data_11182 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 11182 _Entry.Title ; Solution structure of the PDZ domain of human KIAA0340 protein ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2010-07-21 _Entry.Accession_date 2010-07-23 _Entry.Last_release_date 2011-07-20 _Entry.Original_release_date 2011-07-20 _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 3.0.9.14 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.Entry_ID 1 K. Inoue . . . 11182 2 X. Qin . . . 11182 3 F. Hayashi . . . 11182 4 S. Yokoyama . . . 11182 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)' . 11182 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 11182 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 512 11182 '15N chemical shifts' 117 11182 '1H chemical shifts' 833 11182 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 1 . . 2011-07-20 2010-07-21 original author . 11182 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 2CSS 'BMRB Entry Tracking System' 11182 stop_ save_ ############### # Citations # ############### save_citation_1 _Citation.Sf_category citations _Citation.Sf_framecode citation_1 _Citation.Entry_ID 11182 _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 PDZ domain of human KIAA0340 protein' _Citation.Status 'in preparation' _Citation.Type journal _Citation.Journal_abbrev . _Citation.Journal_name_full . _Citation.Journal_volume . _Citation.Journal_issue . _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first . _Citation.Page_last . _Citation.Year . _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.Entry_ID _Citation_author.Citation_ID 1 K. Inoue . . . 11182 1 2 X. Qin . . . 11182 1 3 F. Hayashi . . . 11182 1 4 S. Yokoyama . . . 11182 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 11182 _Assembly.ID 1 _Assembly.Name 'Regulating synaptic membrane exocytosis protein 1' _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 'PDZ domain' 1 $entity_1 A . yes native no no . . . 11182 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 2css . . . . . . 11182 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 11182 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name 'PDZ domain' _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID A _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; GSSGSSGVTWQPSKEGDRLI GRVILNKRTTMPKDSGALLG LKVVGGKMTDLGRLGAFITK VKKGSLADVVGHLRAGDEVL EWNGKPLPGATNEEVYNIIL ESKSEPQVEIIVSRPSGPSS G ; _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 121 _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 2CSS . "Solution Structure Of The Pdz Domain Of Human Kiaa0340 Protein" . . . . . 100.00 121 100.00 100.00 1.26e-77 . . . . 11182 1 2 no DBJ BAE22200 . "unnamed protein product [Mus musculus]" . . . . . 71.90 753 97.70 98.85 5.87e-48 . . . . 11182 1 3 no DBJ BAH11605 . "unnamed protein product [Homo sapiens]" . . . . . 71.90 736 98.85 98.85 3.43e-48 . . . . 11182 1 4 no DBJ BAH14479 . "unnamed protein product [Homo sapiens]" . . . . . 90.91 826 99.09 99.09 7.45e-65 . . . . 11182 1 5 no GB EMP34190 . "Regulating synaptic membrane exocytosis protein 1 [Chelonia mydas]" . . . . . 62.81 540 98.68 98.68 7.90e-41 . . . . 11182 1 6 no GB EPY76123 . "hypothetical protein CB1_001499008 [Camelus ferus]" . . . . . 57.85 149 98.57 98.57 1.03e-38 . . . . 11182 1 7 no GB ETE71210 . "Regulating synaptic membrane exocytosis protein 1, partial [Ophiophagus hannah]" . . . . . 61.98 1643 98.67 98.67 2.82e-39 . . . . 11182 1 8 no REF NP_001161881 . "regulating synaptic membrane exocytosis protein 1 isoform 4 [Homo sapiens]" . . . . . 71.90 760 98.85 98.85 3.10e-48 . . . . 11182 1 9 no REF XP_002690061 . "PREDICTED: regulating synaptic membrane exocytosis protein 1 isoform X31 [Bos taurus]" . . . . . 71.90 868 97.70 98.85 1.44e-47 . . . . 11182 1 10 no REF XP_003271153 . "PREDICTED: regulating synaptic membrane exocytosis protein 1 isoform X6 [Nomascus leucogenys]" . . . . . 71.90 760 97.70 98.85 1.32e-47 . . . . 11182 1 11 no REF XP_004044328 . "PREDICTED: regulating synaptic membrane exocytosis protein 2-like isoform 4 [Gorilla gorilla gorilla]" . . . . . 71.90 760 98.85 98.85 3.10e-48 . . . . 11182 1 12 no REF XP_004381426 . "PREDICTED: regulating synaptic membrane exocytosis protein 1 isoform X6 [Trichechus manatus latirostris]" . . . . . 71.90 760 97.70 98.85 1.51e-47 . . . . 11182 1 stop_ loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID 'PDZ domain' . 11182 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 . 11182 1 2 . SER . 11182 1 3 . SER . 11182 1 4 . GLY . 11182 1 5 . SER . 11182 1 6 . SER . 11182 1 7 . GLY . 11182 1 8 . VAL . 11182 1 9 . THR . 11182 1 10 . TRP . 11182 1 11 . GLN . 11182 1 12 . PRO . 11182 1 13 . SER . 11182 1 14 . LYS . 11182 1 15 . GLU . 11182 1 16 . GLY . 11182 1 17 . ASP . 11182 1 18 . ARG . 11182 1 19 . LEU . 11182 1 20 . ILE . 11182 1 21 . GLY . 11182 1 22 . ARG . 11182 1 23 . VAL . 11182 1 24 . ILE . 11182 1 25 . LEU . 11182 1 26 . ASN . 11182 1 27 . LYS . 11182 1 28 . ARG . 11182 1 29 . THR . 11182 1 30 . THR . 11182 1 31 . MET . 11182 1 32 . PRO . 11182 1 33 . LYS . 11182 1 34 . ASP . 11182 1 35 . SER . 11182 1 36 . GLY . 11182 1 37 . ALA . 11182 1 38 . LEU . 11182 1 39 . LEU . 11182 1 40 . GLY . 11182 1 41 . LEU . 11182 1 42 . LYS . 11182 1 43 . VAL . 11182 1 44 . VAL . 11182 1 45 . GLY . 11182 1 46 . GLY . 11182 1 47 . LYS . 11182 1 48 . MET . 11182 1 49 . THR . 11182 1 50 . ASP . 11182 1 51 . LEU . 11182 1 52 . GLY . 11182 1 53 . ARG . 11182 1 54 . LEU . 11182 1 55 . GLY . 11182 1 56 . ALA . 11182 1 57 . PHE . 11182 1 58 . ILE . 11182 1 59 . THR . 11182 1 60 . LYS . 11182 1 61 . VAL . 11182 1 62 . LYS . 11182 1 63 . LYS . 11182 1 64 . GLY . 11182 1 65 . SER . 11182 1 66 . LEU . 11182 1 67 . ALA . 11182 1 68 . ASP . 11182 1 69 . VAL . 11182 1 70 . VAL . 11182 1 71 . GLY . 11182 1 72 . HIS . 11182 1 73 . LEU . 11182 1 74 . ARG . 11182 1 75 . ALA . 11182 1 76 . GLY . 11182 1 77 . ASP . 11182 1 78 . GLU . 11182 1 79 . VAL . 11182 1 80 . LEU . 11182 1 81 . GLU . 11182 1 82 . TRP . 11182 1 83 . ASN . 11182 1 84 . GLY . 11182 1 85 . LYS . 11182 1 86 . PRO . 11182 1 87 . LEU . 11182 1 88 . PRO . 11182 1 89 . GLY . 11182 1 90 . ALA . 11182 1 91 . THR . 11182 1 92 . ASN . 11182 1 93 . GLU . 11182 1 94 . GLU . 11182 1 95 . VAL . 11182 1 96 . TYR . 11182 1 97 . ASN . 11182 1 98 . ILE . 11182 1 99 . ILE . 11182 1 100 . LEU . 11182 1 101 . GLU . 11182 1 102 . SER . 11182 1 103 . LYS . 11182 1 104 . SER . 11182 1 105 . GLU . 11182 1 106 . PRO . 11182 1 107 . GLN . 11182 1 108 . VAL . 11182 1 109 . GLU . 11182 1 110 . ILE . 11182 1 111 . ILE . 11182 1 112 . VAL . 11182 1 113 . SER . 11182 1 114 . ARG . 11182 1 115 . PRO . 11182 1 116 . SER . 11182 1 117 . GLY . 11182 1 118 . PRO . 11182 1 119 . SER . 11182 1 120 . SER . 11182 1 121 . GLY . 11182 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 11182 1 . SER 2 2 11182 1 . SER 3 3 11182 1 . GLY 4 4 11182 1 . SER 5 5 11182 1 . SER 6 6 11182 1 . GLY 7 7 11182 1 . VAL 8 8 11182 1 . THR 9 9 11182 1 . TRP 10 10 11182 1 . GLN 11 11 11182 1 . PRO 12 12 11182 1 . SER 13 13 11182 1 . LYS 14 14 11182 1 . GLU 15 15 11182 1 . GLY 16 16 11182 1 . ASP 17 17 11182 1 . ARG 18 18 11182 1 . LEU 19 19 11182 1 . ILE 20 20 11182 1 . GLY 21 21 11182 1 . ARG 22 22 11182 1 . VAL 23 23 11182 1 . ILE 24 24 11182 1 . LEU 25 25 11182 1 . ASN 26 26 11182 1 . LYS 27 27 11182 1 . ARG 28 28 11182 1 . THR 29 29 11182 1 . THR 30 30 11182 1 . MET 31 31 11182 1 . PRO 32 32 11182 1 . LYS 33 33 11182 1 . ASP 34 34 11182 1 . SER 35 35 11182 1 . GLY 36 36 11182 1 . ALA 37 37 11182 1 . LEU 38 38 11182 1 . LEU 39 39 11182 1 . GLY 40 40 11182 1 . LEU 41 41 11182 1 . LYS 42 42 11182 1 . VAL 43 43 11182 1 . VAL 44 44 11182 1 . GLY 45 45 11182 1 . GLY 46 46 11182 1 . LYS 47 47 11182 1 . MET 48 48 11182 1 . THR 49 49 11182 1 . ASP 50 50 11182 1 . LEU 51 51 11182 1 . GLY 52 52 11182 1 . ARG 53 53 11182 1 . LEU 54 54 11182 1 . GLY 55 55 11182 1 . ALA 56 56 11182 1 . PHE 57 57 11182 1 . ILE 58 58 11182 1 . THR 59 59 11182 1 . LYS 60 60 11182 1 . VAL 61 61 11182 1 . LYS 62 62 11182 1 . LYS 63 63 11182 1 . GLY 64 64 11182 1 . SER 65 65 11182 1 . LEU 66 66 11182 1 . ALA 67 67 11182 1 . ASP 68 68 11182 1 . VAL 69 69 11182 1 . VAL 70 70 11182 1 . GLY 71 71 11182 1 . HIS 72 72 11182 1 . LEU 73 73 11182 1 . ARG 74 74 11182 1 . ALA 75 75 11182 1 . GLY 76 76 11182 1 . ASP 77 77 11182 1 . GLU 78 78 11182 1 . VAL 79 79 11182 1 . LEU 80 80 11182 1 . GLU 81 81 11182 1 . TRP 82 82 11182 1 . ASN 83 83 11182 1 . GLY 84 84 11182 1 . LYS 85 85 11182 1 . PRO 86 86 11182 1 . LEU 87 87 11182 1 . PRO 88 88 11182 1 . GLY 89 89 11182 1 . ALA 90 90 11182 1 . THR 91 91 11182 1 . ASN 92 92 11182 1 . GLU 93 93 11182 1 . GLU 94 94 11182 1 . VAL 95 95 11182 1 . TYR 96 96 11182 1 . ASN 97 97 11182 1 . ILE 98 98 11182 1 . ILE 99 99 11182 1 . LEU 100 100 11182 1 . GLU 101 101 11182 1 . SER 102 102 11182 1 . LYS 103 103 11182 1 . SER 104 104 11182 1 . GLU 105 105 11182 1 . PRO 106 106 11182 1 . GLN 107 107 11182 1 . VAL 108 108 11182 1 . GLU 109 109 11182 1 . ILE 110 110 11182 1 . ILE 111 111 11182 1 . VAL 112 112 11182 1 . SER 113 113 11182 1 . ARG 114 114 11182 1 . PRO 115 115 11182 1 . SER 116 116 11182 1 . GLY 117 117 11182 1 . PRO 118 118 11182 1 . SER 119 119 11182 1 . SER 120 120 11182 1 . GLY 121 121 11182 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 11182 _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 . . . . . . . . . . . . . . . . . . . . . 11182 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 11182 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_subvariant _Entity_experimental_src.Host_org_organ _Entity_experimental_src.Host_org_tissue _Entity_experimental_src.Host_org_tissue_fraction _Entity_experimental_src.Host_org_cell_line _Entity_experimental_src.Host_org_cell_type _Entity_experimental_src.Host_org_cellular_location _Entity_experimental_src.Host_org_organelle _Entity_experimental_src.Host_org_gene _Entity_experimental_src.Host_org_culture_collection _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Host_org_dev_stage _Entity_experimental_src.Details _Entity_experimental_src.Citation_ID _Entity_experimental_src.Citation_label _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $entity_1 . 'cell free synthesis' 'E. coli - cell free' 'E. coli' . 562 Escherichia coli . . . . . . . . . . . . . plasmid . . P040628-04 . . . . . . 11182 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 11182 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details ; 1.33mM U-15N,13C-labeled {protein;} 20mM {d-Tris-HCl;} 100mM {NaCl;} 1mM {d-DTT;} 0.02% {NaN3;} 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 'PDZ domain' '[U-13C; U-15N]' . . 1 $entity_1 . protein 1.33 . . mM . . . . 11182 1 2 d-Tris-HCl 'natural abundance' . . . . . buffer 20 . . mM . . . . 11182 1 3 NaCl 'natural abundance' . . . . . salt 100 . . mM . . . . 11182 1 4 d-DTT 'natural abundance' . . . . . salt 1 . . mM . . . . 11182 1 5 NaN3 'natural abundance' . . . . . salt 0.02 . . % . . . . 11182 1 6 H2O . . . . . . solvent 90 . . % . . . . 11182 1 7 D2O . . . . . . solvent 10 . . % . . . . 11182 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 11182 _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 11182 1 pH 7.0 0.05 pH 11182 1 pressure 1 0.001 atm 11182 1 temperature 293 0.1 K 11182 1 stop_ save_ ############################ # Computer software used # ############################ save_VNMR _Software.Sf_category software _Software.Sf_framecode VNMR _Software.Entry_ID 11182 _Software.ID 1 _Software.Name VNMR _Software.Version 6.1C _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Varian . . 11182 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection 11182 1 stop_ save_ save_NMRPipe _Software.Sf_category software _Software.Sf_framecode NMRPipe _Software.Entry_ID 11182 _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.' . . 11182 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 11182 2 stop_ save_ save_NMRView _Software.Sf_category software _Software.Sf_framecode NMRView _Software.Entry_ID 11182 _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.' . . 11182 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 11182 3 stop_ save_ save_Kujira _Software.Sf_category software _Software.Sf_framecode Kujira _Software.Entry_ID 11182 _Software.ID 4 _Software.Name Kujira _Software.Version 0.9296 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Kobayashi, N.' . . 11182 4 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 11182 4 stop_ save_ save_CYANA _Software.Sf_category software _Software.Sf_framecode CYANA _Software.Entry_ID 11182 _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.' . . 11182 5 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID refinement 11182 5 'structure solution' 11182 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 11182 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model INOVA _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ save_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_2 _NMR_spectrometer.Entry_ID 11182 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model INOVA _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 900 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 11182 _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 Varian INOVA . 800 . . . 11182 1 2 spectrometer_2 Varian INOVA . 900 . . . 11182 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 11182 _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 . . . . . . . . . . . . . . . . 