2 . . . . 84 ASN HB2 . 11160 1 996 . 1 1 84 84 ASN HB3 H 1 2.840 0.030 . 2 . . . . 84 ASN HB3 . 11160 1 997 . 1 1 84 84 ASN HD21 H 1 6.927 0.030 . 2 . . . . 84 ASN HD21 . 11160 1 998 . 1 1 84 84 ASN HD22 H 1 7.596 0.030 . 2 . . . . 84 ASN HD22 . 11160 1 999 . 1 1 84 84 ASN C C 13 175.012 0.300 . 1 . . . . 84 ASN C . 11160 1 1000 . 1 1 84 84 ASN CA C 13 53.466 0.300 . 1 . . . . 84 ASN CA . 11160 1 1001 . 1 1 84 84 ASN CB C 13 38.893 0.300 . 1 . . . . 84 ASN CB . 11160 1 1002 . 1 1 84 84 ASN N N 15 121.828 0.300 . 1 . . . . 84 ASN N . 11160 1 1003 . 1 1 84 84 ASN ND2 N 15 112.838 0.300 . 1 . . . . 84 ASN ND2 . 11160 1 1004 . 1 1 85 85 LYS H H 1 8.204 0.030 . 1 . . . . 85 LYS H . 11160 1 1005 . 1 1 85 85 LYS HA H 1 4.301 0.030 . 1 . . . . 85 LYS HA . 11160 1 1006 . 1 1 85 85 LYS HB2 H 1 1.773 0.030 . 2 . . . . 85 LYS HB2 . 11160 1 1007 . 1 1 85 85 LYS HB3 H 1 1.848 0.030 . 2 . . . . 85 LYS HB3 . 11160 1 1008 . 1 1 85 85 LYS HD2 H 1 1.683 0.030 . 1 . . . . 85 LYS HD2 . 11160 1 1009 . 1 1 85 85 LYS HD3 H 1 1.683 0.030 . 1 . . . . 85 LYS HD3 . 11160 1 1010 . 1 1 85 85 LYS HE2 H 1 3.154 0.030 . 1 . . . . 85 LYS HE2 . 11160 1 1011 . 1 1 85 85 LYS HE3 H 1 3.154 0.030 . 1 . . . . 85 LYS HE3 . 11160 1 1012 . 1 1 85 85 LYS HG2 H 1 1.432 0.030 . 1 . . . . 85 LYS HG2 . 11160 1 1013 . 1 1 85 85 LYS HG3 H 1 1.432 0.030 . 1 . . . . 85 LYS HG3 . 11160 1 1014 . 1 1 85 85 LYS C C 13 176.552 0.300 . 1 . . . . 85 LYS C . 11160 1 1015 . 1 1 85 85 LYS CA C 13 56.609 0.300 . 1 . . . . 85 LYS CA . 11160 1 1016 . 1 1 85 85 LYS CB C 13 32.914 0.300 . 1 . . . . 85 LYS CB . 11160 1 1017 . 1 1 85 85 LYS CD C 13 29.117 0.300 . 1 . . . . 85 LYS CD . 11160 1 1018 . 1 1 85 85 LYS CE C 13 41.961 0.300 . 1 . . . . 85 LYS CE . 11160 1 1019 . 1 1 85 85 LYS CG C 13 24.751 0.300 . 1 . . . . 85 LYS CG . 11160 1 1020 . 1 1 85 85 LYS N N 15 121.741 0.300 . 1 . . . . 85 LYS N . 11160 1 1021 . 1 1 86 86 VAL H H 1 8.112 0.030 . 1 . . . . 86 VAL H . 11160 1 1022 . 1 1 86 86 VAL HA H 1 4.056 0.030 . 1 . . . . 86 VAL HA . 11160 1 1023 . 1 1 86 86 VAL HB H 1 2.063 0.030 . 1 . . . . 86 VAL HB . 11160 1 1024 . 1 1 86 86 VAL HG11 H 1 0.949 0.030 . 1 . . . . 86 VAL HG1 . 11160 1 1025 . 1 1 86 86 VAL HG12 H 1 0.949 0.030 . 1 . . . . 86 VAL HG1 . 11160 1 1026 . 1 1 86 86 VAL HG13 H 1 0.949 0.030 . 1 . . . . 86 VAL HG1 . 11160 1 1027 . 1 1 86 86 VAL HG21 H 1 0.920 0.030 . 1 . . . . 86 VAL HG2 . 11160 1 1028 . 1 1 86 86 VAL HG22 H 1 0.920 0.030 . 1 . . . . 86 VAL HG2 . 11160 1 1029 . 1 1 86 86 VAL HG23 H 1 0.920 0.030 . 1 . . . . 86 VAL HG2 . 11160 1 1030 . 1 1 86 86 VAL C C 13 176.067 0.300 . 1 . . . . 86 VAL C . 11160 1 1031 . 1 1 86 86 VAL CA C 13 62.622 0.300 . 1 . . . . 86 VAL CA . 11160 1 1032 . 1 1 86 86 VAL CB C 13 32.659 0.300 . 1 . . . . 86 VAL CB . 11160 1 1033 . 1 1 86 86 VAL CG1 C 13 20.883 0.300 . 2 . . . . 86 VAL CG1 . 11160 1 1034 . 