11182 1 2 '3D 13C-separated NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $condition_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 11182 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 11182 _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 . . . . . . . . . 11182 1 H 1 DSS 'methyl protons' . . . . ppm 0.0 . indirect 1.0 . . . . . . . . . 11182 1 N 15 DSS 'methyl protons' . . . . ppm 0.0 . indirect 0.101329118 . . . . . . . . . 11182 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 11182 _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 11182 1 2 '3D 13C-separated NOESY' 1 $sample_1 isotropic 11182 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 $VNMR . . 11182 1 2 $NMRPipe . . 11182 1 3 $NMRView . . 11182 1 4 $Kujira . . 11182 1 5 $CYANA . . 11182 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 4 4 GLY H H 1 8.450 0.030 . 1 . . . . 4 GLY H . 11182 1 2 . 1 1 4 4 GLY HA2 H 1 3.983 0.030 . 1 . . . . 4 GLY HA2 . 11182 1 3 . 1 1 4 4 GLY HA3 H 1 3.983 0.030 . 1 . . . . 4 GLY HA3 . 11182 1 4 . 1 1 4 4 GLY CA C 13 45.282 0.300 . 1 . . . . 4 GLY CA . 11182 1 5 . 1 1 5 5 SER H H 1 8.224 0.030 . 1 . . . . 5 SER H . 11182 1 6 . 1 1 5 5 SER HA H 1 4.500 0.030 . 1 . . . . 5 SER HA . 11182 1 7 . 1 1 5 5 SER HB2 H 1 3.884 0.030 . 1 . . . . 5 SER HB2 . 11182 1 8 . 1 1 5 5 SER HB3 H 1 3.884 0.030 . 1 . . . . 5 SER HB3 . 11182 1 9 . 1 1 5 5 SER C C 13 174.144 0.300 . 1 . . . . 5 SER C . 11182 1 10 . 1 1 5 5 SER CA C 13 58.412 0.300 . 1 . . . . 5 SER CA . 11182 1 11 . 1 1 5 5 SER CB C 13 64.105 0.300 . 1 . . . . 5 SER CB . 11182 1 12 . 1 1 6 6 SER H H 1 8.325 0.030 . 1 . . . . 6 SER H . 11182 1 13 . 1 1 6 6 SER HA H 1 4.498 0.030 . 1 . . . . 6 SER HA . 11182 1 14 . 1 1 6 6 SER HB2 H 1 3.869 0.030 . 2 . . . . 6 SER HB2 . 11182 1 15 . 1 1 6 6 SER HB3 H 1 3.898 0.030 . 2 . . . . 6 SER HB3 . 11182 1 16 . 1 1 6 6 SER C C 13 174.341 0.300 . 1 . . . . 6 SER C . 11182 1 17 . 1 1 6 6 SER CA C 13 58.419 0.300 . 1 . . . . 6 SER CA . 11182 1 18 . 1 1 6 6 SER CB C 13 64.255 0.300 . 1 . . . . 6 SER CB . 11182 1 19 . 1 1 6 6 SER N N 15 117.328 0.300 . 1 . . . . 6 SER N . 11182 1 20 . 1 1 7 7 GLY H H 1 8.720 0.030 . 1 . . . . 7 GLY H . 11182 1 21 . 1 1 7 7 GLY HA2 H 1 3.846 0.030 . 2 . . . . 7 GLY HA2 . 11182 1 22 . 1 1 7 7 GLY HA3 H 1 4.202 0.030 . 2 . . . . 7 GLY HA3 . 11182 1 23 . 1 1 7 7 GLY C C 13 171.599 0.300 . 1 . . . . 7 GLY C . 11182 1 24 . 1 1 7 7 GLY CA C 13 45.174 0.300 . 1 . . . . 7 GLY CA . 11182 1 25 . 1 1 7 7 GLY N N 15 111.148 0.300 . 1 . . . . 7 GLY N . 11182 1 26 . 1 1 8 8 VAL H H 1 8.026 0.030 . 1 . . . . 8 VAL H . 11182 1 27 . 1 1 8 8 VAL HA H 1 4.941 0.030 . 1 . . . . 8 VAL HA . 11182 1 28 . 1 1 8 8 VAL HB H 1 1.886 0.030 . 1 . . . . 8 VAL HB . 11182 1 29 . 1 1 8 8 VAL HG11 H 1 0.767 0.030 . 1 . . . . 8 VAL HG1 . 11182 1 30 . 1 1 8 8 VAL HG12 H 1 0.767 0.030 . 1 . . . . 8 VAL HG1 . 11182 1 31 . 1 1 8 8 VAL HG13 H 1 0.767 0.030 . 1 . . . . 8 VAL HG1 . 11182 1 32 . 1 1 8 8 VAL HG21 H 1 0.333 0.030 . 1 . . . . 8 VAL HG2 . 11182 1 33 . 1 1 8 8 VAL HG22 H 1 0.333 0.030 . 1 . . . . 8 VAL HG2 . 11182 1 34 . 1 1 8 8 VAL HG23 H 1 0.333 0.030 . 1 . . . . 8 VAL HG2 . 11182 1 35 . 1 1 8 8 VAL C C 13 174.445 0.300 . 1 . . . . 8 VAL C . 11182 1 36 . 1 1 8 8 VAL CA C 13 60.028 0.300 . 1 . . . . 8 VAL CA . 11182 1 37 . 1 1 8 8 VAL CB C 13 34.415 0.300 . 1 . . . . 8 VAL CB . 11182 1 38 . 1 1 8 8 VAL CG1 C 13 19.547 0.300 . 2 . . . . 8 VAL CG1 . 11182 1 39 . 1 1 8 8 VAL CG2 C 13 21.161 0.300 . 2 . . . . 8 VAL CG2 . 11182 1 40 . 1 1 8 8 VAL N N 15 118.532 0.300 . 1 . . . . 8 VAL N . 11182 1 41 . 1 1 9 9 THR H H 1 7.902 0.030 . 1 . . . . 9 THR H . 11182 1 42 . 1 1 9 9 THR HA H 1 4.533 0.030 . 1 . . . . 9 THR HA . 11182 1 43 . 1 1 9 9 THR HB H 1 4.009 0.030 . 1 . . . . 9 THR HB . 11182 1 44 . 1 1 9 9 THR HG21 H 1 1.180 0.030 . 1 . . . . 9 THR HG2 . 11182 1 45 . 1 1 9 9 THR HG22 H 1 1.180 0.030 . 1 . . . . 9 THR HG2 . 11182 1 46 . 1 1 9 9 THR HG23 H 1 1.180 0.030 . 1 . . . . 9 THR HG2 . 11182 1 47 . 1 1 9 9 THR C C 13 172.920 0.300 . 1 . . . . 9 THR C . 11182 1 48 . 1 1 9 9 THR CA C 13 60.699 0.300 . 1 . . . . 9 THR CA . 11182 1 49 . 1 1 9 9 THR CB C 13 71.199 0.300 . 1 . . . . 9 THR CB . 11182 1 50 . 1 1 9 9 THR CG2 C 13 21.555 0.300 . 1 . . . . 9 THR CG2 . 11182 1 51 . 1 1 9 9 THR N N 15 120.344 0.300 . 1 . . . . 9 THR N . 11182 1 52 . 1 1 10 10 TRP H H 1 8.830 0.030 . 1 . . . . 10 TRP H . 11182 1 53 . 1 1 10 10 TRP HA H 1 5.436 0.030 . 1 . . . . 10 TRP HA . 11182 1 54 . 1 1 10 10 TRP HB2 H 1 2.999 0.030 . 1 . . . . 10 TRP HB2 . 11182 1 55 . 1 1 10 10 TRP HB3 H 1 2.999 0.030 . 1 . . . . 10 TRP HB3 . 11182 1 56 . 1 1 10 10 TRP HD1 H 1 7.178 0.030 . 1 . . . . 10 TRP HD1 . 11182 1 57 . 1 1 10 10 TRP HE1 H 1 9.789 0.030 . 1 . . . . 10 TRP HE1 . 11182 1 58 . 1 1 10 10 TRP HE3 H 1 7.112 0.030 . 1 . . . . 10 TRP HE3 . 11182 1 59 . 1 1 10 10 TRP HH2 H 1 6.877 0.030 . 1 . . . . 10 TRP HH2 . 11182 1 60 . 1 1 10 10 TRP HZ2 H 1 7.318 0.030 . 1 . . . . 10 TRP HZ2 . 11182 1 61 . 1 1 10 10 TRP HZ3 H 1 6.715 0.030 . 1 . . . . 10 TRP HZ3 . 11182 1 62 . 1 1 10 10 TRP C C 13 176.423 0.300 . 1 . . . . 10 TRP C . 11182 1 63 . 1 1 10 10 TRP CA C 13 55.814 0.300 . 1 . . . . 10 TRP CA . 11182 1 64 . 1 1 10 10 TRP CB C 13 32.150 0.300 . 1 . . . . 10 TRP CB . 11182 1 65 . 1 1 10 10 TRP CD1 C 13 126.967 0.300 . 1 . . . . 10 TRP CD1 . 11182 1 66 . 1 1 10 10 TRP CE3 C 13 120.131 0.300 . 1 . . . . 10 TRP CE3 . 11182 1 67 . 1 1 10 10 TRP CH2 C 13 124.084 0.300 . 1 . . . . 10 TRP CH2 . 11182 1 68 . 1 1 10 10 TRP CZ2 C 13 114.119 0.300 . 1 . . . . 10 TRP CZ2 . 11182 1 69 . 1 1 10 10 TRP CZ3 C 13 121.066 0.300 . 1 . . . . 10 TRP CZ3 . 11182 1 70 . 1 1 10 10 TRP N N 15 125.147 0.300 . 1 . . . . 10 TRP N . 11182 1 71 . 1 1 10 10 TRP NE1 N 15 129.355 0.300 . 1 . . . . 10 TRP NE1 . 11182 1 72 . 1 1 11 11 GLN H H 1 9.312 0.030 . 1 . . . . 11 GLN H . 11182 1 73 . 1 1 11 11 GLN HA H 1 5.081 0.030 . 1 . . . . 11 GLN HA . 11182 1 74 . 1 1 11 11 GLN HB2 H 1 2.034 0.030 . 2 . . . . 11 GLN HB2 . 11182 1 75 . 1 1 11 11 GLN HB3 H 1 2.146 0.030 . 2 . . . . 11 GLN HB3 . 11182 1 76 . 1 1 11 11 GLN HE21 H 1 6.871 0.030 . 2 . . . . 11 GLN HE21 . 11182 1 77 . 1 1 11 11 GLN HE22 H 1 7.492 0.030 . 2 . . . . 11 GLN HE22 . 11182 1 78 . 1 1 11 11 GLN HG2 H 1 2.330 0.030 . 2 . . . . 11 GLN HG2 . 11182 1 79 . 1 1 11 11 GLN HG3 H 1 2.430 0.030 . 2 . . . . 11 GLN HG3 . 11182 1 80 . 1 1 11 11 GLN C C 13 172.918 0.300 . 1 . . . . 11 GLN C . 11182 1 81 . 1 1 11 11 GLN CA C 13 52.946 0.300 . 1 . . . . 11 GLN CA . 11182 1 82 . 1 1 11 11 GLN CB C 13 31.755 0.300 . 1 . . . . 11 GLN CB . 11182 1 83 . 1 1 11 11 GLN CG C 13 33.265 0.300 . 1 . . . . 11 GLN CG . 11182 1 84 . 1 1 11 11 GLN N N 15 121.501 0.300 . 1 . . . . 11 GLN N . 11182 1 85 . 1 1 11 11 GLN NE2 N 15 111.946 0.300 . 1 . . . . 11 GLN NE2 . 11182 1 86 . 1 1 12 12 PRO HA H 1 5.043 0.030 . 1 . . . . 12 PRO HA . 11182 1 87 . 1 1 12 12 PRO HB2 H 1 2.080 0.030 . 2 . . . . 12 PRO HB2 . 11182 1 88 . 1 1 12 12 PRO HB3 H 1 2.405 0.030 . 2 . . . . 12 PRO HB3 . 11182 1 89 . 1 1 12 12 PRO HD2 H 1 3.785 0.030 . 2 . . . . 12 PRO HD2 . 11182 1 90 . 1 1 12 12 PRO HD3 H 1 3.865 0.030 . 2 . . . . 12 PRO HD3 . 11182 1 91 . 1 1 12 12 PRO HG2 H 1 2.033 0.030 . 2 . . . . 12 PRO HG2 . 11182 1 92 . 1 1 12 12 PRO HG3 H 1 2.165 0.030 . 2 . . . . 12 PRO HG3 . 11182 1 93 . 1 1 12 12 PRO C C 13 177.706 0.300 . 1 . . . . 12 PRO C . 11182 1 94 . 1 1 12 12 PRO CA C 13 62.794 0.300 . 1 . . . . 12 PRO CA . 11182 1 95 . 1 1 12 12 PRO CB C 13 32.215 0.300 . 1 . . . . 12 PRO CB . 11182 1 96 . 1 1 12 12 PRO CD C 13 50.688 0.300 . 1 . . . . 12 PRO CD . 11182 1 97 . 1 1 12 12 PRO CG C 13 27.573 0.300 . 1 . . . . 12 PRO CG . 11182 1 98 . 1 1 13 13 SER H H 1 8.777 0.030 . 1 . . . . 13 SER H . 11182 1 99 . 1 1 13 13 SER HA H 1 4.467 0.030 . 1 . . . . 13 SER HA . 11182 1 100 . 1 1 13 13 SER HB2 H 1 3.835 0.030 . 2 . . . . 13 SER HB2 . 11182 1 101 . 1 1 13 13 SER HB3 H 1 4.401 0.030 . 2 . . . . 13 SER HB3 . 11182 1 102 . 1 1 13 13 SER C C 13 175.690 0.300 . 1 . . . . 13 SER C . 11182 1 103 . 1 1 13 13 SER CA C 13 57.413 0.300 . 1 . . . . 13 SER CA . 11182 1 104 . 1 1 13 13 SER CB C 13 64.636 0.300 . 1 . . . . 13 SER CB . 11182 1 105 . 1 1 13 13 SER N N 15 117.335 0.300 . 1 . . . . 13 SER N . 11182 1 106 . 1 1 14 14 LYS H H 1 9.060 0.030 . 1 . . . . 14 LYS H . 11182 1 107 . 1 1 14 14 LYS HA H 1 4.073 0.030 . 1 . . . . 14 LYS HA . 11182 1 108 . 1 1 14 14 LYS HB2 H 1 1.912 0.030 . 2 . . . . 14 LYS HB2 . 11182 1 109 . 1 1 14 14 LYS HB3 H 1 1.819 0.030 . 2 . . . . 14 LYS HB3 . 11182 1 110 . 1 1 14 14 LYS HD2 H 1 1.709 0.030 . 1 . . . . 14 LYS HD2 . 11182 1 111 . 1 1 14 14 LYS HD3 H 1 1.709 0.030 . 1 . . . . 14 LYS HD3 . 11182 1 112 . 1 1 14 14 LYS HE2 H 1 3.019 0.030 . 1 . . . . 14 LYS HE2 . 11182 1 113 . 1 1 14 14 LYS HE3 H 1 3.019 0.030 . 1 . . . . 14 LYS HE3 . 11182 1 114 . 1 1 14 14 LYS HG2 H 1 1.465 0.030 . 1 . . . . 14 LYS HG2 . 11182 1 115 . 1 1 14 14 LYS HG3 H 1 1.465 0.030 . 1 . . . . 14 LYS HG3 . 11182 1 116 . 1 1 14 14 LYS C C 13 178.031 0.300 . 1 . . . . 14 LYS C . 11182 1 117 . 1 1 14 14 LYS CA C 13 59.233 0.300 . 1 . . . . 14 LYS CA . 11182 1 118 . 1 1 14 14 LYS CB C 13 32.122 0.300 . 1 . . . . 14 LYS CB . 11182 1 119 . 1 1 14 14 LYS CD C 13 29.326 0.300 . 1 . . . . 14 LYS CD . 11182 1 120 . 1 1 14 14 LYS CE C 13 42.116 0.300 . 1 . . . . 14 LYS CE . 11182 1 121 . 1 1 14 14 LYS CG C 13 24.599 0.300 . 1 . . . . 14 LYS CG . 11182 1 122 . 1 1 14 14 LYS N N 15 123.425 0.300 . 1 . . . . 14 LYS N . 11182 1 123 . 1 1 15 15 GLU H H 1 8.486 0.030 . 1 . . . . 15 GLU H . 11182 1 124 . 1 1 15 15 GLU HA H 1 4.292 0.030 . 1 . . . . 15 GLU HA . 11182 1 125 . 1 1 15 15 GLU HB2 H 1 2.078 0.030 . 1 . . . . 15 GLU HB2 . 11182 1 126 . 1 1 15 15 GLU HB3 H 1 2.078 0.030 . 1 . . . . 15 GLU HB3 . 11182 1 127 . 1 1 15 15 GLU HG2 H 1 2.225 0.030 . 2 . . . . 15 GLU HG2 . 11182 1 128 . 1 1 15 15 GLU HG3 H 1 2.446 0.030 . 2 . . . . 15 GLU HG3 . 11182 1 129 . 1 1 15 15 GLU C C 13 177.843 0.300 . 1 . . . . 15 GLU C . 11182 1 130 . 1 1 15 15 GLU CA C 13 57.499 0.300 . 1 . . . . 15 GLU CA . 11182 1 131 . 1 1 15 15 GLU CB C 13 29.402 0.300 . 1 . . . . 15 GLU CB . 11182 1 132 . 1 1 15 15 GLU CG C 13 36.848 0.300 . 1 . . . . 15 GLU CG . 11182 1 133 . 1 1 15 15 GLU N N 15 115.470 0.300 . 1 . . . . 15 GLU N . 11182 1 134 . 1 1 16 16 GLY H H 1 8.005 0.030 . 1 . . . . 16 GLY H . 11182 1 135 . 1 1 16 16 GLY HA2 H 1 3.711 0.030 . 2 . . . . 16 GLY HA2 . 11182 1 136 . 1 1 16 16 GLY HA3 H 1 4.168 0.030 . 2 . . . . 16 GLY HA3 . 11182 1 137 . 1 1 16 16 GLY C C 13 173.773 0.300 . 1 . . . . 16 GLY C . 11182 1 138 . 1 1 16 16 GLY CA C 13 45.609 0.300 . 1 . . . . 16 GLY CA . 11182 1 139 . 1 1 16 16 GLY N N 15 107.875 0.300 . 1 . . . . 16 GLY N . 11182 1 140 . 1 1 17 17 ASP H H 1 8.517 0.030 . 1 . . . . 17 ASP H . 11182 1 141 . 1 1 17 17 ASP HA H 1 4.602 0.030 . 1 . . . . 17 ASP HA . 11182 1 142 . 1 1 17 17 ASP HB2 H 1 2.646 0.030 . 2 . . . . 17 ASP HB2 . 11182 1 143 . 1 1 17 17 ASP HB3 H 1 2.826 0.030 . 2 . . . . 17 ASP HB3 . 11182 1 144 . 1 1 17 17 ASP C C 13 175.849 0.300 . 1 . . . . 17 ASP C . 11182 1 145 . 1 1 17 17 ASP CA C 13 53.927 0.300 . 1 . . . . 17 ASP CA . 11182 1 146 . 1 1 17 17 ASP CB C 13 40.170 0.300 . 1 . . . . 17 ASP CB . 11182 1 147 . 1 1 17 17 ASP N N 15 117.302 0.300 . 1 . . . . 17 ASP N . 11182 1 148 . 1 1 18 18 ARG H H 1 7.697 0.030 . 1 . . . . 18 ARG H . 11182 1 149 . 1 1 18 18 ARG HA H 1 5.006 0.030 . 1 . . . . 18 ARG HA . 11182 1 150 . 1 1 18 18 ARG HB2 H 1 1.605 0.030 . 2 . . . . 18 ARG HB2 . 11182 1 151 . 1 1 18 18 ARG HB3 H 1 1.856 0.030 . 2 . . . . 18 ARG HB3 . 11182 1 152 . 1 1 18 18 ARG HD2 H 1 3.106 0.030 . 2 . . . . 18 ARG HD2 . 11182 1 153 . 1 1 18 18 ARG HD3 H 1 3.142 0.030 . 2 . . . . 18 ARG HD3 . 11182 1 154 . 1 1 18 18 ARG HE H 1 7.182 0.030 . 1 . . . . 18 ARG HE . 11182 1 155 . 1 1 18 18 ARG HG2 H 1 1.534 0.030 . 1 . . . . 18 ARG HG2 . 11182 1 156 . 1 1 18 18 ARG HG3 H 1 1.534 0.030 . 1 . . . . 18 ARG HG3 . 11182 1 157 . 1 1 18 18 ARG C C 13 174.498 0.300 . 1 . . . . 18 ARG C . 11182 1 158 . 1 1 18 18 ARG CA C 13 54.001 0.300 . 1 . . . . 18 ARG CA . 11182 1 159 . 1 1 18 18 ARG CB C 13 33.765 0.300 . 1 . . . . 18 ARG CB . 11182 1 160 . 1 1 18 18 ARG CD C 13 43.108 0.300 . 1 . . . . 18 ARG CD . 11182 1 161 . 1 1 18 18 ARG CG C 13 26.831 0.300 . 1 . . . . 18 ARG CG . 11182 1 162 . 1 1 18 18 ARG N N 15 118.848 0.300 . 1 . . . . 18 ARG N . 11182 1 163 . 1 1 18 18 ARG NE N 15 84.909 0.300 . 1 . . . . 18 ARG NE . 11182 1 164 . 1 1 19 19 LEU H H 1 9.357 0.030 . 1 . . . . 19 LEU H . 11182 1 165 . 1 1 19 19 LEU HA H 1 4.833 0.030 . 1 . . . . 19 LEU HA . 11182 1 166 . 1 1 19 19 LEU HB2 H 1 1.562 0.030 . 1 . . . . 19 LEU HB2 . 11182 1 167 . 1 1 19 19 LEU HB3 H 1 1.562 0.030 . 1 . . . . 19 LEU HB3 . 11182 1 168 . 1 1 19 19 LEU HD11 H 1 0.699 0.030 . 1 . . . . 19 LEU HD1 . 11182 1 169 . 1 1 19 19 LEU HD12 H 1 0.699 0.030 . 1 . . . . 19 LEU HD1 . 11182 1 170 . 1 1 19 19 LEU HD13 H 1 0.699 0.030 . 1 . . . . 19 LEU HD1 . 11182 1 171 . 1 1 19 19 LEU HD21 H 1 0.617 0.030 . 1 . . . . 19 LEU HD2 . 11182 1 172 . 1 1 19 19 LEU HD22 H 1 0.617 0.030 . 1 . . . . 19 LEU HD2 . 11182 1 173 . 1 1 19 19 LEU HD23 H 1 0.617 0.030 . 1 . . . . 19 LEU HD2 . 11182 1 174 . 1 1 19 19 LEU HG H 1 1.490 0.030 . 1 . . . . 19 LEU HG . 11182 1 175 . 1 1 19 19 LEU C C 13 175.012 0.300 . 1 . . . . 19 LEU C . 11182 1 176 . 1 1 19 19 LEU CA C 13 54.056 0.300 . 1 . . . . 19 LEU CA . 11182 1 177 . 1 1 19 19 LEU CB C 13 45.441 0.300 . 1 . . . . 19 LEU CB . 11182 1 178 . 1 1 19 19 LEU CD1 C 13 23.461 0.300 . 2 . . . . 19 LEU CD1 . 11182 1 179 . 1 1 19 19 LEU CD2 C 13 24.928 0.300 . 2 . . . . 19 LEU CD2 . 11182 1 180 . 1 1 19 19 LEU CG C 13 27.096 0.300 . 1 . . . . 19 LEU CG . 11182 1 181 . 1 1 19 19 LEU N N 15 122.858 0.300 . 1 . . . . 19 LEU N . 11182 1 182 . 1 1 20 20 ILE H H 1 9.244 0.030 . 1 . . . . 20 ILE H . 11182 1 183 . 1 1 20 20 ILE HA H 1 5.253 0.030 . 1 . . . . 20 ILE HA . 11182 1 184 . 1 1 20 20 ILE HB H 1 2.013 0.030 . 1 . . . . 20 ILE HB . 11182 1 185 . 1 1 20 20 ILE HD11 H 1 0.789 0.030 . 1 . . . . 20 ILE HD1 . 11182 1 186 . 1 1 20 20 ILE HD12 H 1 0.789 0.030 . 1 . . . . 20 ILE HD1 . 11182 1 187 . 1 1 20 20 ILE HD13 H 1 0.789 0.030 . 1 . . . . 20 ILE HD1 . 11182 1 188 . 1 1 20 20 ILE HG12 H 1 1.345 0.030 . 2 . . . . 20 ILE HG12 . 11182 1 189 . 1 1 20 20 ILE HG13 H 1 1.433 0.030 . 2 . . . . 20 ILE HG13 . 11182 1 190 . 1 1 20 20 ILE HG21 H 1 0.801 0.030 . 1 . . . . 20 ILE HG2 . 11182 1 191 . 1 1 20 20 ILE HG22 H 1 0.801 0.030 . 1 . . . . 20 ILE HG2 . 11182 1 192 . 1 1 20 20 ILE HG23 H 1 0.801 0.030 . 1 . . . . 20 ILE HG2 . 11182 1 193 . 1 1 20 20 ILE C C 13 176.688 0.300 . 1 . . . . 20 ILE C . 11182 1 194 . 1 1 20 20 ILE CA C 13 58.546 0.300 . 1 . . . . 20 ILE CA . 11182 1 195 . 1 1 20 20 ILE CB C 13 37.694 0.300 . 1 . . . . 20 ILE CB . 11182 1 196 . 1 1 20 20 ILE CD1 C 13 11.077 0.300 . 1 . . . . 20 ILE CD1 . 11182 1 197 . 1 1 20 20 ILE CG1 C 13 27.110 0.300 . 1 . . . . 20 ILE CG1 . 11182 1 198 . 1 1 20 20 ILE CG2 C 13 17.276 0.300 . 1 . . . . 20 ILE CG2 . 11182 1 199 . 1 1 20 20 ILE N N 15 123.637 0.300 . 1 . . . . 20 ILE N . 11182 1 200 . 1 1 21 21 GLY H H 1 9.344 0.030 . 1 . . . . 21 GLY H . 11182 1 201 . 1 1 21 21 GLY HA2 H 1 1.554 0.030 . 2 . . . . 21 GLY HA2 . 11182 1 202 . 1 1 21 21 GLY HA3 H 1 4.358 0.030 . 2 . . . . 21 GLY HA3 . 11182 1 203 . 1 1 21 21 GLY C C 13 171.025 0.300 . 1 . . . . 21 GLY C . 11182 1 204 . 1 1 21 21 GLY CA C 13 43.544 0.300 . 1 . . . . 21 GLY CA . 11182 1 205 . 1 1 21 21 GLY N N 15 119.331 0.300 . 1 . . . . 21 GLY N . 11182 1 206 . 1 1 22 22 ARG H H 1 8.180 0.030 . 1 . . . . 22 ARG H . 11182 1 207 . 1 1 22 22 ARG HA H 1 4.809 0.030 . 1 . . . . 22 ARG HA . 11182 1 208 . 1 1 22 22 ARG HB2 H 1 1.479 0.030 . 2 . . . . 22 ARG HB2 . 11182 1 209 . 1 1 22 22 ARG HB3 H 1 1.624 0.030 . 2 . . . . 22 ARG HB3 . 11182 1 210 . 1 1 22 22 ARG HD2 H 1 2.968 0.030 . 2 . . . . 22 ARG HD2 . 11182 1 211 . 1 1 22 22 ARG HD3 H 1 3.055 0.030 . 2 . . . . 22 ARG HD3 . 11182 1 212 . 1 1 22 22 ARG HE H 1 7.415 0.030 . 1 . . . . 22 ARG HE . 11182 1 213 . 1 1 22 22 ARG HG2 H 1 1.139 0.030 . 2 . . . . 22 ARG HG2 . 11182 1 214 . 1 1 22 22 ARG HG3 H 1 1.339 0.030 . 2 . . . . 22 ARG HG3 . 11182 1 215 . 1 1 22 22 ARG C C 13 174.603 0.300 . 1 . . . . 22 ARG C . 11182 1 216 . 1 1 22 22 ARG CA C 13 54.587 0.300 . 1 . . . . 22 ARG CA . 11182 1 217 . 1 1 22 22 ARG CB C 13 31.318 0.300 . 1 . . . . 22 ARG CB . 11182 1 218 . 1 1 22 22 ARG CD C 13 43.345 0.300 . 1 . . . . 22 ARG CD . 11182 1 219 . 1 1 22 22 ARG CG C 13 27.703 0.300 . 1 . . . . 22 ARG CG . 11182 1 220 . 1 1 22 22 ARG N N 15 124.125 0.300 . 1 . . . . 22 ARG N . 11182 1 221 . 1 1 22 22 ARG NE N 15 84.647 0.300 . 1 . . . . 22 ARG NE . 11182 1 222 . 1 1 23 23 VAL H H 1 9.148 0.030 . 1 . . . . 23 VAL H . 11182 1 223 . 1 1 23 23 VAL HA H 1 4.451 0.030 . 1 . . . . 23 VAL HA . 11182 1 224 . 1 1 23 23 VAL HB H 1 1.956 0.030 . 1 . . . . 23 VAL HB . 11182 1 225 . 1 1 23 23 VAL HG11 H 1 0.711 0.030 . 1 . . . . 23 VAL HG1 . 11182 1 226 . 1 1 23 23 VAL HG12 H 1 0.711 0.030 . 1 . . . . 23 VAL HG1 . 11182 1 227 . 1 1 23 23 VAL HG13 H 1 0.711 0.030 . 1 . . . . 23 VAL HG1 . 11182 1 228 . 1 1 23 23 VAL HG21 H 1 0.700 0.030 . 1 . . . . 23 VAL HG2 . 11182 1 229 . 1 1 23 23 VAL HG22 H 1 0.700 0.030 . 1 . . . . 23 VAL HG2 . 11182 1 230 . 1 1 23 23 VAL HG23 H 1 0.700 0.030 . 1 . . . . 23 VAL HG2 . 11182 1 231 . 1 1 23 23 VAL C C 13 173.547 0.300 . 1 . . . . 23 VAL C . 11182 1 232 . 1 1 23 23 VAL CA C 13 60.469 0.300 . 1 . . . . 23 VAL CA . 11182 1 233 . 1 1 23 23 VAL CB C 13 34.106 0.300 . 1 . . . . 23 VAL CB . 11182 1 234 . 1 1 23 23 VAL CG1 C 13 21.196 0.300 . 2 . . . . 23 VAL CG1 . 11182 1 235 . 1 1 23 23 VAL CG2 C 13 21.068 0.300 . 2 . . . . 23 VAL CG2 . 11182 1 236 . 1 1 23 23 VAL N N 15 128.326 0.300 . 1 . . . . 23 VAL N . 11182 1 237 . 1 1 24 24 ILE H H 1 8.533 0.030 . 1 . . . . 24 ILE H . 11182 1 238 . 1 1 24 24 ILE HA H 1 4.615 0.030 . 1 . . . . 24 ILE HA . 11182 1 239 . 1 1 24 24 ILE HB H 1 1.687 0.030 . 1 . . . . 24 ILE HB . 11182 1 240 . 1 1 24 24 ILE HD11 H 1 0.670 0.030 . 1 . . . . 24 ILE HD1 . 11182 1 241 . 1 1 24 24 ILE HD12 H 1 0.670 0.030 . 1 . . . . 24 ILE HD1 . 11182 1 242 . 1 1 24 24 ILE HD13 H 1 0.670 0.030 . 1 . . . . 24 ILE HD1 . 11182 1 243 . 1 1 24 24 ILE HG12 H 1 0.896 0.030 . 2 . . . . 24 ILE HG12 . 11182 1 244 . 1 1 24 24 ILE HG13 H 1 1.331 0.030 . 2 . . . . 24 ILE HG13 . 11182 1 245 . 1 1 24 24 ILE HG21 H 1 0.560 0.030 . 1 . . . . 24 ILE HG2 . 11182 1 246 . 1 1 24 24 ILE HG22 H 1 0.560 0.030 . 1 . . . . 24 ILE HG2 . 11182 1 247 . 1 1 24 24 ILE HG23 H 1 0.560 0.030 . 1 . . . . 24 ILE HG2 . 11182 1 248 . 1 1 24 24 ILE C C 13 175.178 0.300 . 1 . . . . 24 ILE C . 11182 1 249 . 1 1 24 24 ILE CA C 13 59.838 0.300 . 1 . . . . 24 ILE CA . 11182 1 250 . 1 1 24 24 ILE CB C 13 38.907 0.300 . 1 . . . . 24 ILE CB . 11182 1 251 . 1 1 24 24 ILE CD1 C 13 12.696 0.300 . 1 . . . . 24 ILE CD1 . 11182 1 252 . 1 1 24 24 ILE CG1 C 13 27.602 0.300 . 1 . . . . 24 ILE CG1 . 11182 1 253 . 1 1 24 24 ILE CG2 C 13 17.595 0.300 . 1 . . . . 24 ILE CG2 . 11182 1 254 . 1 1 24 24 ILE N N 15 126.434 0.300 . 1 . . . . 24 ILE N . 11182 1 255 . 1 1 25 25 LEU H H 1 8.679 0.030 . 1 . . . . 25 LEU H . 11182 1 256 . 1 1 25 25 LEU HA H 1 4.631 0.030 . 1 . . . . 25 LEU HA . 11182 1 257 . 1 1 25 25 LEU HB2 H 1 1.044 0.030 . 2 . . . . 25 LEU HB2 . 11182 1 258 . 1 1 25 25 LEU HB3 H 1 1.653 0.030 . 2 . . . . 25 LEU HB3 . 11182 1 259 . 1 1 25 25 LEU HD11 H 1 0.617 0.030 . 1 . . . . 25 LEU HD1 . 11182 1 260 . 1 1 25 25 LEU HD12 H 1 0.617 0.030 . 1 . . . . 25 LEU HD1 . 11182 1 261 . 1 1 25 25 LEU HD13 H 1 0.617 0.030 . 1 . . . . 25 LEU HD1 . 11182 1 262 . 1 1 25 25 LEU HD21 H 1 0.608 0.030 . 1 . . . . 25 LEU HD2 . 11182 1 263 . 1 1 25 25 LEU HD22 H 1 0.608 0.030 . 1 . . . . 25 LEU HD2 . 11182 1 264 . 1 1 25 25 LEU HD23 H 1 0.608 0.030 . 1 . . . . 25 LEU HD2 . 11182 1 265 . 1 1 25 25 LEU HG H 1 1.393 0.030 . 1 . . . . 25 LEU HG . 11182 1 266 . 1 1 25 25 LEU C C 13 174.528 0.300 . 1 . . . . 25 LEU C . 11182 1 267 . 1 1 25 25 LEU CA C 13 52.708 0.300 . 1 . . . . 25 LEU CA . 11182 1 268 . 1 1 25 25 LEU CB C 13 42.967 0.300 . 1 . . . . 25 LEU CB . 11182 1 269 . 1 1 25 25 LEU CD1 C 13 26.138 0.300 . 2 . . . . 25 LEU CD1 . 11182 1 270 . 1 1 25 25 LEU CD2 C 13 23.782 0.300 . 2 . . . . 25 LEU CD2 . 11182 1 271 . 1 1 25 25 LEU CG C 13 26.348 0.300 . 1 . . . . 25 LEU CG . 11182 1 272 . 1 1 25 25 LEU N N 15 124.940 0.300 . 1 . . . . 25 LEU N . 11182 1 273 . 1 1 26 26 ASN H H 1 8.765 0.030 . 1 . . . . 26 ASN H . 11182 1 274 . 1 1 26 26 ASN HA H 1 4.920 0.030 . 1 . . . . 26 ASN HA . 11182 1 275 . 1 1 26 26 ASN HB2 H 1 2.627 0.030 . 2 . . . . 26 ASN HB2 . 11182 1 276 . 1 1 26 26 ASN HB3 H 1 2.847 0.030 . 2 . . . . 26 ASN HB3 . 11182 1 277 . 1 1 26 26 ASN HD21 H 1 6.955 0.030 . 2 . . . . 26 ASN HD21 . 11182 1 278 . 1 1 26 26 ASN HD22 H 1 7.597 0.030 . 2 . . . . 26 ASN HD22 . 11182 1 279 . 1 1 26 26 ASN C C 13 175.163 0.300 . 1 . . . . 26 ASN C . 11182 1 280 . 1 1 26 26 ASN CA C 13 52.572 0.300 . 1 . . . . 26 ASN CA . 11182 1 281 . 1 1 26 26 ASN CB C 13 39.595 0.300 . 1 . . . . 26 ASN CB . 11182 1 282 . 1 1 26 26 ASN N N 15 122.600 0.300 . 1 . . . . 26 ASN N . 11182 1 283 . 1 1 26 26 ASN ND2 N 15 112.406 0.300 . 1 . . . . 26 ASN ND2 . 11182 1 284 . 1 1 27 27 LYS H H 1 8.620 0.030 . 1 . . . . 27 LYS H . 11182 1 285 . 1 1 27 27 LYS HA H 1 4.092 0.030 . 1 . . . . 27 LYS HA . 11182 1 286 . 1 1 27 27 LYS HB2 H 1 1.695 0.030 . 2 . . . . 27 LYS HB2 . 11182 1 287 . 1 1 27 27 LYS HB3 H 1 2.008 0.030 . 2 . . . . 27 LYS HB3 . 11182 1 288 . 1 1 27 27 LYS HD2 H 1 1.725 0.030 . 2 . . . . 27 LYS HD2 . 11182 1 289 . 1 1 27 27 LYS HD3 H 1 1.780 0.030 . 2 . . . . 27 LYS HD3 . 11182 1 290 . 1 1 27 27 LYS HE2 H 1 2.769 0.030 . 2 . . . . 27 LYS HE2 . 11182 1 291 . 1 1 27 27 LYS HE3 H 1 2.958 0.030 . 2 . . . . 27 LYS HE3 . 11182 1 292 . 1 1 27 27 LYS HG2 H 1 1.297 0.030 . 1 . . . . 27 LYS HG2 . 11182 1 293 . 1 1 27 27 LYS HG3 H 1 1.297 0.030 . 1 . . . . 27 LYS HG3 . 11182 1 294 . 1 1 27 27 LYS C C 13 176.815 0.300 . 1 . . . . 27 LYS C . 11182 1 295 . 1 1 27 27 LYS CA C 13 57.293 0.300 . 1 . . . . 27 LYS CA . 11182 1 296 . 1 1 27 27 LYS CB C 13 32.886 0.300 . 1 . . . . 27 LYS CB . 11182 1 297 . 1 1 27 27 LYS CD C 13 29.612 0.300 . 1 . . . . 27 LYS CD . 11182 1 298 . 1 1 27 27 LYS CE C 13 42.678 0.300 . 1 . . . . 27 LYS CE . 11182 1 299 . 1 1 27 27 LYS CG C 13 25.622 0.300 . 1 . . . . 27 LYS CG . 11182 1 300 . 1 1 27 27 LYS N N 15 123.335 0.300 . 1 . . . . 27 LYS N . 11182 1 301 . 1 1 28 28 ARG H H 1 8.351 0.030 . 1 . . . . 28 ARG H . 11182 1 302 . 1 1 28 28 ARG HA H 1 4.327 0.030 . 1 . . . . 28 ARG HA . 11182 1 303 . 1 1 28 28 ARG HB2 H 1 1.864 0.030 . 2 . . . . 28 ARG HB2 . 11182 1 304 . 1 1 28 28 ARG HB3 H 1 1.948 0.030 . 2 . . . . 28 ARG HB3 . 11182 1 305 . 1 1 28 28 ARG HD2 H 1 3.222 0.030 . 1 . . . . 28 ARG HD2 . 11182 1 306 . 1 1 28 28 ARG HD3 H 1 3.222 0.030 . 1 . . . . 28 ARG HD3 . 11182 1 307 . 1 1 28 28 ARG HE H 1 6.943 0.030 . 1 . . . . 28 ARG HE . 11182 1 308 . 1 1 28 28 ARG HG2 H 1 1.655 0.030 . 2 . . . . 28 ARG HG2 . 11182 1 309 . 1 1 28 28 ARG HG3 H 1 1.741 0.030 . 2 . . . . 28 ARG HG3 . 11182 1 310 . 1 1 28 28 ARG C C 13 176.710 0.300 . 1 . . . . 28 ARG C . 11182 1 311 . 1 1 28 28 ARG CA C 13 56.724 0.300 . 1 . . . . 28 ARG CA . 11182 1 312 . 1 1 28 28 ARG CB C 13 30.050 0.300 . 1 . . . . 28 ARG CB . 11182 1 313 . 1 1 28 28 ARG CD C 13 43.347 0.300 . 1 . . . . 28 ARG CD . 11182 1 314 . 1 1 28 28 ARG CG C 13 27.481 0.300 . 1 . . . . 28 ARG CG . 11182 1 315 . 1 1 28 28 ARG N N 15 119.158 0.300 . 1 . . . . 28 ARG N . 11182 1 316 . 1 1 29 29 THR H H 1 7.922 0.030 . 1 . . . . 29 THR H . 11182 1 317 . 1 1 29 29 THR HA H 1 4.413 0.030 . 1 . . . . 29 THR HA . 11182 1 318 . 1 1 29 29 THR HB H 1 4.309 0.030 . 1 . . . . 29 THR HB . 11182 1 319 . 1 1 29 29 THR HG21 H 1 1.170 0.030 . 1 . . . . 29 THR HG2 . 11182 1 320 . 1 1 29 29 THR HG22 H 1 1.170 0.030 . 1 . . . . 29 THR HG2 . 11182 1 321 . 1 1 29 29 THR HG23 H 1 1.170 0.030 . 1 . . . . 29 THR HG2 . 11182 1 322 . 1 1 29 29 THR C C 13 174.398 0.300 . 1 . . . . 29 THR C . 11182 1 323 . 1 1 29 29 THR CA C 13 61.763 0.300 . 1 . . . . 29 THR CA . 11182 1 324 . 1 1 29 29 THR CB C 13 69.456 0.300 . 1 . . . . 29 THR CB . 11182 1 325 . 1 1 29 29 THR CG2 C 13 21.315 0.300 . 1 . . . . 29 THR CG2 . 11182 1 326 . 1 1 29 29 THR N N 15 112.963 0.300 . 1 . . . . 29 THR N . 11182 1 327 . 1 1 30 30 THR H H 1 7.994 0.030 . 1 . . . . 30 THR H . 11182 1 328 . 1 1 30 30 THR HA H 1 4.323 0.030 . 1 . . . . 30 THR HA . 11182 1 329 . 1 1 30 30 THR HB H 1 4.276 0.030 . 1 . . . . 30 THR HB . 11182 1 330 . 1 1 30 30 THR HG21 H 1 1.196 0.030 . 1 . . . . 30 THR HG2 . 11182 1 331 . 1 1 30 30 THR HG22 H 1 1.196 0.030 . 1 . . . . 30 THR HG2 . 11182 1 332 . 1 1 30 30 THR HG23 H 1 1.196 0.030 . 1 . . . . 30 THR HG2 . 11182 1 333 . 1 1 30 30 THR C C 13 174.371 0.300 . 1 . . . . 30 THR C . 11182 1 334 . 1 1 30 30 THR CA C 13 62.140 0.300 . 1 . . . . 30 THR CA . 11182 1 335 . 1 1 30 30 THR CB C 13 69.416 0.300 . 1 . . . . 30 THR CB . 11182 1 336 . 1 1 30 30 THR CG2 C 13 21.832 0.300 . 1 . . . . 30 THR CG2 . 11182 1 337 . 1 1 30 30 THR N N 15 114.876 0.300 . 1 . . . . 30 THR N . 11182 1 338 . 1 1 31 31 MET H H 1 8.306 0.030 . 1 . . . . 31 MET H . 11182 1 339 . 1 1 31 31 MET HA H 1 4.827 0.030 . 1 . . . . 31 MET HA . 11182 1 340 . 1 1 31 31 MET HB2 H 1 1.976 0.030 . 2 . . . . 31 MET HB2 . 11182 1 341 . 1 1 31 31 MET HB3 H 1 2.108 0.030 . 2 . . . . 31 MET HB3 . 11182 1 342 . 1 1 31 31 MET HE1 H 1 2.108 0.030 . 1 . . . . 31 MET HE . 11182 1 343 . 1 1 31 31 MET HE2 H 1 2.108 0.030 . 1 . . . . 31 MET HE . 11182 1 344 . 1 1 31 31 MET HE3 H 1 2.108 0.030 . 1 . . . . 31 MET HE . 11182 1 345 . 1 1 31 31 MET HG2 H 1 2.553 0.030 . 2 . . . . 31 MET HG2 . 11182 1 346 . 1 1 31 31 MET HG3 H 1 2.636 0.030 . 2 . . . . 31 MET HG3 . 11182 1 347 . 1 1 31 31 MET C C 13 174.413 0.300 . 1 . . . . 31 MET C . 11182 1 348 . 1 1 31 31 MET CA C 13 53.580 0.300 . 1 . . . . 31 MET CA . 11182 1 349 . 1 1 31 31 MET CB C 13 32.524 0.300 . 1 . . . . 31 MET CB . 11182 1 350 . 1 1 31 31 MET CE C 13 17.228 0.300 . 1 . . . . 31 MET CE . 11182 1 351 . 1 1 31 31 MET CG C 13 32.195 0.300 . 1 . . . . 31 MET CG . 11182 1 352 . 1 1 31 31 MET N N 15 123.209 0.300 . 1 . . . . 31 MET N . 11182 1 353 . 1 1 32 32 PRO HA H 1 4.380 0.030 . 1 . . . . 32 PRO HA . 11182 1 354 . 1 1 32 32 PRO HB2 H 1 1.937 0.030 . 2 . . . . 32 PRO HB2 . 11182 1 355 . 1 1 32 32 PRO HB3 H 1 2.296 0.030 . 2 . . . . 32 PRO HB3 . 11182 1 356 . 1 1 32 32 PRO HD2 H 1 3.707 0.030 . 2 . . . . 32 PRO HD2 . 11182 1 357 . 1 1 32 32 PRO HD3 H 1 3.840 0.030 . 2 . . . . 32 PRO HD3 . 11182 1 358 . 1 1 32 32 PRO HG2 H 1 2.007 0.030 . 2 . . . . 32 PRO HG2 . 11182 1 359 . 1 1 32 32 PRO HG3 H 1 2.065 0.030 . 2 . . . . 32 PRO HG3 . 11182 1 360 . 1 1 32 32 PRO C C 13 177.434 0.300 . 1 . . . . 32 PRO C . 11182 1 361 . 1 1 32 32 PRO CA C 13 63.958 0.300 . 1 . . . . 32 PRO CA . 11182 1 362 . 1 1 32 32 PRO CB C 13 32.002 0.300 . 1 . . . . 32 PRO CB . 11182 1 363 . 1 1 32 32 PRO CD C 13 50.627 0.300 . 1 . . . . 32 PRO CD . 11182 1 364 . 1 1 32 32 PRO CG C 13 27.595 0.300 . 1 . . . . 32 PRO CG . 11182 1 365 . 1 1 33 33 LYS H H 1 8.371 0.030 . 1 . . . . 33 LYS H . 11182 1 366 . 1 1 33 33 LYS HA H 1 4.250 0.030 . 1 . . . . 33 LYS HA . 11182 1 367 . 1 1 33 33 LYS HB2 H 1 1.803 0.030 . 