1 1 86 86 VAL CG2 C 13 21.188 0.300 . 2 . . . . 86 VAL CG2 . 11160 1 1035 . 1 1 86 86 VAL N N 15 121.318 0.300 . 1 . . . . 86 VAL N . 11160 1 1036 . 1 1 87 87 GLN H H 1 8.426 0.030 . 1 . . . . 87 GLN H . 11160 1 1037 . 1 1 87 87 GLN HA H 1 4.344 0.030 . 1 . . . . 87 GLN HA . 11160 1 1038 . 1 1 87 87 GLN HB2 H 1 2.091 0.030 . 2 . . . . 87 GLN HB2 . 11160 1 1039 . 1 1 87 87 GLN HB3 H 1 1.987 0.030 . 2 . . . . 87 GLN HB3 . 11160 1 1040 . 1 1 87 87 GLN HG2 H 1 2.360 0.030 . 1 . . . . 87 GLN HG2 . 11160 1 1041 . 1 1 87 87 GLN HG3 H 1 2.360 0.030 . 1 . . . . 87 GLN HG3 . 11160 1 1042 . 1 1 87 87 GLN C C 13 175.771 0.300 . 1 . . . . 87 GLN C . 11160 1 1043 . 1 1 87 87 GLN CA C 13 55.713 0.300 . 1 . . . . 87 GLN CA . 11160 1 1044 . 1 1 87 87 GLN CB C 13 29.408 0.300 . 1 . . . . 87 GLN CB . 11160 1 1045 . 1 1 87 87 GLN CG C 13 33.730 0.300 . 1 . . . . 87 GLN CG . 11160 1 1046 . 1 1 87 87 GLN N N 15 124.110 0.300 . 1 . . . . 87 GLN N . 11160 1 1047 . 1 1 88 88 MET H H 1 8.451 0.030 . 1 . . . . 88 MET H . 11160 1 1048 . 1 1 88 88 MET HA H 1 4.533 0.030 . 1 . . . . 88 MET HA . 11160 1 1049 . 1 1 88 88 MET HB2 H 1 2.130 0.030 . 2 . . . . 88 MET HB2 . 11160 1 1050 . 1 1 88 88 MET HB3 H 1 2.015 0.030 . 2 . . . . 88 MET HB3 . 11160 1 1051 . 1 1 88 88 MET HE1 H 1 2.097 0.030 . 1 . . . . 88 MET HE . 11160 1 1052 . 1 1 88 88 MET HE2 H 1 2.097 0.030 . 1 . . . . 88 MET HE . 11160 1 1053 . 1 1 88 88 MET HE3 H 1 2.097 0.030 . 1 . . . . 88 MET HE . 11160 1 1054 . 1 1 88 88 MET HG2 H 1 2.626 0.030 . 2 . . . . 88 MET HG2 . 11160 1 1055 . 1 1 88 88 MET HG3 H 1 2.546 0.030 . 2 . . . . 88 MET HG3 . 11160 1 1056 . 1 1 88 88 MET C C 13 176.027 0.300 . 1 . . . . 88 MET C . 11160 1 1057 . 1 1 88 88 MET CA C 13 55.445 0.300 . 1 . . . . 88 MET CA . 11160 1 1058 . 1 1 88 88 MET CB C 13 33.100 0.300 . 1 . . . . 88 MET CB . 11160 1 1059 . 1 1 88 88 MET CE C 13 17.029 0.300 . 1 . . . . 88 MET CE . 11160 1 1060 . 1 1 88 88 MET CG C 13 32.165 0.300 . 1 . . . . 88 MET CG . 11160 1 1061 . 1 1 88 88 MET N N 15 122.449 0.300 . 1 . . . . 88 MET N . 11160 1 1062 . 1 1 89 89 SER H H 1 8.332 0.030 . 1 . . . . 89 SER H . 11160 1 1063 . 1 1 89 89 SER HA H 1 4.481 0.030 . 1 . . . . 89 SER HA . 11160 1 1064 . 1 1 89 89 SER HB2 H 1 3.927 0.030 . 2 . . . . 89 SER HB2 . 11160 1 1065 . 1 1 89 89 SER HB3 H 1 3.873 0.030 . 2 . . . . 89 SER HB3 . 11160 1 1066 . 1 1 89 89 SER C C 13 173.328 0.300 . 1 . . . . 89 SER C . 11160 1 1067 . 1 1 89 89 SER CA C 13 58.239 0.300 . 1 . . . . 89 SER CA . 11160 1 1068 . 1 1 89 89 SER CB C 13 64.044 0.300 . 1 . . . . 89 SER CB . 11160 1 1069 . 1 1 89 89 SER N N 15 117.246 0.300 . 1 . . . . 89 SER N . 11160 1 1070 . 1 1 90 90 ASN H H 1 8.115 0.030 . 1 . . . . 90 ASN H . 11160 1 1071 . 1 1 90 90 ASN C C 13 179.464 0.300 . 1 . . . . 90 ASN C . 11160 1 1072 . 1 1 90 90 ASN N N 15 126.024 0.300 . 1 . . . . 90 ASN N . 11160 1 stop_ save_