2 . . . . 33 LYS HB2 . 11182 1 368 . 1 1 33 33 LYS HB3 H 1 1.853 0.030 . 2 . . . . 33 LYS HB3 . 11182 1 369 . 1 1 33 33 LYS HD2 H 1 1.669 0.030 . 1 . . . . 33 LYS HD2 . 11182 1 370 . 1 1 33 33 LYS HD3 H 1 1.669 0.030 . 1 . . . . 33 LYS HD3 . 11182 1 371 . 1 1 33 33 LYS HE2 H 1 3.003 0.030 . 1 . . . . 33 LYS HE2 . 11182 1 372 . 1 1 33 33 LYS HE3 H 1 3.003 0.030 . 1 . . . . 33 LYS HE3 . 11182 1 373 . 1 1 33 33 LYS HG2 H 1 1.411 0.030 . 1 . . . . 33 LYS HG2 . 11182 1 374 . 1 1 33 33 LYS HG3 H 1 1.411 0.030 . 1 . . . . 33 LYS HG3 . 11182 1 375 . 1 1 33 33 LYS C C 13 176.408 0.300 . 1 . . . . 33 LYS C . 11182 1 376 . 1 1 33 33 LYS CA C 13 56.824 0.300 . 1 . . . . 33 LYS CA . 11182 1 377 . 1 1 33 33 LYS CB C 13 32.764 0.300 . 1 . . . . 33 LYS CB . 11182 1 378 . 1 1 33 33 LYS CD C 13 29.090 0.300 . 1 . . . . 33 LYS CD . 11182 1 379 . 1 1 33 33 LYS CE C 13 42.120 0.300 . 1 . . . . 33 LYS CE . 11182 1 380 . 1 1 33 33 LYS CG C 13 24.702 0.300 . 1 . . . . 33 LYS CG . 11182 1 381 . 1 1 33 33 LYS N N 15 119.739 0.300 . 1 . . . . 33 LYS N . 11182 1 382 . 1 1 34 34 ASP H H 1 8.228 0.030 . 1 . . . . 34 ASP H . 11182 1 383 . 1 1 34 34 ASP HA H 1 4.622 0.030 . 1 . . . . 34 ASP HA . 11182 1 384 . 1 1 34 34 ASP HB2 H 1 2.697 0.030 . 2 . . . . 34 ASP HB2 . 11182 1 385 . 1 1 34 34 ASP HB3 H 1 2.782 0.030 . 2 . . . . 34 ASP HB3 . 11182 1 386 . 1 1 34 34 ASP C C 13 176.513 0.300 . 1 . . . . 34 ASP C . 11182 1 387 . 1 1 34 34 ASP CA C 13 54.548 0.300 . 1 . . . . 34 ASP CA . 11182 1 388 . 1 1 34 34 ASP CB C 13 41.371 0.300 . 1 . . . . 34 ASP CB . 11182 1 389 . 1 1 34 34 ASP N N 15 119.920 0.300 . 1 . . . . 34 ASP N . 11182 1 390 . 1 1 35 35 SER HA H 1 4.368 0.030 . 1 . . . . 35 SER HA . 11182 1 391 . 1 1 35 35 SER HB2 H 1 3.904 0.030 . 2 . . . . 35 SER HB2 . 11182 1 392 . 1 1 35 35 SER HB3 H 1 3.971 0.030 . 2 . . . . 35 SER HB3 . 11182 1 393 . 1 1 35 35 SER C C 13 174.416 0.300 . 1 . . . . 35 SER C . 11182 1 394 . 1 1 35 35 SER CA C 13 59.684 0.300 . 1 . . . . 35 SER CA . 11182 1 395 . 1 1 35 35 SER CB C 13 63.761 0.300 . 1 . . . . 35 SER CB . 11182 1 396 . 1 1 36 36 GLY H H 1 8.505 0.030 . 1 . . . . 36 GLY H . 11182 1 397 . 1 1 36 36 GLY HA2 H 1 4.017 0.030 . 1 . . . . 36 GLY HA2 . 11182 1 398 . 1 1 36 36 GLY HA3 H 1 4.017 0.030 . 1 . . . . 36 GLY HA3 . 11182 1 399 . 1 1 36 36 GLY C C 13 171.860 0.300 . 1 . . . . 36 GLY C . 11182 1 400 . 1 1 36 36 GLY CA C 13 45.871 0.300 . 1 . . . . 36 GLY CA . 11182 1 401 . 1 1 36 36 GLY N N 15 110.330 0.300 . 1 . . . . 36 GLY N . 11182 1 402 . 1 1 37 37 ALA H H 1 8.268 0.030 . 1 . . . . 37 ALA H . 11182 1 403 . 1 1 37 37 ALA HA H 1 4.323 0.030 . 1 . . . . 37 ALA HA . 11182 1 404 . 1 1 37 37 ALA HB1 H 1 1.394 0.030 . 1 . . . . 37 ALA HB . 11182 1 405 . 1 1 37 37 ALA HB2 H 1 1.394 0.030 . 1 . . . . 37 ALA HB . 11182 1 406 . 1 1 37 37 ALA HB3 H 1 1.394 0.030 . 1 . . . . 37 ALA HB . 11182 1 407 . 1 1 37 37 ALA C C 13 177.887 0.300 . 1 . . . . 37 ALA C . 11182 1 408 . 1 1 37 37 ALA CA C 13 53.247 0.300 . 1 . . . . 37 ALA CA . 11182 1 409 . 1 1 37 37 ALA CB C 13 19.364 0.300 . 1 . . . . 37 ALA CB . 11182 1 410 . 1 1 38 38 LEU H H 1 7.998 0.030 . 1 . . . . 38 LEU H . 11182 1 411 . 1 1 38 38 LEU HA H 1 4.351 0.030 . 1 . . . . 38 LEU HA . 11182 1 412 . 1 1 38 38 LEU HB2 H 1 1.767 0.030 . 2 . . . . 38 LEU HB2 . 11182 1 413 . 1 1 38 38 LEU HB3 H 1 1.954 0.030 . 2 . . . . 38 LEU HB3 . 11182 1 414 . 1 1 38 38 LEU HD11 H 1 0.985 0.030 . 1 . . . . 38 LEU HD1 . 11182 1 415 . 1 1 38 38 LEU HD12 H 1 0.985 0.030 . 1 . . . . 38 LEU HD1 . 11182 1 416 . 1 1 38 38 LEU HD13 H 1 0.985 0.030 . 1 . . . . 38 LEU HD1 . 11182 1 417 . 1 1 38 38 LEU HD21 H 1 0.878 0.030 . 1 . . . . 38 LEU HD2 . 11182 1 418 . 1 1 38 38 LEU HD22 H 1 0.878 0.030 . 1 . . . . 38 LEU HD2 . 11182 1 419 . 1 1 38 38 LEU HD23 H 1 0.878 0.030 . 1 . . . . 38 LEU HD2 . 11182 1 420 . 1 1 38 38 LEU HG H 1 1.643 0.030 . 1 . . . . 38 LEU HG . 11182 1 421 . 1 1 38 38 LEU C C 13 177.918 0.300 . 1 . . . . 38 LEU C . 11182 1 422 . 1 1 38 38 LEU CA C 13 55.769 0.300 . 1 . . . . 38 LEU CA . 11182 1 423 . 1 1 38 38 LEU CB C 13 42.395 0.300 . 1 . . . . 38 LEU CB . 11182 1 424 . 1 1 38 38 LEU CD1 C 13 25.369 0.300 . 2 . . . . 38 LEU CD1 . 11182 1 425 . 1 1 38 38 LEU CD2 C 13 24.241 0.300 . 2 . . . . 38 LEU CD2 . 11182 1 426 . 1 1 38 38 LEU CG C 13 27.957 0.300 . 1 . . . . 38 LEU CG . 11182 1 427 . 1 1 38 38 LEU N N 15 117.918 0.300 . 1 . . . . 38 LEU N . 11182 1 428 . 1 1 39 39 LEU H H 1 8.237 0.030 . 1 . . . . 39 LEU H . 11182 1 429 . 1 1 39 39 LEU HA H 1 4.103 0.030 . 1 . . . . 39 LEU HA . 11182 1 430 . 1 1 39 39 LEU HB2 H 1 1.529 0.030 . 2 . . . . 39 LEU HB2 . 11182 1 431 . 1 1 39 39 LEU HB3 H 1 2.086 0.030 . 2 . . . . 39 LEU HB3 . 11182 1 432 . 1 1 39 39 LEU HD11 H 1 0.842 0.030 . 1 . . . . 39 LEU HD1 . 11182 1 433 . 1 1 39 39 LEU HD12 H 1 0.842 0.030 . 1 . . . . 39 LEU HD1 . 11182 1 434 . 1 1 39 39 LEU HD13 H 1 0.842 0.030 . 1 . . . . 39 LEU HD1 . 11182 1 435 . 1 1 39 39 LEU HD21 H 1 0.895 0.030 . 1 . . . . 39 LEU HD2 . 11182 1 436 . 1 1 39 39 LEU HD22 H 1 0.895 0.030 . 1 . . . . 39 LEU HD2 . 11182 1 437 . 1 1 39 39 LEU HD23 H 1 0.895 0.030 . 1 . . . . 39 LEU HD2 . 11182 1 438 . 1 1 39 39 LEU HG H 1 1.782 0.030 . 1 . . . . 39 LEU HG . 11182 1 439 . 1 1 39 39 LEU C C 13 176.106 0.300 . 1 . . . . 39 LEU C . 11182 1 440 . 1 1 39 39 LEU CA C 13 56.971 0.300 . 1 . . . . 39 LEU CA . 11182 1 441 . 1 1 39 39 LEU CB C 13 41.028 0.300 . 1 . . . . 39 LEU CB . 11182 1 442 . 1 1 39 39 LEU CD1 C 13 23.932 0.300 . 2 . . . . 39 LEU CD1 . 11182 1 443 . 1 1 39 39 LEU CD2 C 13 26.296 0.300 . 2 . . . . 39 LEU CD2 . 11182 1 444 . 1 1 39 39 LEU CG C 13 26.864 0.300 . 1 . . . . 39 LEU CG . 11182 1 445 . 1 1 40 40 GLY H H 1 8.109 0.030 . 1 . . . . 40 GLY H . 11182 1 446 . 1 1 40 40 GLY HA2 H 1 3.669 0.030 . 1 . . . . 40 GLY HA2 . 11182 1 447 . 1 1 40 40 GLY HA3 H 1 3.669 0.030 . 1 . . . . 40 GLY HA3 . 11182 1 448 . 1 1 40 40 GLY C C 13 174.626 0.300 . 1 . . . . 40 GLY C . 11182 1 449 . 1 1 40 40 GLY CA C 13 44.958 0.300 . 1 . . . . 40 GLY CA . 11182 1 450 . 1 1 40 40 GLY N N 15 102.714 0.300 . 1 . . . . 40 GLY N . 11182 1 451 . 1 1 41 41 LEU H H 1 7.681 0.030 . 1 . . . . 41 LEU H . 11182 1 452 . 1 1 41 41 LEU HA H 1 5.122 0.030 . 1 . . . . 41 LEU HA . 11182 1 453 . 1 1 41 41 LEU HB2 H 1 1.286 0.030 . 2 . . . . 41 LEU HB2 . 11182 1 454 . 1 1 41 41 LEU HB3 H 1 1.993 0.030 . 2 . . . . 41 LEU HB3 . 11182 1 455 . 1 1 41 41 LEU HD11 H 1 0.919 0.030 . 1 . . . . 41 LEU HD1 . 11182 1 456 . 1 1 41 41 LEU HD12 H 1 0.919 0.030 . 1 . . . . 41 LEU HD1 . 11182 1 457 . 1 1 41 41 LEU HD13 H 1 0.919 0.030 . 1 . . . . 41 LEU HD1 . 11182 1 458 . 1 1 41 41 LEU HD21 H 1 0.932 0.030 . 1 . . . . 41 LEU HD2 . 11182 1 459 . 1 1 41 41 LEU HD22 H 1 0.932 0.030 . 1 . . . . 41 LEU HD2 . 11182 1 460 . 1 1 41 41 LEU HD23 H 1 0.932 0.030 . 1 . . . . 41 LEU HD2 . 11182 1 461 . 1 1 41 41 LEU HG H 1 1.653 0.030 . 1 . . . . 41 LEU HG . 11182 1 462 . 1 1 41 41 LEU C C 13 176.181 0.300 . 1 . . . . 41 LEU C . 11182 1 463 . 1 1 41 41 LEU CA C 13 53.812 0.300 . 1 . . . . 41 LEU CA . 11182 1 464 . 1 1 41 41 LEU CB C 13 45.680 0.300 . 1 . . . . 41 LEU CB . 11182 1 465 . 1 1 41 41 LEU CD1 C 13 25.354 0.300 . 2 . . . . 41 LEU CD1 . 11182 1 466 . 1 1 41 41 LEU CD2 C 13 25.967 0.300 . 2 . . . . 41 LEU CD2 . 11182 1 467 . 1 1 41 41 LEU CG C 13 26.663 0.300 . 1 . . . . 41 LEU CG . 11182 1 468 . 1 1 41 41 LEU N N 15 118.836 0.300 . 1 . . . . 41 LEU N . 11182 1 469 . 1 1 42 42 LYS H H 1 8.093 0.030 . 1 . . . . 42 LYS H . 11182 1 470 . 1 1 42 42 LYS HA H 1 4.635 0.030 . 1 . . . . 42 LYS HA . 11182 1 471 . 1 1 42 42 LYS HB2 H 1 1.678 0.030 . 2 . . . . 42 LYS HB2 . 11182 1 472 . 1 1 42 42 LYS HB3 H 1 1.798 0.030 . 2 . . . . 42 LYS HB3 . 11182 1 473 . 1 1 42 42 LYS HD2 H 1 1.636 0.030 . 1 . . . . 42 LYS HD2 . 11182 1 474 . 1 1 42 42 LYS HD3 H 1 1.636 0.030 . 1 . . . . 42 LYS HD3 . 11182 1 475 . 1 1 42 42 LYS HE2 H 1 2.931 0.030 . 1 . . . . 42 LYS HE2 . 11182 1 476 . 1 1 42 42 LYS HE3 H 1 2.931 0.030 . 1 . . . . 42 LYS HE3 . 11182 1 477 . 1 1 42 42 LYS HG2 H 1 1.287 0.030 . 2 . . . . 42 LYS HG2 . 11182 1 478 . 1 1 42 42 LYS HG3 H 1 1.383 0.030 . 2 . . . . 42 LYS HG3 . 11182 1 479 . 1 1 42 42 LYS C C 13 174.974 0.300 . 1 . . . . 42 LYS C . 11182 1 480 . 1 1 42 42 LYS CA C 13 56.098 0.300 . 1 . . . . 42 LYS CA . 11182 1 481 . 1 1 42 42 LYS CB C 13 34.819 0.300 . 1 . . . . 42 LYS CB . 11182 1 482 . 1 1 42 42 LYS CD C 13 29.002 0.300 . 1 . . . . 42 LYS CD . 11182 1 483 . 1 1 42 42 LYS CE C 13 42.251 0.300 . 1 . . . . 42 LYS CE . 11182 1 484 . 1 1 42 42 LYS CG C 13 25.133 0.300 . 1 . . . . 42 LYS CG . 11182 1 485 . 1 1 42 42 LYS N N 15 121.169 0.300 . 1 . . . . 42 LYS N . 11182 1 486 . 1 1 43 43 VAL H H 1 8.487 0.030 . 1 . . . . 43 VAL H . 11182 1 487 . 1 1 43 43 VAL HA H 1 4.904 0.030 . 1 . . . . 43 VAL HA . 11182 1 488 . 1 1 43 43 VAL HB H 1 1.551 0.030 . 1 . . . . 43 VAL HB . 11182 1 489 . 1 1 43 43 VAL HG11 H 1 0.532 0.030 . 1 . . . . 43 VAL HG1 . 11182 1 490 . 1 1 43 43 VAL HG12 H 1 0.532 0.030 . 1 . . . . 43 VAL HG1 . 11182 1 491 . 1 1 43 43 VAL HG13 H 1 0.532 0.030 . 1 . . . . 43 VAL HG1 . 11182 1 492 . 1 1 43 43 VAL HG21 H 1 0.780 0.030 . 1 . . . . 43 VAL HG2 . 11182 1 493 . 1 1 43 43 VAL HG22 H 1 0.780 0.030 . 1 . . . . 43 VAL HG2 . 11182 1 494 . 1 1 43 43 VAL HG23 H 1 0.780 0.030 . 1 . . . . 43 VAL HG2 . 11182 1 495 . 1 1 43 43 VAL C C 13 175.019 0.300 . 1 . . . . 43 VAL C . 11182 1 496 . 1 1 43 43 VAL CA C 13 60.341 0.300 . 1 . . . . 43 VAL CA . 11182 1 497 . 1 1 43 43 VAL CB C 13 35.054 0.300 . 1 . . . . 43 VAL CB . 11182 1 498 . 1 1 43 43 VAL CG1 C 13 21.188 0.300 . 2 . . . . 43 VAL CG1 . 11182 1 499 . 1 1 43 43 VAL CG2 C 13 21.851 0.300 . 2 . . . . 43 VAL CG2 . 11182 1 500 . 1 1 43 43 VAL N N 15 125.324 0.300 . 1 . . . . 43 VAL N . 11182 1 501 . 1 1 44 44 VAL H H 1 9.061 0.030 . 1 . . . . 44 VAL H . 11182 1 502 . 1 1 44 44 VAL HA H 1 4.481 0.030 . 1 . . . . 44 VAL HA . 11182 1 503 . 1 1 44 44 VAL HB H 1 2.008 0.030 . 1 . . . . 44 VAL HB . 11182 1 504 . 1 1 44 44 VAL HG11 H 1 1.052 0.030 . 1 . . . . 44 VAL HG1 . 11182 1 505 . 1 1 44 44 VAL HG12 H 1 1.052 0.030 . 1 . . . . 44 VAL HG1 . 11182 1 506 . 1 1 44 44 VAL HG13 H 1 1.052 0.030 . 1 . . . . 44 VAL HG1 . 11182 1 507 . 1 1 44 44 VAL HG21 H 1 1.038 0.030 . 1 . . . . 44 VAL HG2 . 11182 1 508 . 1 1 44 44 VAL HG22 H 1 1.038 0.030 . 1 . . . . 44 VAL HG2 . 11182 1 509 . 1 1 44 44 VAL HG23 H 1 1.038 0.030 . 1 . . . . 44 VAL HG2 . 11182 1 510 . 1 1 44 44 VAL C C 13 175.056 0.300 . 1 . . . . 44 VAL C . 11182 1 511 . 1 1 44 44 VAL CA C 13 61.071 0.300 . 1 . . . . 44 VAL CA . 11182 1 512 . 1 1 44 44 VAL CB C 13 34.245 0.300 . 1 . . . . 44 VAL CB . 11182 1 513 . 1 1 44 44 VAL CG1 C 13 21.070 0.300 . 2 . . . . 44 VAL CG1 . 11182 1 514 . 1 1 44 44 VAL CG2 C 13 21.677 0.300 . 2 . . . . 44 VAL CG2 . 11182 1 515 . 1 1 44 44 VAL N N 15 126.968 0.300 . 1 . . . . 44 VAL N . 11182 1 516 . 1 1 45 45 GLY H H 1 9.049 0.030 . 1 . . . . 45 GLY H . 11182 1 517 . 1 1 45 45 GLY HA2 H 1 3.406 0.030 . 2 . . . . 45 GLY HA2 . 11182 1 518 . 1 1 45 45 GLY HA3 H 1 4.930 0.030 . 2 . . . . 45 GLY HA3 . 11182 1 519 . 1 1 45 45 GLY C C 13 172.995 0.300 . 1 . . . . 45 GLY C . 11182 1 520 . 1 1 45 45 GLY CA C 13 43.348 0.300 . 1 . . . . 45 GLY CA . 11182 1 521 . 1 1 45 45 GLY N N 15 112.066 0.300 . 1 . . . . 45 GLY N . 11182 1 522 . 1 1 46 46 GLY H H 1 7.976 0.030 . 1 . . . . 46 GLY H . 11182 1 523 . 1 1 46 46 GLY HA2 H 1 3.876 0.030 . 2 . . . . 46 GLY HA2 . 11182 1 524 . 1 1 46 46 GLY HA3 H 1 4.024 0.030 . 2 . . . . 46 GLY HA3 . 11182 1 525 . 1 1 46 46 GLY C C 13 173.954 0.300 . 1 . . . . 46 GLY C . 11182 1 526 . 1 1 46 46 GLY CA C 13 47.742 0.300 . 1 . . . . 46 GLY CA . 11182 1 527 . 1 1 46 46 GLY N N 15 106.845 0.300 . 1 . . . . 46 GLY N . 11182 1 528 . 1 1 47 47 LYS H H 1 9.161 0.030 . 1 . . . . 47 LYS H . 11182 1 529 . 1 1 47 47 LYS HA H 1 4.470 0.030 . 1 . . . . 47 LYS HA . 11182 1 530 . 1 1 47 47 LYS HB2 H 1 1.822 0.030 . 2 . . . . 47 LYS HB2 . 11182 1 531 . 1 1 47 47 LYS HB3 H 1 1.948 0.030 . 2 . . . . 47 LYS HB3 . 11182 1 532 . 1 1 47 47 LYS HD2 H 1 1.423 0.030 . 2 . . . . 47 LYS HD2 . 11182 1 533 . 1 1 47 47 LYS HD3 H 1 1.580 0.030 . 2 . . . . 47 LYS HD3 . 11182 1 534 . 1 1 47 47 LYS HE2 H 1 2.769 0.030 . 2 . . . . 47 LYS HE2 . 11182 1 535 . 1 1 47 47 LYS HE3 H 1 2.793 0.030 . 2 . . . . 47 LYS HE3 . 11182 1 536 . 1 1 47 47 LYS HG2 H 1 1.286 0.030 . 2 . . . . 47 LYS HG2 . 11182 1 537 . 1 1 47 47 LYS HG3 H 1 1.434 0.030 . 2 . . . . 47 LYS HG3 . 11182 1 538 . 1 1 47 47 LYS C C 13 176.303 0.300 . 1 . . . . 47 LYS C . 11182 1 539 . 1 1 47 47 LYS CA C 13 54.994 0.300 . 1 . . . . 47 LYS CA . 11182 1 540 . 1 1 47 47 LYS CB C 13 33.336 0.300 . 1 . . . . 47 LYS CB . 11182 1 541 . 1 1 47 47 LYS CD C 13 28.844 0.300 . 1 . . . . 47 LYS CD . 11182 1 542 . 1 1 47 47 LYS CE C 13 41.793 0.300 . 1 . . . . 47 LYS CE . 11182 1 543 . 1 1 47 47 LYS CG C 13 24.677 0.300 . 1 . . . . 47 LYS CG . 11182 1 544 . 1 1 47 47 LYS N N 15 121.882 0.300 . 1 . . . . 47 LYS N . 11182 1 545 . 1 1 48 48 MET H H 1 8.810 0.030 . 1 . . . . 48 MET H . 11182 1 546 . 1 1 48 48 MET HA H 1 4.648 0.030 . 1 . . . . 48 MET HA . 11182 1 547 . 1 1 48 48 MET HB2 H 1 1.999 0.030 . 1 . . . . 48 MET HB2 . 11182 1 548 . 1 1 48 48 MET HB3 H 1 1.999 0.030 . 1 . . . . 48 MET HB3 . 11182 1 549 . 1 1 48 48 MET HE1 H 1 1.997 0.030 . 1 . . . . 48 MET HE . 11182 1 550 . 1 1 48 48 MET HE2 H 1 1.997 0.030 . 1 . . . . 48 MET HE . 11182 1 551 . 1 1 48 48 MET HE3 H 1 1.997 0.030 . 1 . . . . 48 MET HE . 11182 1 552 . 1 1 48 48 MET HG2 H 1 2.533 0.030 . 2 . . . . 48 MET HG2 . 11182 1 553 . 1 1 48 48 MET HG3 H 1 2.657 0.030 . 2 . . . . 48 MET HG3 . 11182 1 554 . 1 1 48 48 MET C C 13 176.536 0.300 . 1 . . . . 48 MET C . 11182 1 555 . 1 1 48 48 MET CA C 13 55.842 0.300 . 1 . . . . 48 MET CA . 11182 1 556 . 1 1 48 48 MET CB C 13 31.158 0.300 . 1 . . . . 48 MET CB . 11182 1 557 . 1 1 48 48 MET CE C 13 16.290 0.300 . 1 . . . . 48 MET CE . 11182 1 558 . 1 1 48 48 MET CG C 13 31.679 0.300 . 1 . . . . 48 MET CG . 11182 1 559 . 1 1 48 48 MET N N 15 125.560 0.300 . 1 . . . . 48 MET N . 11182 1 560 . 1 1 49 49 THR H H 1 8.442 0.030 . 1 . . . . 49 THR H . 11182 1 561 . 1 1 49 49 THR HA H 1 4.787 0.030 . 1 . . . . 49 THR HA . 11182 1 562 . 1 1 49 49 THR HB H 1 4.667 0.030 . 1 . . . . 49 THR HB . 11182 1 563 . 1 1 49 49 THR HG21 H 1 1.446 0.030 . 1 . . . . 49 THR HG2 . 11182 1 564 . 1 1 49 49 THR HG22 H 1 1.446 0.030 . 1 . . . . 49 THR HG2 . 11182 1 565 . 1 1 49 49 THR HG23 H 1 1.446 0.030 . 1 . . . . 49 THR HG2 . 11182 1 566 . 1 1 49 49 THR C C 13 176.045 0.300 . 1 . . . . 49 THR C . 11182 1 567 . 1 1 49 49 THR CA C 13 60.355 0.300 . 1 . . . . 49 THR CA . 11182 1 568 . 1 1 49 49 THR CB C 13 72.285 0.300 . 1 . . . . 49 THR CB . 11182 1 569 . 1 1 49 49 THR CG2 C 13 20.955 0.300 . 1 . . . . 49 THR CG2 . 11182 1 570 . 1 1 49 49 THR N N 15 118.061 0.300 . 1 . . . . 49 THR N . 11182 1 571 . 1 1 50 50 ASP H H 1 9.028 0.030 . 1 . . . . 50 ASP H . 11182 1 572 . 1 1 50 50 ASP HA H 1 4.427 0.030 . 1 . . . . 50 ASP HA . 11182 1 573 . 1 1 50 50 ASP HB2 H 1 2.746 0.030 . 1 . . . . 50 ASP HB2 . 11182 1 574 . 1 1 50 50 ASP HB3 H 1 2.746 0.030 . 1 . . . . 50 ASP HB3 . 11182 1 575 . 1 1 50 50 ASP C C 13 176.680 0.300 . 1 . . . . 50 ASP C . 11182 1 576 . 1 1 50 50 ASP CA C 13 56.008 0.300 . 1 . . . . 50 ASP CA . 11182 1 577 . 1 1 50 50 ASP CB C 13 39.965 0.300 . 1 . . . . 50 ASP CB . 11182 1 578 . 1 1 50 50 ASP N N 15 120.906 0.300 . 1 . . . . 50 ASP N . 11182 1 579 . 1 1 51 51 LEU H H 1 7.790 0.030 . 1 . . . . 51 LEU H . 11182 1 580 . 1 1 51 51 LEU HA H 1 4.392 0.030 . 1 . . . . 51 LEU HA . 11182 1 581 . 1 1 51 51 LEU HB2 H 1 1.624 0.030 . 2 . . . . 51 LEU HB2 . 11182 1 582 . 1 1 51 51 LEU HB3 H 1 1.683 0.030 . 2 . . . . 51 LEU HB3 . 11182 1 583 . 1 1 51 51 LEU HD11 H 1 0.934 0.030 . 1 . . . . 51 LEU HD1 . 11182 1 584 . 1 1 51 51 LEU HD12 H 1 0.934 0.030 . 1 . . . . 51 LEU HD1 . 11182 1 585 . 1 1 51 51 LEU HD13 H 1 0.934 0.030 . 1 . . . . 51 LEU HD1 . 11182 1 586 . 1 1 51 51 LEU HD21 H 1 0.862 0.030 . 1 . . . . 51 LEU HD2 . 11182 1 587 . 1 1 51 51 LEU HD22 H 1 0.862 0.030 . 1 . . . . 51 LEU HD2 . 11182 1 588 . 1 1 51 51 LEU HD23 H 1 0.862 0.030 . 1 . . . . 51 LEU HD2 . 11182 1 589 . 1 1 51 51 LEU HG H 1 1.690 0.030 . 1 . . . . 51 LEU HG . 11182 1 590 . 1 1 51 51 LEU C C 13 178.130 0.300 . 1 . . . . 51 LEU C . 11182 1 591 . 1 1 51 51 LEU CA C 13 54.889 0.300 . 1 . . . . 51 LEU CA . 11182 1 592 . 1 1 51 51 LEU CB C 13 41.933 0.300 . 1 . . . . 51 LEU CB . 11182 1 593 . 1 1 51 51 LEU CD1 C 13 25.256 0.300 . 2 . . . . 51 LEU CD1 . 11182 1 594 . 1 1 51 51 LEU CD2 C 13 22.769 0.300 . 2 . . . . 51 LEU CD2 . 11182 1 595 . 1 1 51 51 LEU CG C 13 26.997 0.300 . 1 . . . . 51 LEU CG . 11182 1 596 . 1 1 51 51 LEU N N 15 117.808 0.300 . 1 . . . . 51 LEU N . 11182 1 597 . 1 1 52 52 GLY H H 1 8.122 0.030 . 1 . . . . 52 GLY H . 11182 1 598 . 1 1 52 52 GLY HA2 H 1 3.819 0.030 . 2 . . . . 52 GLY HA2 . 11182 1 599 . 1 1 52 52 GLY HA3 H 1 4.138 0.030 . 2 . . . . 52 GLY HA3 . 11182 1 600 . 1 1 52 52 GLY C C 13 173.486 0.300 . 1 . . . . 52 GLY C . 11182 1 601 . 1 1 52 52 GLY CA C 13 46.116 0.300 . 1 . . . . 52 GLY CA . 11182 1 602 . 1 1 52 52 GLY N N 15 107.396 0.300 . 1 . . . . 52 GLY N . 11182 1 603 . 1 1 53 53 ARG H H 1 6.975 0.030 . 1 . . . . 53 ARG H . 11182 1 604 . 1 1 53 53 ARG HA H 1 4.735 0.030 . 1 . . . . 53 ARG HA . 11182 1 605 . 1 1 53 53 ARG HB2 H 1 1.693 0.030 . 2 . . . . 53 ARG HB2 . 11182 1 606 . 1 1 53 53 ARG HB3 H 1 1.883 0.030 . 2 . . . . 53 ARG HB3 . 11182 1 607 . 1 1 53 53 ARG HD2 H 1 3.062 0.030 . 2 . . . . 53 ARG HD2 . 11182 1 608 . 1 1 53 53 ARG HD3 H 1 3.126 0.030 . 2 . . . . 53 ARG HD3 . 11182 1 609 . 1 1 53 53 ARG HG2 H 1 1.464 0.030 . 2 . . . . 53 ARG HG2 . 11182 1 610 . 1 1 53 53 ARG HG3 H 1 1.537 0.030 . 2 . . . . 53 ARG HG3 . 11182 1 611 . 1 1 53 53 ARG C C 13 174.830 0.300 . 1 . . . . 53 ARG C . 11182 1 612 . 1 1 53 53 ARG CA C 13 53.441 0.300 . 1 . . . . 53 ARG CA . 11182 1 613 . 1 1 53 53 ARG CB C 13 32.429 0.300 . 1 . . . . 53 ARG CB . 11182 1 614 . 1 1 53 53 ARG CD C 13 43.585 0.300 . 1 . . . . 53 ARG CD . 11182 1 615 . 1 1 53 53 ARG CG C 13 26.265 0.300 . 1 . . . . 53 ARG CG . 11182 1 616 . 1 1 53 53 ARG N N 15 116.615 0.300 . 1 . . . . 53 ARG N . 11182 1 617 . 1 1 54 54 LEU H H 1 8.686 0.030 . 1 . . . . 54 LEU H . 11182 1 618 . 1 1 54 54 LEU HA H 1 4.779 0.030 . 1 . . . . 54 LEU HA . 11182 1 619 . 1 1 54 54 LEU HB2 H 1 1.205 0.030 . 2 . . . . 54 LEU HB2 . 11182 1 620 . 1 1 54 54 LEU HB3 H 1 1.471 0.030 . 2 . . . . 54 LEU HB3 . 11182 1 621 . 1 1 54 54 LEU HD11 H 1 0.773 0.030 . 1 . . . . 54 LEU HD1 . 11182 1 622 . 1 1 54 54 LEU HD12 H 1 0.773 0.030 . 1 . . . . 54 LEU HD1 . 11182 1 623 . 1 1 54 54 LEU HD13 H 1 0.773 0.030 . 1 . . . . 54 LEU HD1 . 11182 1 624 . 1 1 54 54 LEU HD21 H 1 0.714 0.030 . 1 . . . . 54 LEU HD2 . 11182 1 625 . 1 1 54 54 LEU HD22 H 1 0.714 0.030 . 1 . . . . 54 LEU HD2 . 11182 1 626 . 1 1 54 54 LEU HD23 H 1 0.714 0.030 . 1 . . . . 54 LEU HD2 . 11182 1 627 . 1 1 54 54 LEU HG H 1 1.720 0.030 . 1 . . . . 54 LEU HG . 11182 1 628 . 1 1 54 54 LEU C C 13 178.310 0.300 . 1 . . . . 54 LEU C . 11182 1 629 . 1 1 54 54 LEU CA C 13 54.671 0.300 . 1 . . . . 54 LEU CA . 11182 1 630 . 1 1 54 54 LEU CB C 13 42.864 0.300 . 1 . . . . 54 LEU CB . 11182 1 631 . 1 1 54 54 LEU CD1 C 13 24.877 0.300 . 2 . . . . 54 LEU CD1 . 11182 1 632 . 1 1 54 54 LEU CD2 C 13 21.853 0.300 . 2 . . . . 54 LEU CD2 . 11182 1 633 . 1 1 54 54 LEU CG C 13 26.728 0.300 . 1 . . . . 54 LEU CG . 11182 1 634 . 1 1 54 54 LEU N N 15 121.560 0.300 . 1 . . . . 54 LEU N . 11182 1 635 . 1 1 55 55 GLY H H 1 9.608 0.030 . 1 . . . . 55 GLY H . 11182 1 636 . 1 1 55 55 GLY HA2 H 1 3.353 0.030 . 2 . . . . 55 GLY HA2 . 11182 1 637 . 1 1 55 55 GLY HA3 H 1 4.595 0.030 . 2 . . . . 55 GLY HA3 . 11182 1 638 . 1 1 55 55 GLY C C 13 170.104 0.300 . 1 . . . . 55 GLY C . 11182 1 639 . 1 1 55 55 GLY CA C 13 44.534 0.300 . 1 . . . . 55 GLY CA . 11182 1 640 . 1 1 55 55 GLY N N 15 112.965 0.300 . 1 . . . . 55 GLY N . 11182 1 641 . 1 1 56 56 ALA H H 1 9.372 0.030 . 1 . . . . 56 ALA H . 11182 1 642 . 1 1 56 56 ALA HA H 1 5.600 0.030 . 1 . . . . 56 ALA HA . 11182 1 643 . 1 1 56 56 ALA HB1 H 1 1.253 0.030 . 1 . . . . 56 ALA HB . 11182 1 644 . 1 1 56 56 ALA HB2 H 1 1.253 0.030 . 1 . . . . 56 ALA HB . 11182 1 645 . 1 1 56 56 ALA HB3 H 1 1.253 0.030 . 1 . . . . 56 ALA HB . 11182 1 646 . 1 1 56 56 ALA C C 13 176.000 0.300 . 1 . . . . 56 ALA C . 11182 1 647 . 1 1 56 56 ALA CA C 13 49.135 0.300 . 1 . . . . 56 ALA CA . 11182 1 648 . 1 1 56 56 ALA CB C 13 22.341 0.300 . 1 . . . . 56 ALA CB . 11182 1 649 . 1 1 56 56 ALA N N 15 122.169 0.300 . 1 . . . . 56 ALA N . 11182 1 650 . 1 1 57 57 PHE H H 1 8.677 0.030 . 1 . . . . 57 PHE H . 11182 1 651 . 1 1 57 57 PHE HA H 1 5.319 0.030 . 1 . . . . 57 PHE HA . 11182 1 652 . 1 1 57 57 PHE HB2 H 1 2.544 0.030 . 2 . . . . 57 PHE HB2 . 11182 1 653 . 1 1 57 57 PHE HB3 H 1 2.860 0.030 . 2 . . . . 57 PHE HB3 . 11182 1 654 . 1 1 57 57 PHE HD1 H 1 7.083 0.030 . 1 . . . . 57 PHE HD1 . 11182 1 655 . 1 1 57 57 PHE HD2 H 1 7.083 0.030 . 1 . . . . 57 PHE HD2 . 11182 1 656 . 1 1 57 57 PHE HE1 H 1 7.221 0.030 . 1 . . . . 57 PHE HE1 . 11182 1 657 . 1 1 57 57 PHE HE2 H 1 7.221 0.030 . 1 . . . . 57 PHE HE2 . 11182 1 658 . 1 1 57 57 PHE HZ H 1 7.220 0.030 . 1 . . . . 57 PHE HZ . 11182 1 659 . 1 1 57 57 PHE C C 13 175.548 0.300 . 1 . . . . 57 PHE C . 11182 1 660 . 1 1 57 57 PHE CA C 13 56.234 0.300 . 1 . . . . 57 PHE CA . 11182 1 661 . 1 1 57 57 PHE CB C 13 43.852 0.300 . 1 . . . . 57 PHE CB . 11182 1 662 . 1 1 57 57 PHE CD1 C 13 131.919 0.300 . 1 . . . . 57 PHE CD1 . 11182 1 663 . 1 1 57 57 PHE CD2 C 13 131.919 0.300 . 1 . . . . 57 PHE CD2 . 11182 1 664 . 1 1 57 57 PHE CE1 C 13 130.746 0.300 . 1 . . . . 57 PHE CE1 . 11182 1 665 . 1 1 57 57 PHE CE2 C 13 130.746 0.300 . 1 . . . . 57 PHE CE2 . 11182 1 666 . 1 1 57 57 PHE CZ C 13 129.487 0.300 . 1 . . . . 57 PHE CZ . 11182 1 667 . 1 1 57 57 PHE N N 15 117.243 0.300 . 1 . . . . 57 PHE N . 11182 1 668 . 1 1 58 58 ILE H H 1 9.060 0.030 . 1 . . . . 58 ILE H . 11182 1 669 . 1 1 58 58 ILE HA H 1 4.580 0.030 . 1 . . . . 58 ILE HA . 11182 1 670 . 1 1 58 58 ILE HB H 1 2.156 0.030 . 1 . . . . 58 ILE HB . 11182 1 671 . 1 1 58 58 ILE HD11 H 1 0.997 0.030 . 1 . . . . 58 ILE HD1 . 11182 1 672 . 1 1 58 58 ILE HD12 H 1 0.997 0.030 . 1 . . . . 58 ILE HD1 . 11182 1 673 . 1 1 58 58 ILE HD13 H 1 0.997 0.030 . 1 . . . . 58 ILE HD1 . 11182 1 674 . 1 1 58 58 ILE HG12 H 1 0.914 0.030 . 2 . . . . 58 ILE HG12 . 11182 1 675 . 1 1 58 58 ILE HG13 H 1 1.899 0.030 . 2 . . . . 58 ILE HG13 . 11182 1 676 . 1 1 58 58 ILE HG21 H 1 0.785 0.030 . 1 . . . . 58 ILE HG2 . 11182 1 677 . 1 1 58 58 ILE HG22 H 1 0.785 0.030 . 1 . . . . 58 ILE HG2 . 11182 1 678 . 1 1 58 58 ILE HG23 H 1 0.785 0.030 . 1 . . . . 58 ILE HG2 . 11182 1 679 . 1 1 58 58 ILE C C 13 177.835 0.300 . 1 . . . . 58 ILE C . 11182 1 680 . 1 1 58 58 ILE CA C 13 61.932 0.300 . 1 . . . . 58 ILE CA . 11182 1 681 . 1 1 58 58 ILE CB C 13 38.057 0.300 . 1 . . . . 58 ILE CB . 11182 1 682 . 1 1 58 58 ILE CD1 C 13 15.329 0.300 . 1 . . . . 58 ILE CD1 . 11182 1 683 . 1 1 58 58 ILE CG1 C 13 28.806 0.300 . 1 . . . . 58 ILE CG1 . 11182 1 684 . 1 1 58 58 ILE CG2 C 13 19.516 0.300 . 1 . . . . 58 ILE CG2 . 11182 1 685 . 1 1 58 58 ILE N N 15 121.698 0.300 . 1 . . . . 58 ILE N . 11182 1 686 . 1 1 59 59 THR H H 1 9.309 0.030 . 1 . . . . 59 THR H . 11182 1 687 . 1 1 59 59 THR HA H 1 4.653 0.030 . 1 . . . . 59 THR HA . 11182 1 688 . 1 1 59 59 THR HB H 1 4.281 0.030 . 1 . . . . 59 THR HB . 11182 1 689 . 1 1 59 59 THR HG21 H 1 1.169 0.030 . 1 . . . . 59 THR HG2 . 11182 1 690 . 1 1 59 59 THR HG22 H 1 1.169 0.030 . 1 . . . . 59 THR HG2 . 11182 1 691 . 1 1 59 59 THR HG23 H 1 1.169 0.030 . 1 . . . . 59 THR HG2 . 11182 1 692 . 1 1 59 59 THR C C 13 175.117 0.300 . 1 . . . . 59 THR C . 11182 1 693 . 1 1 59 59 THR CA C 13 61.889 0.300 . 1 . . . . 59 THR CA . 11182 1 694 . 1 1 59 59 THR CB C 13 68.805 0.300 . 1 . . . . 59 THR CB . 11182 1 695 . 1 1 59 59 THR CG2 C 13 22.890 0.300 . 1 . . . . 59 THR CG2 . 11182 1 696 . 1 1 59 59 THR N N 15 121.116 0.300 . 1 . . . . 59 THR N . 11182 1 697 . 1 1 60 60 LYS H H 1 7.425 0.030 . 1 . . . . 60 LYS H . 11182 1 698 . 1 1 60 60 LYS HA H 1 4.472 0.030 . 1 . . . . 60 LYS HA . 11182 1 699 . 1 1 60 60 LYS HB2 H 1 1.633 0.030 . 2 . . . . 60 LYS HB2 . 11182 1 700 . 1 1 60 60 LYS HB3 H 1 1.799 0.030 . 2 . . . . 60 LYS HB3 . 11182 1 701 . 1 1 60 60 LYS HD2 H 1 1.668 0.030 . 1 . . . . 60 LYS HD2 . 11182 1 702 . 1 1 60 60 LYS HD3 H 1 1.668 0.030 . 1 . . . . 60 LYS HD3 . 11182 1 703 . 1 1 60 60 LYS HE2 H 1 2.948 0.030 . 1 . . . . 60 LYS HE2 . 11182 1 704 . 1 1 60 60 LYS HE3 H 1 2.948 0.030 . 1 . . . . 60 LYS HE3 . 11182 1 705 . 1 1 60 60 LYS HG2 H 1 1.315 0.030 . 2 . . . . 60 LYS HG2 . 11182 1 706 . 1 1 60 60 LYS HG3 H 1 1.378 0.030 . 2 . . . . 60 LYS HG3 . 11182 1 707 . 1 1 60 60 LYS C C 13 173.524 0.300 . 1 . . . . 60 LYS C . 11182 1 708 . 1 1 60 60 LYS CA C 13 56.399 0.300 . 1 . . . . 60 LYS CA . 11182 1 709 . 1 1 60 60 LYS CB C 13 36.491 0.300 . 1 . . . . 60 LYS CB . 11182 1 710 . 1 1 60 60 LYS CD C 13 29.068 0.300 . 1 . . . . 60 LYS CD . 11182 1 711 . 1 1 60 60 LYS CE C 13 42.168 0.300 . 1 . . . . 60 LYS CE . 11182 1 712 . 1 1 60 60 LYS CG C 13 25.014 0.300 . 1 . . . . 60 LYS CG . 11182 1 713 . 1 1 60 60 LYS N N 15 121.875 0.300 . 1 . . . . 60 LYS N . 11182 1 714 . 1 1 61 61 VAL H H 1 8.554 0.030 . 1 . . . . 61 VAL H . 11182 1 715 . 1 1 61 61 VAL HA H 1 4.423 0.030 . 1 . . . . 61 VAL HA . 11182 1 716 . 1 1 61 61 VAL HB H 1 1.827 0.030 . 1 . . . . 61 VAL HB . 11182 1 717 . 1 1 61 61 VAL HG11 H 1 0.599 0.030 . 1 . . . . 61 VAL HG1 . 11182 1 718 . 1 1 61 61 VAL HG12 H 1 0.599 0.030 . 1 . . . . 61 VAL HG1 . 11182 1 719 . 1 1 61 61 VAL HG13 H 1 0.599 0.030 . 1 . . . . 61 VAL HG1 . 11182 1 720 . 1 1 61 61 VAL HG21 H 1 0.627 0.030 . 1 . . . . 61 VAL HG2 . 11182 1 721 . 1 1 61 61 VAL HG22 H 1 0.627 0.030 . 1 . . . . 61 VAL HG2 . 11182 1 722 . 1 1 61 61 VAL HG23 H 1 0.627 0.030 . 1 . . . . 61 VAL HG2 . 11182 1 723 . 1 1 61 61 VAL C C 13 175.510 0.300 . 1 . . . . 61 VAL C . 11182 1 724 . 1 1 61 61 VAL CA C 13 61.091 0.300 . 1 . . . . 61 VAL CA . 11182 1 725 . 1 1 61 61 VAL CB C 13 34.246 0.300 . 1 . . . . 61 VAL CB . 11182 1 726 . 1 1 61 61 VAL CG1 C 13 21.286 0.300 . 2 . . . . 61 VAL CG1 . 11182 1 727 . 1 1 61 61 VAL CG2 C 13 20.710 0.300 . 2 . . . . 61 VAL CG2 . 11182 1 728 . 1 1 61 61 VAL N N 15 123.625 0.300 . 1 . . . . 61 VAL N . 11182 1 729 . 1 1 62 62 LYS H H 1 9.100 0.030 . 1 . . . . 62 LYS H . 11182 1 730 . 1 1 62 62 LYS HA H 1 4.273 0.030 . 1 . . . . 62 LYS HA . 11182 1 731 . 1 1 62 62 LYS HB2 H 1 1.742 0.030 . 2 . . . . 62 LYS HB2 . 11182 1 732 . 1 1 62 62 LYS HB3 H 1 1.854 0.030 . 2 . . . . 62 LYS HB3 . 11182 1 733 . 1 1 62 62 LYS HD2 H 1 1.689 0.030 . 2 . . . . 62 LYS HD2 . 11182 1 734 . 1 1 62 62 LYS HD3 H 1 1.756 0.030 . 2 . . . . 62 LYS HD3 . 11182 1 735 . 1 1 62 62 LYS HE2 H 1 3.027 0.030 . 1 . . . . 62 LYS HE2 . 11182 1 736 . 1 1 62 62 LYS HE3 H 1 3.027 0.030 . 1 . . . . 62 LYS HE3 . 11182 1 737 . 1 1 62 62 LYS HG2 H 1 1.410 0.030 . 2 . . . . 62 LYS HG2 . 11182 1 738 . 1 1 62 62 LYS HG3 H 1 1.476 0.030 . 2 . . . . 62 LYS HG3 . 11182 1 739 . 1 1 62 62 LYS C C 13 177.359 0.300 . 1 . . . . 62 LYS C . 11182 1 740 . 1 1 62 62 LYS CA C 13 56.271 0.300 . 1 . . . . 62 LYS CA . 11182 1 741 . 1 1 62 62 LYS CB C 13 32.836 0.300 . 1 . . . . 62 LYS CB . 11182 1 742 . 1 1 62 62 LYS CD C 13 29.332 0.300 . 1 . . . . 62 LYS CD . 11182 1 743 . 1 1 62 62 LYS CE C 13 42.207 0.300 . 1 . . . . 62 LYS CE . 11182 1 744 . 1 1 62 62 LYS CG C 13 24.597 0.300 . 1 . . . . 62 LYS CG . 11182 1 745 . 1 1 62 62 LYS N N 15 129.084 0.300 . 1 . . . . 62 LYS N . 11182 1 746 . 1 1 63 63 LYS H H 1 9.247 0.030 . 1 . . . . 63 LYS H . 11182 1 747 . 1 1 63 63 LYS HA H 1 4.196 0.030 . 1 . . . . 63 LYS HA . 11182 1 748 . 1 1 63 63 LYS HB2 H 1 1.791 0.030 . 2 . . . . 63 LYS HB2 . 11182 1 749 . 1 1 63 63 LYS HB3 H 1 1.873 0.030 . 2 . . . . 63 LYS HB3 . 11182 1 750 . 1 1 63 63 LYS HD2 H 1 1.733 0.030 . 1 . . . . 63 LYS HD2 . 11182 1 751 . 1 1 63 63 LYS HD3 H 1 1.733 0.030 . 1 . . . . 63 LYS HD3 . 11182 1 752 . 1 1 63 63 LYS HE2 H 1 3.016 0.030 . 1 . . . . 63 LYS HE2 . 11182 1 753 . 1 1 63 63 LYS HE3 H 1 3.016 0.030 . 1 . . . . 63 LYS HE3 . 11182 1 754 . 1 1 63 63 LYS HG2 H 1 1.444 0.030 . 2 . . . . 63 LYS HG2 . 11182 1 755 . 1 1 63 63 LYS HG3 H 1 1.538 0.030 . 2 . . . . 63 LYS HG3 . 11182 1 756 . 1 1 63 63 LYS C C 13 178.507 0.300 . 1 . . . . 63 LYS C . 11182 1 757 . 1 1 63 63 LYS CA C 13 57.684 0.300 . 1 . . . . 63 LYS CA . 11182 1 758 . 1 1 63 63 LYS CB C 13 31.644 0.300 . 1 . . . . 63 LYS CB . 11182 1 759 . 1 1 63 63 LYS CD C 13 28.831 0.300 . 1 . . . . 63 LYS CD . 11182 1 760 . 1 1 63 63 LYS CE C 13 42.128 0.300 . 1 . . . . 63 LYS CE . 11182 1 761 . 1 1 63 63 LYS CG C 13 24.509 0.300 . 1 . . . . 63 LYS CG . 11182 1 762 . 1 1 63 63 LYS N N 15 134.173 0.300 . 1 . . . . 63 LYS N . 11182 1 763 . 1 1 64 64 GLY H H 1 10.935 0.030 . 1 . . . . 64 GLY H . 11182 1 764 . 1 1 64 64 GLY HA2 H 1 3.623 0.030 . 2 . . . . 64 GLY HA2 . 11182 1 765 . 1 1 64 64 GLY HA3 H 1 4.342 0.030 . 2 . . . . 64 GLY HA3 . 11182 1 766 . 1 1 64 64 GLY C C 13 173.962 0.300 . 1 . . . . 64 GLY C . 11182 1 767 . 1 1 64 64 GLY CA C 13 45.439 0.300 . 1 . . . . 64 GLY CA . 11182 1 768 . 1 1 64 64 GLY N N 15 117.138 0.300 . 1 . . . . 64 GLY N . 11182 1 769 . 1 1 65 65 SER H H 1 7.859 0.030 . 1 . . . . 65 SER H . 11182 1 770 . 1 1 65 65 SER HA H 1 4.525 0.030 . 1 . . . . 65 SER HA . 11182 1 771 . 1 1 65 65 SER HB2 H 1 3.814 0.030 . 2 . . . . 65 SER HB2 . 11182 1 772 . 1 1 65 65 SER HB3 H 1 4.371 0.030 . 2 . . . . 65 SER HB3 . 11182 1 773 . 1 1 65 65 SER C C 13 174.966 0.300 . 1 . . . . 65 SER C . 11182 1 774 . 1 1 65 65 SER CA C 13 58.126 0.300 . 1 . . . . 65 SER CA . 11182 1 775 . 1 1 65 65 SER CB C 13 65.903 0.300 . 1 . . . . 65 SER CB . 11182 1 776 . 1 1 65 65 SER N N 15 115.270 0.300 . 1 . . . . 65 SER N . 11182 1 777 . 1 1 66 66 LEU H H 1 9.113 0.030 . 1 . . . . 66 LEU H . 11182 1 778 . 1 1 66 66 LEU HA H 1 4.063 0.030 . 1 . . . . 66 LEU HA . 11182 1 779 . 1 1 66 66 LEU HB2 H 1 1.482 0.030 . 2 . . . . 66 LEU HB2 . 11182 1 780 . 1 1 66 66 LEU HB3 H 1 1.855 0.030 . 2 . . . . 66 LEU HB3 . 11182 1 781 . 1 1 66 66 LEU HD11 H 1 0.917 0.030 . 1 . . . . 66 LEU HD1 . 11182 1 782 . 1 1 66 66 LEU HD12 H 1 0.917 0.030 . 1 . . . . 66 LEU HD1 . 11182 1 783 . 1 1 66 66 LEU HD13 H 1 0.917 0.030 . 1 . . . . 66 LEU HD1 . 11182 1 784 . 1 1 66 66 LEU HD21 H 1 0.933 0.030 . 1 . . . . 66 LEU HD2 . 11182 1 785 . 1 1 66 66 LEU HD22 H 1 0.933 0.030 . 1 . . . . 66 LEU HD2 . 11182 1 786 . 1 1 66 66 LEU HD23 H 1 0.933 0.030 . 1 . . . . 66 LEU HD2 . 11182 1 787 . 1 1 66 66 LEU HG H 1 1.798 0.030 . 1 . . . . 66 LEU HG . 11182 1 788 . 1 1 66 66 LEU C C 13 179.337 0.300 . 1 . . . . 66 LEU C . 11182 1 789 . 1 1 66 66 LEU CA C 13 58.740 0.300 . 1 . . . . 66 LEU CA . 11182 1 790 . 1 1 66 66 LEU CB C 13 42.983 0.300 . 1 . . . . 66 LEU CB . 11182 1 791 . 1 1 66 66 LEU CD1 C 13 23.932 0.300 . 2 . . . . 66 LEU CD1 . 11182 1 792 . 1 1 66 66 LEU CD2 C 13 25.529 0.300 . 2 . . . . 66 LEU CD2 . 11182 1 793 . 1 1 66 66 LEU CG C 13 27.221 0.300 . 1 . . . . 66 LEU CG . 11182 1 794 . 1 1 66 66 LEU N N 15 121.744 0.300 . 1 . . . . 66 LEU N . 11182 1 795 . 1 1 67 67 ALA H H 1 8.385 0.030 . 1 . . . . 67 ALA H . 11182 1 796 . 1 1 67 67 ALA HA H 1 3.675 0.030 . 1 . . . . 67 ALA HA . 11182 1 797 . 1 1 67 67 ALA HB1 H 1 1.366 0.030 . 1 . . . . 67 ALA HB . 11182 1 798 . 1 1 67 67 ALA HB2 H 1 1.366 0.030 . 1 . . . . 67 ALA HB . 11182 1 799 . 1 1 67 67 ALA HB3 H 1 1.366 0.030 . 1 . . . . 67 ALA HB . 11182 1 800 . 1 1 67 67 ALA C C 13 176.317 0.300 . 1 . . . . 67 ALA C . 11182 1 801 . 1 1 67 67 ALA CA C 13 55.629 0.300 . 1 . . . . 67 ALA CA . 11182 1 802 . 1 1 67 67 ALA CB C 13 19.457 0.300 . 1 . . . . 67 ALA CB . 11182 1 803 . 1 1 67 67 ALA N N 15 118.308 0.300 . 1 . . . . 67 ALA N . 11182 1 804 . 1 1 68 68 ASP H H 1 7.123 0.030 . 1 . . . . 68 ASP H . 11182 1 805 . 1 1 68 68 ASP HA H 1 4.439 0.030 . 1 . . . . 68 ASP HA . 11182 1 806 . 1 1 68 68 ASP HB2 H 1 2.757 0.030 . 2 . . . . 68 ASP HB2 . 11182 1 807 . 1 1 68 68 ASP HB3 H 1 3.003 0.030 . 2 . . . . 68 ASP HB3 . 11182 1 808 . 1 1 68 68 ASP C C 13 176.913 0.300 . 1 . . . . 68 ASP C . 11182 1 809 . 1 1 68 68 ASP CA C 13 56.402 0.300 . 1 . . . . 68 ASP CA . 11182 1 810 . 1 1 68 68 ASP CB C 13 43.668 0.300 . 1 . . . . 68 ASP CB . 11182 1 811 . 1 1 68 68 ASP N N 15 114.127 0.300 . 1 . . . . 68 ASP N . 11182 1 812 . 1 1 69 69 VAL H H 1 8.503 0.030 . 1 . . . . 69 VAL H . 11182 1 813 . 1 1 69 69 VAL HA H 1 3.686 0.030 . 1 . . . . 69 VAL HA . 11182 1 814 . 1 1 69 69 VAL HB H 1 2.116 0.030 . 1 . . . . 69 VAL HB . 11182 1 815 . 1 1 69 69 VAL HG11 H 1 0.968 0.030 . 1 . . . . 69 VAL HG1 . 11182 1 816 . 1 1 69 69 VAL HG12 H 1 0.968 0.030 . 1 . . . . 69 VAL HG1 . 11182 1 817 . 1 1 69 69 VAL HG13 H 1 0.968 0.030 . 1 . . . . 69 VAL HG1 . 11182 1 818 . 1 1 69 69 VAL HG21 H 1 0.978 0.030 . 1 . . . . 69 VAL HG2 . 11182 1 819 . 1 1 69 69 VAL HG22 H 1 0.978 0.030 . 1 . . . . 69 VAL HG2 . 11182 1 820 . 1 1 69 69 VAL HG23 H 1 0.978 0.030 . 1 . . . . 69 VAL HG2 . 11182 1 821 . 1 1 69 69 VAL C C 13 176.619 0.300 . 1 . . . . 69 VAL C . 11182 1 822 . 1 1 69 69 VAL CA C 13 65.136 0.300 . 1 . . . . 69 VAL CA . 11182 1 823 . 1 1 69 69 VAL CB C 13 32.329 0.300 . 1 . . . . 69 VAL CB . 11182 1 824 . 1 1 69 69 VAL CG1 C 13 20.921 0.300 . 2 . . . . 69 VAL CG1 . 11182 1 825 . 1 1 69 69 VAL CG2 C 13 21.818 0.300 . 2 . . . . 69 VAL CG2 . 11182 1 826 . 1 1 69 69 VAL N N 15 112.640 0.300 . 1 . . . . 69 VAL N . 11182 1 827 . 1 1 70 70 VAL H H 1 7.928 0.030 . 1 . . . . 70 VAL H . 11182 1 828 . 1 1 70 70 VAL HA H 1 4.062 0.030 . 1 . . . . 70 VAL HA . 11182 1 829 . 1 1 70 70 VAL HB H 1 2.081 0.030 . 1 . . . . 70 VAL HB . 11182 1 830 . 1 1 70 70 VAL HG11 H 1 1.005 0.030 . 1 . . . . 70 VAL HG1 . 11182 1 831 . 1 1 70 70 VAL HG12 H 1 1.005 0.030 . 1 . . . . 70 VAL HG1 . 11182 1 832 . 1 1 70 70 VAL HG13 H 1 1.005 0.030 . 1 . . . . 70 VAL HG1 . 11182 1 833 . 1 1 70 70 VAL HG21 H 1 0.833 0.030 . 1 . . . . 70 VAL HG2 . 11182 1 834 . 1 1 70 70 VAL HG22 H 1 0.833 0.030 . 1 . . . . 70 VAL HG2 . 11182 1 835 . 1 1 70 70 VAL HG23 H 1 0.833 0.030 . 1 . . . . 70 VAL HG2 . 11182 1 836 . 1 1 70 70 VAL C C 13 177.238 0.300 . 1 . . . . 70 VAL C . 11182 1 837 . 1 1 70 70 VAL CA C 13 63.786 0.300 . 1 . . . . 70 VAL CA . 11182 1 838 . 1 1 70 70 VAL CB C 13 31.999 0.300 . 1 . . . . 70 VAL CB . 11182 1 839 . 1 1 70 70 VAL CG1 C 13 22.342 0.300 . 2 . . . . 70 VAL CG1 . 11182 1 840 . 1 1 70 70 VAL CG2 C 13 21.554 0.300 . 2 . . . . 70 VAL CG2 . 11182 1 841 . 1 1 70 70 VAL N N 15 117.434 0.300 . 1 . . . . 70 VAL N . 11182 1 842 . 1 1 71 71 GLY H H 1 7.549 0.030 . 1 . . . . 71 GLY H . 11182 1 843 . 1 1 71 71 GLY HA2 H 1 3.295 0.030 . 2 . . . . 71 GLY HA2 . 11182 1 844 . 1 1 71 71 GLY HA3 H 1 3.737 0.030 . 2 . . . . 71 GLY HA3 . 11182 1 845 . 1 1 71 71 GLY C C 13 171.372 0.300 . 1 . . . . 71 GLY C . 11182 1 846 . 1 1 71 71 GLY CA C 13 47.142 0.300 . 1 . . . . 71 GLY CA . 11182 1 847 . 1 1 71 71 GLY N N 15 102.355 0.300 . 1 . . . . 71 GLY N . 11182 1 848 . 1 1 72 72 HIS H H 1 7.253 0.030 . 1 . . . . 72 HIS H . 11182 1 849 . 1 1 72 72 HIS HA H 1 4.792 0.030 . 1 . . . . 72 HIS HA . 11182 1 850 . 1 1 72 72 HIS HB2 H 1 3.375 0.030 . 2 . . . . 72 HIS HB2 . 11182 1 851 . 1 1 72 72 HIS HB3 H 1 3.589 0.030 . 2 . . . . 72 HIS HB3 . 11182 1 852 . 1 1 72 72 HIS HD2 H 1 7.068 0.030 . 1 . . . . 72 HIS HD2 . 11182 1 853 . 1 1 72 72 HIS HE1 H 1 8.289 0.030 . 1 . . . . 72 HIS HE1 . 11182 1 854 . 1 1 72 72 HIS C C 13 176.250 0.300 . 1 . . . . 72 HIS C . 11182 1 855 . 1 1 72 72 HIS CA C 13 55.614 0.300 . 1 . . . . 72 HIS CA . 11182 1 856 . 1 1 72 72 HIS CB C 13 27.288 0.300 . 1 . . . . 72 HIS CB . 11182 1 857 . 1 1 72 72 HIS CD2 C 13 119.595 0.300 . 1 . . . . 72 HIS CD2 . 11182 1 858 . 1 1 72 72 HIS CE1 C 13 136.658 0.300 . 1 . . . . 72 HIS CE1 . 11182 1 859 . 1 1 72 72 HIS N N 15 111.337 0.300 . 1 . . . . 72 HIS N . 11182 1 860 . 1 1 73 73 LEU H H 1 7.960 0.030 . 1 . . . . 73 LEU H . 11182 1 861 . 1 1 73 73 LEU HA H 1 4.236 0.030 . 1 . . . . 73 LEU HA . 11182 1 862 . 1 1 73 73 LEU HB2 H 1 1.389 0.030 . 2 . . . . 73 LEU HB2 . 11182 1 863 . 1 1 73 73 LEU HB3 H 1 1.539 0.030 . 2 . . . . 73 LEU HB3 . 11182 1 864 . 1 1 73 73 LEU HD11 H 1 0.870 0.030 . 1 . . . . 73 LEU HD1 . 11182 1 865 . 1 1 73 73 LEU HD12 H 1 0.870 0.030 . 1 . . . . 73 LEU HD1 . 11182 1 866 . 1 1 73 73 LEU HD13 H 1 0.870 0.030 . 1 . . . . 73 LEU HD1 . 11182 1 867 . 1 1 73 73 LEU HD21 H 1 0.969 0.030 . 1 . . . . 73 LEU HD2 . 11182 1 868 . 1 1 73 73 LEU HD22 H 1 0.969 0.030 . 1 . . . . 73 LEU HD2 . 11182 1 869 . 1 1 73 73 LEU HD23 H 1 0.969 0.030 . 1 . . . . 73 LEU HD2 . 11182 1 870 . 1 1 73 73 LEU HG H 1 1.683 0.030 . 1 . . . . 73 LEU HG . 11182 1 871 . 1 1 73 73 LEU C C 13 175.706 0.300 . 1 . . . . 73 LEU C . 11182 1 872 . 1 1 73 73 LEU CA C 13 54.718 0.300 . 1 . . . . 73 LEU CA . 11182 1 873 . 1 1 73 73 LEU CB C 13 42.507 0.300 . 1 . . . . 73 LEU CB . 11182 1 874 . 1 1 73 73 LEU CD1 C 13 25.743 0.300 . 2 . . . . 73 LEU CD1 . 11182 1 875 . 1 1 73 73 LEU CD2 C 13 23.600 0.300 . 2 . . . . 73 LEU CD2 . 11182 1 876 . 1 1 73 73 LEU CG C 13 27.064 0.300 . 1 . . . . 73 LEU CG . 11182 1 877 . 1 1 73 73 LEU N N 15 116.598 0.300 . 1 . . . . 73 LEU N . 11182 1 878 . 1 1 74 74 ARG H H 1 8.618 0.030 . 1 . . . . 74 ARG H . 11182 1 879 . 1 1 74 74 ARG HA H 1 4.587 0.030 . 1 . . . . 74 ARG HA . 11182 1 880 . 1 1 74 74 ARG HB2 H 1 1.689 0.030 . 2 . . . . 74 ARG HB2 . 11182 1 881 . 1 1 74 74 ARG HB3 H 1 1.801 0.030 . 2 . . . . 74 ARG HB3 . 11182 1 882 . 1 1 74 74 ARG HD2 H 1 2.986 0.030 . 2 . . . . 74 ARG HD2 . 11182 1 883 . 1 1 74 74 ARG HD3 H 1 3.092 0.030 . 2 . . . . 74 ARG HD3 . 11182 1 884 . 1 1 74 74 ARG HG2 H 1 1.549 0.030 . 2 . . . . 74 ARG HG2 . 11182 1 885 . 1 1 74 74 ARG HG3 H 1 1.696 0.030 . 2 . . . . 74 ARG HG3 . 11182 1 886 . 1 1 74 74 ARG C C 13 174.799 0.300 . 1 . . . . 74 ARG C . 11182 1 887 . 1 1 74 74 ARG CA C 13 54.665 0.300 . 1 . . . . 74 ARG CA . 11182 1 888 . 1 1 74 74 ARG CB C 13 35.277 0.300 . 1 . . . . 74 ARG CB . 11182 1 889 . 1 1 74 74 ARG CD C 13 44.221 0.300 . 1 . . . . 74 ARG CD . 11182 1 890 . 1 1 74 74 ARG CG C 13 26.806 0.300 . 1 . . . . 74 ARG CG . 11182 1 891 . 1 1 74 74 ARG N N 15 118.459 0.300 . 1 . . . . 74 ARG N . 11182 1 892 . 1 1 75 75 ALA H H 1 8.647 0.030 . 1 . . . . 75 ALA H . 11182 1 893 . 1 1 75 75 ALA HA H 1 3.806 0.030 . 1 . . . . 75 ALA HA . 11182 1 894 . 1 1 75 75 ALA HB1 H 1 1.254 0.030 . 1 . . . . 75 ALA HB . 11182 1 895 . 1 1 75 75 ALA HB2 H 1 1.254 0.030 . 1 . . . . 75 ALA HB . 11182 1 896 . 1 1 75 75 ALA HB3 H 1 1.254 0.030 . 1 . . . . 75 ALA HB . 11182 1 897 . 1 1 75 75 ALA C C 13 178.666 0.300 . 1 . . . . 75 ALA C . 11182 1 898 . 1 1 75 75 ALA CA C 13 53.213 0.300 . 1 . . . . 75 ALA CA . 11182 1 899 . 1 1 75 75 ALA CB C 13 17.508 0.300 . 1 . . . . 75 ALA CB . 11182 1 900 . 1 1 75 75 ALA N N 15 122.425 0.300 . 1 . . . . 75 ALA N . 11182 1 901 . 1 1 76 76 GLY H H 1 9.307 0.030 . 1 . . . . 76 GLY H . 11182 1 902 . 1 1 76 76 GLY HA2 H 1 3.716 0.030 . 2 . . . . 76 GLY HA2 . 11182 1 903 . 1 1 76 76 GLY HA3 H 1 4.600 0.030 . 2 . . . . 76 GLY HA3 . 11182 1 904 . 1 1 76 76 GLY C C 13 174.709 0.300 . 1 . . . . 76 GLY C . 11182 1 905 . 1 1 76 76 GLY CA C 13 44.704 0.300 . 1 . . . . 76 GLY CA . 11182 1 906 . 1 1 76 76 GLY N N 15 113.400 0.300 . 1 . . . . 76 GLY N . 11182 1 907 . 1 1 77 77 ASP H H 1 8.033 0.030 . 1 . . . . 77 ASP H . 11182 1 908 . 1 1 77 77 ASP HA H 1 4.831 0.030 . 1 . . . . 77 ASP HA . 11182 1 909 . 1 1 77 77 ASP HB2 H 1 2.493 0.030 . 2 . . . . 77 ASP HB2 . 11182 1 910 . 1 1 77 77 ASP HB3 H 1 2.936 0.030 . 2 . . . . 77 ASP HB3 . 11182 1 911 . 1 1 77 77 ASP C C 13 175.381 0.300 . 1 . . . . 77 ASP C . 11182 1 912 . 1 1 77 77 ASP CA C 13 56.307 0.300 . 1 . . . . 77 ASP CA . 11182 1 913 . 1 1 77 77 ASP CB C 13 40.895 0.300 . 1 . . . . 77 ASP CB . 11182 1 914 . 1 1 77 77 ASP N N 15 123.547 0.300 . 1 . . . . 77 ASP N . 11182 1 915 . 1 1 78 78 GLU H H 1 9.013 0.030 . 1 . . . . 78 GLU H . 11182 1 916 . 1 1 78 78 GLU HA H 1 4.405 0.030 . 1 . . . . 78 GLU HA . 11182 1 917 . 1 1 78 78 GLU HB2 H 1 1.860 0.030 . 2 . . . . 78 GLU HB2 . 11182 1 918 . 1 1 78 78 GLU HB3 H 1 1.985 0.030 . 2 . . . . 78 GLU HB3 . 11182 1 919 . 1 1 78 78 GLU HG2 H 1 1.648 0.030 . 1 . . . . 78 GLU HG2 . 11182 1 920 . 1 1 78 78 GLU HG3 H 1 1.648 0.030 . 1 . . . . 78 GLU HG3 . 11182 1 921 . 1 1 78 78 GLU C C 13 176.333 0.300 . 1 . . . . 78 GLU C . 11182 1 922 . 1 1 78 78 GLU CA C 13 54.785 0.300 . 1 . . . . 78 GLU CA . 11182 1 923 . 1 1 78 78 GLU CB C 13 30.550 0.300 . 1 . . . . 78 GLU CB . 11182 1 924 . 1 1 78 78 GLU CG C 13 35.836 0.300 . 1 . . . . 78 GLU CG . 11182 1 925 . 1 1 78 78 GLU N N 15 125.027 0.300 . 1 . . . . 78 GLU N . 11182 1 926 . 1 1 79 79 VAL H H 1 8.940 0.030 . 1 . . . . 79 VAL H . 11182 1 927 . 1 1 79 79 VAL HA H 1 4.310 0.030 . 1 . . . . 79 VAL HA . 11182 1 928 . 1 1 79 79 VAL HB H 1 1.892 0.030 . 1 . . . . 79 VAL HB . 11182 1 929 . 1 1 79 79 VAL HG11 H 1 0.883 0.030 . 1 . . . . 79 VAL HG1 . 11182 1 930 . 1 1 79 79 VAL HG12 H 1 0.883 0.030 . 1 . . . . 79 VAL HG1 . 11182 1 931 . 1 1 79 79 VAL HG13 H 1 0.883 0.030 . 1 . . . . 79 VAL HG1 . 11182 1 932 . 1 1 79 79 VAL HG21 H 1 1.044 0.030 . 1 . . . . 79 VAL HG2 . 11182 1 933 . 1 1 79 79 VAL HG22 H 1 1.044 0.030 . 1 . . . . 79 VAL HG2 . 11182 1 934 . 1 1 79 79 VAL HG23 H 1 1.044 0.030 . 1 . . . . 79 VAL HG2 . 11182 1 935 . 1 1 79 79 VAL C C 13 174.935 0.300 . 1 . . . . 79 VAL C . 11182 1 936 . 1 1 79 79 VAL CA C 13 61.996 0.300 . 1 . . . . 79 VAL CA . 11182 1 937 . 1 1 79 79 VAL CB C 13 31.151 0.300 . 1 . . . . 79 VAL CB . 11182 1 938 . 1 1 79 79 VAL CG1 C 13 21.604 0.300 . 2 . . . . 79 VAL CG1 . 11182 1 939 . 1 1 79 79 VAL CG2 C 13 24.077 0.300 . 2 . . . . 79 VAL CG2 . 11182 1 940 . 1 1 79 79 VAL N N 15 126.791 0.300 . 1 . . . . 79 VAL N . 11182 1 941 . 1 1 80 80 LEU H H 1 9.409 0.030 . 1 . . . . 80 LEU H . 11182 1 942 . 1 1 80 80 LEU HA H 1 4.357 0.030 . 1 . . . . 80 LEU HA . 11182 1 943 . 1 1 80 80 LEU HB2 H 1 1.515 0.030 . 1 . . . . 80 LEU HB2 . 11182 1 944 . 1 1 80 80 LEU HB3 H 1 1.515 0.030 . 1 . . . . 80 LEU HB3 . 11182 1 945 . 1 1 80 80 LEU HD11 H 1 0.728 0.030 . 1 . . . . 80 LEU HD1 . 11182 1 946 . 1 1 80 80 LEU HD12 H 1 0.728 0.030 . 1 . . . . 80 LEU HD1 . 11182 1 947 . 1 1 80 80 LEU HD13 H 1 0.728 0.030 . 1 . . . . 80 LEU HD1 . 11182 1 948 . 1 1 80 80 LEU HD21 H 1 0.874 0.030 . 1 . . . . 80 LEU HD2 . 11182 1 949 . 1 1 80 80 LEU HD22 H 1 0.874 0.030 . 1 . . . . 80 LEU HD2 . 11182 1 950 . 1 1 80 80 LEU HD23 H 1 0.874 0.030 . 1 . . . . 80 LEU HD2 . 11182 1 951 . 1 1 80 80 LEU HG H 1 1.492 0.030 . 1 . . . . 80 LEU HG . 11182 1 952 . 1 1 80 80 LEU C C 13 179.579 0.300 . 1 . . . . 80 LEU C . 11182 1 953 . 1 1 80 80 LEU CA C 13 55.859 0.300 . 1 . . . . 80 LEU CA . 11182 1 954 . 1 1 80 80 LEU CB C 13 42.305 0.300 . 1 . . . . 80 LEU CB . 11182 1 955 . 1 1 80 80 LEU CD1 C 13 21.696 0.300 . 2 . . . . 80 LEU CD1 . 11182 1 956 . 1 1 80 80 LEU CD2 C 13 25.571 0.300 . 2 . . . . 80 LEU CD2 . 11182 1 957 . 1 1 80 80 LEU CG C 13 26.976 0.300 . 1 . . . . 80 LEU CG . 11182 1 958 . 1 1 80 80 LEU N N 15 126.895 0.300 . 1 . . . . 80 LEU N . 11182 1 959 . 1 1 81 81 GLU H H 1 7.991 0.030 . 1 . . . . 81 GLU H . 11182 1 960 . 1 1 81 81 GLU HA H 1 5.062 0.030 . 1 . . . . 81 GLU HA . 11182 1 961 . 1 1 81 81 GLU HB2 H 1 1.727 0.030 . 1 . . . . 81 GLU HB2 . 11182 1 962 . 1 1 81 81 GLU HB3 H 1 1.727 0.030 . 1 . . . . 81 GLU HB3 . 11182 1 963 . 1 1 81 81 GLU HG2 H 1 1.814 0.030 . 2 . . . . 81 GLU HG2 . 11182 1 964 . 1 1 81 81 GLU HG3 H 1 1.877 0.030 . 2 . . . . 81 GLU HG3 . 11182 1 965 . 1 1 81 81 GLU C C 13 173.501 0.300 . 1 . . . . 81 GLU C . 11182 1 966 . 1 1 81 81 GLU CA C 13 55.767 0.300 . 1 . . . . 81 GLU CA . 11182 1 967 . 1 1 81 81 GLU CB C 13 35.599 0.300 . 1 . . . . 81 GLU CB . 11182 1 968 . 1 1 81 81 GLU CG C 13 36.822 0.300 . 1 . . . . 81 GLU CG . 11182 1 969 . 1 1 81 81 GLU N N 15 119.604 0.300 . 1 . . . . 81 GLU N . 11182 1 970 . 1 1 82 82 TRP H H 1 8.635 0.030 . 1 . . . . 82 TRP H . 11182 1 971 . 1 1 82 82 TRP HA H 1 4.700 0.030 . 1 . . . . 82 TRP HA . 11182 1 972 . 1 1 82 82 TRP HB2 H 1 2.717 0.030 . 2 . . . . 82 TRP HB2 . 11182 1 973 . 1 1 82 82 TRP HB3 H 1 3.281 0.030 . 2 . . . . 82 TRP HB3 . 11182 1 974 . 1 1 82 82 TRP HD1 H 1 6.867 0.030 . 1 . . . . 82 TRP HD1 . 11182 1 975 . 1 1 82 82 TRP HE1 H 1 10.077 0.030 . 1 . . . . 82 TRP HE1 . 11182 1 976 . 1 1 82 82 TRP HE3 H 1 7.300 0.030 . 1 . . . . 82 TRP HE3 . 11182 1 977 . 1 1 82 82 TRP HH2 H 1 6.952 0.030 . 1 . . . . 82 TRP HH2 . 11182 1 978 . 1 1 82 82 TRP HZ2 H 1 7.373 0.030 . 1 . . . . 82 TRP HZ2 . 11182 1 979 . 1 1 82 82 TRP HZ3 H 1 6.681 0.030 . 1 . . . . 82 TRP HZ3 . 11182 1 980 . 1 1 82 82 TRP C C 13 175.441 0.300 . 1 . . . . 82 TRP C . 11182 1 981 . 1 1 82 82 TRP CA C 13 56.233 0.300 . 1 . . . . 82 TRP CA . 11182 1 982 . 1 1 82 82 TRP CB C 13 31.046 0.300 . 1 . . . . 82 TRP CB . 11182 1 983 . 1 1 82 82 TRP CD1 C 13 125.174 0.300 . 1 . . . . 82 TRP CD1 . 11182 1 984 . 1 1 82 82 TRP CE3 C 13 119.366 0.300 . 1 . . . . 82 TRP CE3 . 11182 1 985 . 1 1 82 82 TRP CH2 C 13 123.696 0.300 . 1 . . . . 82 TRP CH2 . 11182 1 986 . 1 1 82 82 TRP CZ2 C 13 114.851 0.300 . 1 . . . . 82 TRP CZ2 . 11182 1 987 . 1 1 82 82 TRP CZ3 C 13 120.866 0.300 . 1 . . . . 82 TRP CZ3 . 11182 1 988 . 1 1 82 82 TRP N N 15 123.799 0.300 . 1 . . . . 82 TRP N . 11182 1 989 . 1 1 82 82 TRP NE1 N 15 127.863 0.300 . 1 . . . . 82 TRP NE1 . 11182 1 990 . 1 1 83 83 ASN H H 1 9.370 0.030 . 1 . . . . 83 ASN H . 11182 1 991 . 1 1 83 83 ASN HA H 1 4.570 0.030 . 1 . . . . 83 ASN HA . 11182 1 992 . 1 1 83 83 ASN HB2 H 1 2.404 0.030 . 2 . . . . 83 ASN HB2 . 11182 1 993 . 1 1 83 83 ASN HB3 H 1 3.594 0.030 . 2 . . . . 83 ASN HB3 . 11182 1 994 . 1 1 83 83 ASN HD21 H 1 6.928 0.030 . 2 . . . . 83 ASN HD21 . 11182 1 995 . 1 1 83 83 ASN HD22 H 1 8.240 0.030 . 2 . . . . 83 ASN HD22 . 11182 1 996 . 1 1 83 83 ASN C C 13 175.449 0.300 . 1 . . . . 83 ASN C . 11182 1 997 . 1 1 83 83 ASN CA C 13 53.835 0.300 . 1 . . . . 83 ASN CA . 11182 1 998 . 1 1 83 83 ASN CB C 13 38.245 0.300 . 1 . . . . 83 ASN CB . 11182 1 999 . 1 1 83 83 ASN N N 15 129.843 0.300 . 1 . . . . 83 ASN N . 11182 1 1000 . 1 1 83 83 ASN ND2 N 15 109.930 0.300 . 1 . . . . 83 ASN ND2 . 11182 1 1001 . 1 1 84 84 GLY H H 1 9.380 0.030 . 1 . . . . 84 GLY H . 11182 1 1002 . 1 1 84 84 GLY HA2 H 1 3.751 0.030 . 2 . . . . 84 GLY HA2 . 11182 1 1003 . 1 1 84 84 GLY HA3 H 1 4.079 0.030 . 2 . . . . 84 GLY HA3 . 11182 1 1004 . 1 1 84 84 GLY C C 13 174.332 0.300 . 1 . . . . 84 GLY C . 11182 1 1005 . 1 1 84 84 GLY CA C 13 45.140 0.300 . 1 . . . . 84 GLY CA . 11182 1 1006 . 1 1 84 84 GLY N N 15 104.395 0.300 . 1 . . . . 84 GLY N . 11182 1 1007 . 1 1 85 85 LYS H H 1 7.773 0.030 . 1 . . . . 85 LYS H . 11182 1 1008 . 1 1 85 85 LYS HA H 1 4.916 0.030 . 1 . . . . 85 LYS HA . 11182 1 1009 . 1 1 85 85 LYS HB2 H 1 1.783 0.030 . 2 . . . . 85 LYS HB2 . 11182 1 1010 . 1 1 85 85 LYS HB3 H 1 2.171 0.030 . 2 . . . . 85 LYS HB3 . 11182 1 1011 . 1 1 85 85 LYS HD2 H 1 1.714 0.030 . 2 . . . . 85 LYS HD2 . 11182 1 1012 . 1 1 85 85 LYS HD3 H 1 1.763 0.030 . 2 . . . . 85 LYS HD3 . 11182 1 1013 . 1 1 85 85 LYS HE2 H 1 3.063 0.030 . 1 . . . . 85 LYS HE2 . 11182 1 1014 . 1 1 85 85 LYS HE3 H 1 3.063 0.030 . 1 . . . . 85 LYS HE3 . 11182 1 1015 . 1 1 85 85 LYS HG2 H 1 1.492 0.030 . 2 . . . . 85 LYS HG2 . 11182 1 1016 . 1 1 85 85 LYS HG3 H 1 1.599 0.030 . 2 . . . . 85 LYS HG3 . 11182 1 1017 . 1 1 85 85 LYS C C 13 174.096 0.300 . 1 . . . . 85 LYS C . 11182 1 1018 . 1 1 85 85 LYS CA C 13 52.453 0.300 . 1 . . . . 85 LYS CA . 11182 1 1019 . 1 1 85 85 LYS CB C 13 32.462 0.300 . 1 . . . . 85 LYS CB . 11182 1 1020 . 1 1 85 85 LYS CD C 13 29.207 0.300 . 1 . . . . 85 LYS CD . 11182 1 1021 . 1 1 85 85 LYS CE C 13 42.451 0.300 . 1 . . . . 85 LYS CE . 11182 1 1022 . 1 1 85 85 LYS CG C 13 25.378 0.300 . 1 . . . . 85 LYS CG . 11182 1 1023 . 1 1 85 85 LYS N N 15 121.656 0.300 . 1 . . . . 85 LYS N . 11182 1 1024 . 1 1 86 86 PRO HA H 1 4.901 0.030 . 1 . . . . 86 PRO HA . 11182 1 1025 . 1 1 86 86 PRO HB2 H 1 2.118 0.030 . 2 . . . . 86 PRO HB2 . 11182 1 1026 . 1 1 86 86 PRO HB3 H 1 2.357 0.030 . 2 . . . . 86 PRO HB3 . 11182 1 1027 . 1 1 86 86 PRO HD2 H 1 3.817 0.030 . 2 . . . . 86 PRO HD2 . 11182 1 1028 . 1 1 86 86 PRO HD3 H 1 4.009 0.030 . 2 . . . . 86 PRO HD3 . 11182 1 1029 . 1 1 86 86 PRO HG2 H 1 2.049 0.030 . 2 . . . . 86 PRO HG2 . 11182 1 1030 . 1 1 86 86 PRO HG3 H 1 2.226 0.030 . 2 . . . . 86 PRO HG3 . 11182 1 1031 . 1 1 86 86 PRO C C 13 176.801 0.300 . 1 . . . . 86 PRO C . 11182 1 1032 . 1 1 86 86 PRO CA C 13 62.385 0.300 . 1 . . . . 86 PRO CA . 11182 1 1033 . 1 1 86 86 PRO CB C 13 32.266 0.300 . 1 . . . . 86 PRO CB . 11182 1 1034 . 1 1 86 86 PRO CD C 13 51.110 0.300 . 1 . . . . 86 PRO CD . 11182 1 1035 . 1 1 86 86 PRO CG C 13 27.360 0.300 . 1 . . . . 86 PRO CG . 11182 1 1036 . 1 1 87 87 LEU H H 1 7.770 0.030 . 1 . . . . 87 LEU H . 11182 1 1037 . 1 1 87 87 LEU HA H 1 4.633 0.030 . 1 . . . . 87 LEU HA . 11182 1 1038 . 1 1 87 87 LEU HB2 H 1 1.333 0.030 . 2 . . . . 87 LEU HB2 . 11182 1 1039 . 1 1 87 87 LEU HB3 H 1 2.127 0.030 . 2 . . . . 87 LEU HB3 . 11182 1 1040 . 1 1 87 87 LEU HD11 H 1 0.797 0.030 . 1 . . . . 87 LEU HD1 . 11182 1 1041 . 1 1 87 87 LEU HD12 H 1 0.797 0.030 . 1 . . . . 87 LEU HD1 . 11182 1 1042 . 1 1 87 87 LEU HD13 H 1 0.797 0.030 . 1 . . . . 87 LEU HD1 . 11182 1 1043 . 1 1 87 87 LEU HD21 H 1 0.743 0.030 . 1 . . . . 87 LEU HD2 . 11182 1 1044 . 1 1 87 87 LEU HD22 H 1 0.743 0.030 . 1 . . . . 87 LEU HD2 . 11182 1 1045 . 1 1 87 87 LEU HD23 H 1 0.743 0.030 . 1 . . . . 87 LEU HD2 . 11182 1 1046 . 1 1 87 87 LEU HG H 1 1.584 0.030 . 1 . . . . 87 LEU HG . 11182 1 1047 . 1 1 87 87 LEU C C 13 174.912 0.300 . 1 . . . . 87 LEU C . 11182 1 1048 . 1 1 87 87 LEU CA C 13 55.577 0.300 . 1 . . . . 87 LEU CA . 11182 1 1049 . 1 1 87 87 LEU CB C 13 40.573 0.300 . 1 . . . . 87 LEU CB . 11182 1 1050 . 1 1 87 87 LEU CD1 C 13 26.180 0.300 . 2 . . . . 87 LEU CD1 . 11182 1 1051 . 1 1 87 87 LEU CD2 C 13 23.122 0.300 . 2 . . . . 87 LEU CD2 . 11182 1 1052 . 1 1 87 87 LEU CG C 13 27.304 0.300 . 1 . . . . 87 LEU CG . 11182 1 1053 . 1 1 87 87 LEU N N 15 121.029 0.300 . 1 . . . . 87 LEU N . 11182 1 1054 . 1 1 88 88 PRO HA H 1 4.565 0.030 . 1 . . . . 88 PRO HA . 11182 1 1055 . 1 1 88 88 PRO HB2 H 1 1.773 0.030 . 2 . . . . 88 PRO HB2 . 11182 1 1056 . 1 1 88 88 PRO HB3 H 1 2.224 0.030 . 2 . . . . 88 PRO HB3 . 11182 1 1057 . 1 1 88 88 PRO HD2 H 1 3.736 0.030 . 2 . . . . 88 PRO HD2 . 11182 1 1058 . 1 1 88 88 PRO HD3 H 1 4.262 0.030 . 2 . . . . 88 PRO HD3 . 11182 1 1059 . 1 1 88 88 PRO HG2 H 1 2.163 0.030 . 2 . . . . 88 PRO HG2 . 11182 1 1060 . 1 1 88 88 PRO HG3 H 1 2.265 0.030 . 2 . . . . 88 PRO HG3 . 11182 1 1061 . 1 1 88 88 PRO C C 13 178.187 0.300 . 1 . . . . 88 PRO C . 11182 1 1062 . 1 1 88 88 PRO CA C 13 65.911 0.300 . 1 . . . . 88 PRO CA . 11182 1 1063 . 1 1 88 88 PRO CB C 13 30.699 0.300 . 1 . . . . 88 PRO CB . 11182 1 1064 . 1 1 88 88 PRO CD C 13 52.091 0.300 . 1 . . . . 88 PRO CD . 11182 1 1065 . 1 1 88 88 PRO CG C 13 28.315 0.300 . 1 . . . . 88 PRO CG . 11182 1 1066 . 1 1 89 89 GLY H H 1 8.869 0.030 . 1 . . . . 89 GLY H . 11182 1 1067 . 1 1 89 89 GLY HA2 H 1 3.788 0.030 . 2 . . . . 89 GLY HA2 . 11182 1 1068 . 1 1 89 89 GLY HA3 H 1 4.381 0.030 . 2 . . . . 89 GLY HA3 . 11182 1 1069 . 1 1 89 89 GLY C C 13 173.071 0.300 . 1 . . . . 89 GLY C . 11182 1 1070 . 1 1 89 89 GLY CA C 13 45.362 0.300 . 1 . . . . 89 GLY CA . 11182 1 1071 . 1 1 89 89 GLY N N 15 112.443 0.300 . 1 . . . . 89 GLY N . 11182 1 1072 . 1 1 90 90 ALA H H 1 7.791 0.030 . 1 . . . . 90 ALA H . 11182 1 1073 . 1 1 90 90 ALA HA H 1 4.606 0.030 . 1 . . . . 90 ALA HA . 11182 1 1074 . 1 1 90 90 ALA HB1 H 1 1.448 0.030 . 1 . . . . 90 ALA HB . 11182 1 1075 . 1 1 90 90 ALA HB2 H 1 1.448 0.030 . 1 . . . . 90 ALA HB . 11182 1 1076 . 1 1 90 90 ALA HB3 H 1 1.448 0.030 . 1 . . . . 90 ALA HB . 11182 1 1077 . 1 1 90 90 ALA C C 13 177.918 0.300 . 1 . . . . 90 ALA C . 11182 1 1078 . 1 1 90 90 ALA CA C 13 51.438 0.300 . 1 . . . . 90 ALA CA . 11182 1 1079 . 1 1 90 90 ALA CB C 13 19.667 0.300 . 1 . . . . 90 ALA CB . 11182 1 1080 . 1 1 90 90 ALA N N 15 123.959 0.300 . 1 . . . . 90 ALA N . 11182 1 1081 . 1 1 91 91 THR H H 1 8.713 0.030 . 1 . . . . 91 THR H . 11182 1 1082 . 1 1 91 91 THR HA H 1 4.226 0.030 . 1 . . . . 91 THR HA . 11182 1 1083 . 1 1 91 91 THR HB H 1 4.737 0.030 . 1 . . . . 91 THR HB . 11182 1 1084 . 1 1 91 91 THR HG21 H 1 1.340 0.030 . 1 . . . . 91 THR HG2 . 11182 1 1085 . 1 1 91 91 THR HG22 H 1 1.340 0.030 . 1 . . . . 91 THR HG2 . 11182 1 1086 . 1 1 91 91 THR HG23 H 1 1.340 0.030 . 1 . . . . 91 THR HG2 . 11182 1 1087 . 1 1 91 91 THR C C 13 175.222 0.300 . 1 . . . . 91 THR C . 11182 1 1088 . 1 1 91 91 THR CA C 13 60.967 0.300 . 1 . . . . 91 THR CA . 11182 1 1089 . 1 1 91 91 THR CB C 13 71.207 0.300 . 1 . . . . 91 THR CB . 11182 1 1090 . 1 1 91 91 THR CG2 C 13 21.929 0.300 . 1 . . . . 91 THR CG2 . 11182 1 1091 . 1 1 91 91 THR N N 15 110.173 0.300 . 1 . . . . 91 THR N . 11182 1 1092 . 1 1 92 92 ASN H H 1 9.206 0.030 . 1 . . . . 92 ASN H . 11182 1 1093 . 1 1 92 92 ASN HA H 1 3.962 0.030 . 1 . . . . 92 ASN HA . 11182 1 1094 . 1 1 92 92 ASN HB2 H 1 2.724 0.030 . 2 . . . . 92 ASN HB2 . 11182 1 1095 . 1 1 92 92 ASN HB3 H 1 2.942 0.030 . 2 . . . . 92 ASN HB3 . 11182 1 1096 . 1 1 92 92 ASN HD21 H 1 6.927 0.030 . 2 . . . . 92 ASN HD21 . 11182 1 1097 . 1 1 92 92 ASN HD22 H 1 7.716 0.030 . 2 . . . . 92 ASN HD22 . 11182 1 1098 . 1 1 92 92 ASN C C 13 177.133 0.300 . 1 . . . . 92 ASN C . 11182 1 1099 . 1 1 92 92 ASN CA C 13 57.971 0.300 . 1 . . . . 92 ASN CA . 11182 1 1100 . 1 1 92 92 ASN CB C 13 38.930 0.300 . 1 . . . . 92 ASN CB . 11182 1 1101 . 1 1 92 92 ASN N N 15 117.923 0.300 . 1 . . . . 92 ASN N . 11182 1 1102 . 1 1 92 92 ASN ND2 N 15 114.086 0.300 . 1 . . . . 92 ASN ND2 . 11182 1 1103 . 1 1 93 93 GLU H H 1 8.668 0.030 . 1 . . . . 93 GLU H . 11182 1 1104 . 1 1 93 93 GLU HA H 1 3.985 0.030 . 1 . . . . 93 GLU HA . 11182 1 1105 . 1 1 93 93 GLU HB2 H 1 1.927 0.030 . 2 . . . . 93 GLU HB2 . 11182 1 1106 . 1 1 93 93 GLU HB3 H 1 2.042 0.030 . 2 . . . . 93 GLU HB3 . 11182 1 1107 . 1 1 93 93 GLU HG2 H 1 2.271 0.030 . 2 . . . . 93 GLU HG2 . 11182 1 1108 . 1 1 93 93 GLU HG3 H 1 2.333 0.030 . 2 . . . . 93 GLU HG3 . 11182 1 1109 . 1 1 93 93 GLU C C 13 178.514 0.300 . 1 . . . . 93 GLU C . 11182 1 1110 . 1 1 93 93 GLU CA C 13 59.914 0.300 . 1 . . . . 93 GLU CA . 11182 1 1111 . 1 1 93 93 GLU CB C 13 29.368 0.300 . 1 . . . . 93 GLU CB . 11182 1 1112 . 1 1 93 93 GLU CG C 13 36.695 0.300 . 1 . . . . 93 GLU CG . 11182 1 1113 . 1 1 93 93 GLU N N 15 118.430 0.300 . 1 . . . . 93 GLU N . 11182 1 1114 . 1 1 94 94 GLU H H 1 7.654 0.030 . 1 . . . . 94 GLU H . 11182 1 1115 . 1 1 94 94 GLU HA H 1 4.016 0.030 . 1 . . . . 94 GLU HA . 11182 1 1116 . 1 1 94 94 GLU HB2 H 1 1.914 0.030 . 2 . . . . 94 GLU HB2 . 11182 1 1117 . 1 1 94 94 GLU HB3 H 1 2.374 0.030 . 2 . . . . 94 GLU HB3 . 11182 1 1118 . 1 1 94 94 GLU HG2 H 1 2.284 0.030 . 2 . . . . 94 GLU HG2 . 11182 1 1119 . 1 1 94 94 GLU HG3 H 1 2.375 0.030 . 2 . . . . 94 GLU HG3 . 11182 1 1120 . 1 1 94 94 GLU C C 13 179.880 0.300 . 1 . . . . 94 GLU C . 11182 1 1121 . 1 1 94 94 GLU CA C 13 59.165 0.300 . 1 . . . . 94 GLU CA . 11182 1 1122 . 1 1 94 94 GLU CB C 13 30.067 0.300 . 1 . . . . 94 GLU CB . 11182 1 1123 . 1 1 94 94 GLU CG C 13 37.335 0.300 . 1 . . . . 94 GLU CG . 11182 1 1124 . 1 1 94 94 GLU N N 15 119.819 0.300 . 1 . . . . 94 GLU N . 11182 1 1125 . 1 1 95 95 VAL H H 1 8.371 0.030 . 1 . . . . 95 VAL H . 11182 1 1126 . 1 1 95 95 VAL HA H 1 3.311 0.030 . 1 . . . . 95 VAL HA . 11182 1 1127 . 1 1 95 95 VAL HB H 1 2.089 0.030 . 1 . . . . 95 VAL HB . 11182 1 1128 . 1 1 95 95 VAL HG11 H 1 0.638 0.030 . 1 . . . . 95 VAL HG1 . 11182 1 1129 . 1 1 95 95 VAL HG12 H 1 0.638 0.030 . 1 . . . . 95 VAL HG1 . 11182 1 1130 . 1 1 95 95 VAL HG13 H 1 0.638 0.030 . 1 . . . . 95 VAL HG1 . 11182 1 1131 . 1 1 95 95 VAL HG21 H 1 1.092 0.030 . 1 . . . . 95 VAL HG2 . 11182 1 1132 . 1 1 95 95 VAL HG22 H 1 1.092 0.030 . 1 . . . . 95 VAL HG2 . 11182 1 1133 . 1 1 95 95 VAL HG23 H 1 1.092 0.030 . 1 . . . . 95 VAL HG2 . 11182 1 1134 . 1 1 95 95 VAL C C 13 176.430 0.300 . 1 . . . . 95 VAL C . 11182 1 1135 . 1 1 95 95 VAL CA C 13 67.430 0.300 . 1 . . . . 95 VAL CA . 11182 1 1136 . 1 1 95 95 VAL CB C 13 31.495 0.300 . 1 . . . . 95 VAL CB . 11182 1 1137 . 1 1 95 95 VAL CG1 C 13 21.384 0.300 . 2 . . . . 95 VAL CG1 . 11182 1 1138 . 1 1 95 95 VAL CG2 C 13 25.106 0.300 . 2 . . . . 95 VAL CG2 . 11182 1 1139 . 1 1 95 95 VAL N N 15 119.736 0.300 . 1 . . . . 95 VAL N . 11182 1 1140 . 1 1 96 96 TYR H H 1 8.275 0.030 . 1 . . . . 96 TYR H . 11182 1 1141 . 1 1 96 96 TYR HA H 1 3.812 0.030 . 1 . . . . 96 TYR HA . 11182 1 1142 . 1 1 96 96 TYR HB2 H 1 3.078 0.030 . 1 . . . . 96 TYR HB2 . 11182 1 1143 . 1 1 96 96 TYR HB3 H 1 3.078 0.030 . 1 . . . . 96 TYR HB3 . 11182 1 1144 . 1 1 96 96 TYR HD1 H 1 7.126 0.030 . 1 . . . . 96 TYR HD1 . 11182 1 1145 . 1 1 96 96 TYR HD2 H 1 7.126 0.030 . 1 . . . . 96 TYR HD2 . 11182 1 1146 . 1 1 96 96 TYR HE1 H 1 6.818 0.030 . 1 . . . . 96 TYR HE1 . 11182 1 1147 . 1 1 96 96 TYR HE2 H 1 6.818 0.030 . 1 . . . . 96 TYR HE2 . 11182 1 1148 . 1 1 96 96 TYR C C 13 177.858 0.300 . 1 . . . . 96 TYR C . 11182 1 1149 . 1 1 96 96 TYR CA C 13 61.763 0.300 . 1 . . . . 96 TYR CA . 11182 1 1150 . 1 1 96 96 TYR CB C 13 37.763 0.300 . 1 . . . . 96 TYR CB . 11182 1 1151 . 1 1 96 96 TYR CD1 C 13 133.207 0.300 . 1 . . . . 96 TYR CD1 . 11182 1 1152 . 1 1 96 96 TYR CD2 C 13 133.207 0.300 . 1 . . . . 96 TYR CD2 . 11182 1 1153 . 1 1 96 96 TYR CE1 C 13 118.017 0.300 . 1 . . . . 96 TYR CE1 . 11182 1 1154 . 1 1 96 96 TYR CE2 C 13 118.017 0.300 . 1 . . . . 96 TYR CE2 . 11182 1 1155 . 1 1 96 96 TYR N N 15 119.223 0.300 . 1 . . . . 96 TYR N . 11182 1 1156 . 1 1 97 97 ASN H H 1 8.033 0.030 . 1 . . . . 97 ASN H . 11182 1 1157 . 1 1 97 97 ASN HA H 1 4.355 0.030 . 1 . . . . 97 ASN HA . 11182 1 1158 . 1 1 97 97 ASN HB2 H 1 2.795 0.030 . 2 . . . . 97 ASN HB2 . 11182 1 1159 . 1 1 97 97 ASN HB3 H 1 2.870 0.030 . 2 . . . . 97 ASN HB3 . 11182 1 1160 . 1 1 97 97 ASN HD21 H 1 7.019 0.030 . 2 . . . . 97 ASN HD21 . 11182 1 1161 . 1 1 97 97 ASN HD22 H 1 7.643 0.030 . 2 . . . . 97 ASN HD22 . 11182 1 1162 . 1 1 97 97 ASN C C 13 177.624 0.300 . 1 . . . . 97 ASN C . 11182 1 1163 . 1 1 97 97 ASN CA C 13 56.396 0.300 . 1 . . . . 97 ASN CA . 11182 1 1164 . 1 1 97 97 ASN CB C 13 38.218 0.300 . 1 . . . . 97 ASN CB . 11182 1 1165 . 1 1 97 97 ASN N N 15 117.432 0.300 . 1 . . . . 97 ASN N . 11182 1 1166 . 1 1 97 97 ASN ND2 N 15 112.511 0.300 . 1 . . . . 97 ASN ND2 . 11182 1 1167 . 1 1 98 98 ILE H H 1 8.001 0.030 . 1 . . . . 98 ILE H . 11182 1 1168 . 1 1 98 98 ILE HA H 1 3.648 0.030 . 1 . . . . 98 ILE HA . 11182 1 1169 . 1 1 98 98 ILE HB H 1 1.798 0.030 . 1 . . . . 98 ILE HB . 11182 1 1170 . 1 1 98 98 ILE HD11 H 1 0.707 0.030 . 1 . . . . 98 ILE HD1 . 11182 1 1171 . 1 1 98 98 ILE HD12 H 1 0.707 0.030 . 1 . . . . 98 ILE HD1 . 11182 1 1172 . 1 1 98 98 ILE HD13 H 1 0.707 0.030 . 1 . . . . 98 ILE HD1 . 11182 1 1173 . 1 1 98 98 ILE HG12 H 1 0.960 0.030 . 2 . . . . 98 ILE HG12 . 11182 1 1174 . 1 1 98 98 ILE HG13 H 1 1.790 0.030 . 2 . . . . 98 ILE HG13 . 11182 1 1175 . 1 1 98 98 ILE HG21 H 1 0.896 0.030 . 1 . . . . 98 ILE HG2 . 11182 1 1176 . 1 1 98 98 ILE HG22 H 1 0.896 0.030 . 1 . . . . 98 ILE HG2 . 11182 1 1177 . 1 1 98 98 ILE HG23 H 1 0.896 0.030 . 1 . . . . 98 ILE HG2 . 11182 1 1178 . 1 1 98 98 ILE C C 13 178.846 0.300 . 1 . . . . 98 ILE C . 11182 1 1179 . 1 1 98 98 ILE CA C 13 65.355 0.300 . 1 . . . . 98 ILE CA . 11182 1 1180 . 1 1 98 98 ILE CB C 13 38.566 0.300 . 1 . . . . 98 ILE CB . 11182 1 1181 . 1 1 98 98 ILE CD1 C 13 13.826 0.300 . 1 . . . . 98 ILE CD1 . 11182 1 1182 . 1 1 98 98 ILE CG1 C 13 30.252 0.300 . 1 . . . . 98 ILE CG1 . 11182 1 1183 . 1 1 98 98 ILE CG2 C 13 17.149 0.300 . 1 . . . . 98 ILE CG2 . 11182 1 1184 . 1 1 98 98 ILE N N 15 123.179 0.300 . 1 . . . . 98 ILE N . 11182 1 1185 . 1 1 99 99 ILE H H 1 7.933 0.030 . 1 . . . . 99 ILE H . 11182 1 1186 . 1 1 99 99 ILE HA H 1 2.865 0.030 . 1 . . . . 99 ILE HA . 11182 1 1187 . 1 1 99 99 ILE HB H 1 1.310 0.030 . 1 . . . . 99 ILE HB . 11182 1 1188 . 1 1 99 99 ILE HD11 H 1 -0.183 0.030 . 1 . . . . 99 ILE HD1 . 11182 1 1189 . 1 1 99 99 ILE HD12 H 1 -0.183 0.030 . 1 . . . . 99 ILE HD1 . 11182 1 1190 . 1 1 99 99 ILE HD13 H 1 -0.183 0.030 . 1 . . . . 99 ILE HD1 . 11182 1 1191 . 1 1 99 99 ILE HG12 H 1 -1.342 0.030 . 2 . . . . 99 ILE HG12 . 11182 1 1192 . 1 1 99 99 ILE HG13 H 1 0.766 0.030 . 2 . . . . 99 ILE HG13 . 11182 1 1193 . 1 1 99 99 ILE HG21 H 1 0.304 0.030 . 1 . . . . 99 ILE HG2 . 11182 1 1194 . 1 1 99 99 ILE HG22 H 1 0.304 0.030 . 1 . . . . 99 ILE HG2 . 11182 1 1195 . 1 1 99 99 ILE HG23 H 1 0.304 0.030 . 1 . . . . 99 ILE HG2 . 11182 1 1196 . 1 1 99 99 ILE C C 13 180.870 0.300 . 1 . . . . 99 ILE C . 11182 1 1197 . 1 1 99 99 ILE CA C 13 65.306 0.300 . 1 . . . . 99 ILE CA . 11182 1 1198 . 1 1 99 99 ILE CB C 13 36.895 0.300 . 1 . . . . 99 ILE CB . 11182 1 1199 . 1 1 99 99 ILE CD1 C 13 12.666 0.300 . 1 . . . . 99 ILE CD1 . 11182 1 1200 . 1 1 99 99 ILE CG1 C 13 27.026 0.300 . 1 . . . . 99 ILE CG1 . 11182 1 1201 . 1 1 99 99 ILE CG2 C 13 16.157 0.300 . 1 . . . . 99 ILE CG2 . 11182 1 1202 . 1 1 99 99 ILE N N 15 121.283 0.300 . 1 . . . . 99 ILE N . 11182 1 1203 . 1 1 100 100 LEU H H 1 8.505 0.030 . 1 . . . . 100 LEU H . 11182 1 1204 . 1 1 100 100 LEU HA H 1 3.874 0.030 . 1 . . . . 100 LEU HA . 11182 1 1205 . 1 1 100 100 LEU HB2 H 1 1.400 0.030 . 2 . . . . 100 LEU HB2 . 11182 1 1206 . 1 1 100 100 LEU HB3 H 1 1.648 0.030 . 2 . . . . 100 LEU HB3 . 11182 1 1207 . 1 1 100 100 LEU HD11 H 1 0.804 0.030 . 1 . . . . 100 LEU HD1 . 11182 1 1208 . 1 1 100 100 LEU HD12 H 1 0.804 0.030 . 1 . . . . 100 LEU HD1 . 11182 1 1209 . 1 1 100 100 LEU HD13 H 1 0.804 0.030 . 1 . . . . 100 LEU HD1 . 11182 1 1210 . 1 1 100 100 LEU HD21 H 1 0.832 0.030 . 1 . . . . 100 LEU HD2 . 11182 1 1211 . 1 1 100 100 LEU HD22 H 1 0.832 0.030 . 1 . . . . 100 LEU HD2 . 11182 1 1212 . 1 1 100 100 LEU HD23 H 1 0.832 0.030 . 1 . . . . 100 LEU HD2 . 11182 1 1213 . 1 1 100 100 LEU HG H 1 1.451 0.030 . 1 . . . . 100 LEU HG . 11182 1 1214 . 1 1 100 100 LEU C C 13 180.296 0.300 . 1 . . . . 100 LEU C . 11182 1 1215 . 1 1 100 100 LEU CA C 13 58.313 0.300 . 1 . . . . 100 LEU CA . 11182 1 1216 . 1 1 100 100 LEU CB C 13 41.682 0.300 . 1 . . . . 100 LEU CB . 11182 1 1217 . 1 1 100 100 LEU CD1 C 13 23.958 0.300 . 2 . . . . 100 LEU CD1 . 11182 1 1218 . 1 1 100 100 LEU CD2 C 13 24.440 0.300 . 2 . . . . 100 LEU CD2 . 11182 1 1219 . 1 1 100 100 LEU CG C 13 26.864 0.300 . 1 . . . . 100 LEU CG . 11182 1 1220 . 1 1 100 100 LEU N N 15 124.690 0.300 . 1 . . . . 100 LEU N . 11182 1 1221 . 1 1 101 101 GLU H H 1 8.228 0.030 . 1 . . . . 101 GLU H . 11182 1 1222 . 1 1 101 101 GLU HA H 1 4.102 0.030 . 1 . . . . 101 GLU HA . 11182 1 1223 . 1 1 101 101 GLU HB2 H 1 2.175 0.030 . 1 . . . . 101 GLU HB2 . 11182 1 1224 . 1 1 101 101 GLU HB3 H 1 2.175 0.030 . 1 . . . . 101 GLU HB3 . 11182 1 1225 . 1 1 101 101 GLU HG2 H 1 2.369 0.030 . 2 . . . . 101 GLU HG2 . 11182 1 1226 . 1 1 101 101 GLU HG3 H 1 2.506 0.030 . 2 . . . . 101 GLU HG3 . 11182 1 1227 . 1 1 101 101 GLU C C 13 177.767 0.300 . 1 . . . . 101 GLU C . 11182 1 1228 . 1 1 101 101 GLU CA C 13 58.821 0.300 . 1 . . . . 101 GLU CA . 11182 1 1229 . 1 1 101 101 GLU CB C 13 29.289 0.300 . 1 . . . . 101 GLU CB . 11182 1 1230 . 1 1 101 101 GLU CG C 13 36.673 0.300 . 1 . . . . 101 GLU CG . 11182 1 1231 . 1 1 101 101 GLU N N 15 119.119 0.300 . 1 . . . . 101 GLU N . 11182 1 1232 . 1 1 102 102 SER H H 1 7.731 0.030 . 1 . . . . 102 SER H . 11182 1 1233 . 1 1 102 102 SER HA H 1 4.764 0.030 . 1 . . . . 102 SER HA . 11182 1 1234 . 1 1 102 102 SER HB2 H 1 4.309 0.030 . 2 . . . . 102 SER HB2 . 11182 1 1235 . 1 1 102 102 SER HB3 H 1 4.355 0.030 . 2 . . . . 102 SER HB3 . 11182 1 1236 . 1 1 102 102 SER C C 13 175.579 0.300 . 1 . . . . 102 SER C . 11182 1 1237 . 1 1 102 102 SER CA C 13 58.962 0.300 . 1 . . . . 102 SER CA . 11182 1 1238 . 1 1 102 102 SER CB C 13 65.027 0.300 . 1 . . . . 102 SER CB . 11182 1 1239 . 1 1 102 102 SER N N 15 112.564 0.300 . 1 . . . . 102 SER N . 11182 1 1240 . 1 1 103 103 LYS H H 1 7.856 0.030 . 1 . . . . 103 LYS H . 11182 1 1241 . 1 1 103 103 LYS HA H 1 4.071 0.030 . 1 . . . . 103 LYS HA . 11182 1 1242 . 1 1 103 103 LYS HB2 H 1 1.974 0.030 . 2 . . . . 103 LYS HB2 . 11182 1 1243 . 1 1 103 103 LYS HB3 H 1 2.107 0.030 . 2 . . . . 103 LYS HB3 . 11182 1 1244 . 1 1 103 103 LYS HD2 H 1 1.731 0.030 . 1 . . . . 103 LYS HD2 . 11182 1 1245 . 1 1 103 103 LYS HD3 H 1 1.731 0.030 . 1 . . . . 103 LYS HD3 . 11182 1 1246 . 1 1 103 103 LYS HE2 H 1 3.004 0.030 . 1 . . . . 103 LYS HE2 . 11182 1 1247 . 1 1 103 103 LYS HE3 H 1 3.004 0.030 . 1 . . . . 103 LYS HE3 . 11182 1 1248 . 1 1 103 103 LYS HG2 H 1 1.539 0.030 . 1 . . . . 103 LYS HG2 . 11182 1 1249 . 1 1 103 103 LYS HG3 H 1 1.539 0.030 . 1 . . . . 103 LYS HG3 . 11182 1 1250 . 1 1 103 103 LYS C C 13 177.306 0.300 . 1 . . . . 103 LYS C . 11182 1 1251 . 1 1 103 103 LYS CA C 13 60.138 0.300 . 1 . . . . 103 LYS CA . 11182 1 1252 . 1 1 103 103 LYS CB C 13 32.751 0.300 . 1 . . . . 103 LYS CB . 11182 1 1253 . 1 1 103 103 LYS CD C 13 29.621 0.300 . 1 . . . . 103 LYS CD . 11182 1 1254 . 1 1 103 103 LYS CE C 13 42.109 0.300 . 1 . . . . 103 LYS CE . 11182 1 1255 . 1 1 103 103 LYS CG C 13 24.626 0.300 . 1 . . . . 103 LYS CG . 11182 1 1256 . 1 1 103 103 LYS N N 15 124.341 0.300 . 1 . . . . 103 LYS N . 11182 1 1257 . 1 1 104 104 SER H H 1 8.209 0.030 . 1 . . . . 104 SER H . 11182 1 1258 . 1 1 104 104 SER HA H 1 4.427 0.030 . 1 . . . . 104 SER HA . 11182 1 1259 . 1 1 104 104 SER HB2 H 1 3.929 0.030 . 2 . . . . 104 SER HB2 . 11182 1 1260 . 1 1 104 104 SER HB3 H 1 4.001 0.030 . 2 . . . . 104 SER HB3 . 11182 1 1261 . 1 1 104 104 SER C C 13 174.709 0.300 . 1 . . . . 104 SER C . 11182 1 1262 . 1 1 104 104 SER CA C 13 58.785 0.300 . 1 . . . . 104 SER CA . 11182 1 1263 . 1 1 104 104 SER CB C 13 63.228 0.300 . 1 . . . . 104 SER CB . 11182 1 1264 . 1 1 104 104 SER N N 15 111.692 0.300 . 1 . . . . 104 SER N . 11182 1 1265 . 1 1 105 105 GLU H H 1 7.727 0.030 . 1 . . . . 105 GLU H . 11182 1 1266 . 1 1 105 105 GLU HA H 1 4.589 0.030 . 1 . . . . 105 GLU HA . 11182 1 1267 . 1 1 105 105 GLU HB2 H 1 2.018 0.030 . 2 . . . . 105 GLU HB2 . 11182 1 1268 . 1 1 105 105 GLU HB3 H 1 2.248 0.030 . 2 . . . . 105 GLU HB3 . 11182 1 1269 . 1 1 105 105 GLU HG2 H 1 2.327 0.030 . 2 . . . . 105 GLU HG2 . 11182 1 1270 . 1 1 105 105 GLU HG3 H 1 2.423 0.030 . 2 . . . . 105 GLU HG3 . 11182 1 1271 . 1 1 105 105 GLU C C 13 176.513 0.300 . 1 . . . . 105 GLU C . 11182 1 1272 . 1 1 105 105 GLU CA C 13 53.915 0.300 . 1 . . . . 105 GLU CA . 11182 1 1273 . 1 1 105 105 GLU CB C 13 29.556 0.300 . 1 . . . . 105 GLU CB . 11182 1 1274 . 1 1 105 105 GLU CG C 13 35.901 0.300 . 1 . . . . 105 GLU CG . 11182 1 1275 . 1 1 105 105 GLU N N 15 122.930 0.300 . 1 . . . . 105 GLU N . 11182 1 1276 . 1 1 106 106 PRO HA H 1 4.429 0.030 . 1 . . . . 106 PRO HA . 11182 1 1277 . 1 1 106 106 PRO HB2 H 1 2.043 0.030 . 2 . . . . 106 PRO HB2 . 11182 1 1278 . 1 1 106 106 PRO HB3 H 1 2.255 0.030 . 2 . . . . 106 PRO HB3 . 11182 1 1279 . 1 1 106 106 PRO HD2 H 1 3.868 0.030 . 2 . . . . 106 PRO HD2 . 11182 1 1280 . 1 1 106 106 PRO HD3 H 1 4.005 0.030 . 2 . . . . 106 PRO HD3 . 11182 1 1281 . 1 1 106 106 PRO HG2 H 1 2.044 0.030 . 2 . . . . 106 PRO HG2 . 11182 1 1282 . 1 1 106 106 PRO HG3 H 1 2.095 0.030 . 2 . . . . 106 PRO HG3 . 11182 1 1283 . 1 1 106 106 PRO C C 13 174.990 0.300 . 1 . . . . 106 PRO C . 11182 1 1284 . 1 1 106 106 PRO CA C 13 64.341 0.300 . 1 . . . . 106 PRO CA . 11182 1 1285 . 1 1 106 106 PRO CB C 13 32.022 0.300 . 1 . . . . 106 PRO CB . 11182 1 1286 . 1 1 106 106 PRO CD C 13 50.733 0.300 . 1 . . . . 106 PRO CD . 11182 1 1287 . 1 1 106 106 PRO CG C 13 27.112 0.300 . 1 . . . . 106 PRO CG . 11182 1 1288 . 1 1 107 107 GLN H H 1 7.395 0.030 . 1 . . . . 107 GLN H . 11182 1 1289 . 1 1 107 107 GLN HA H 1 5.142 0.030 . 1 . . . . 107 GLN HA . 11182 1 1290 . 1 1 107 107 GLN HB2 H 1 1.954 0.030 . 2 . . . . 107 GLN HB2 . 11182 1 1291 . 1 1 107 107 GLN HB3 H 1 1.816 0.030 . 2 . . . . 107 GLN HB3 . 11182 1 1292 . 1 1 107 107 GLN HE21 H 1 6.809 0.030 . 2 . . . . 107 GLN HE21 . 11182 1 1293 . 1 1 107 107 GLN HE22 H 1 7.644 0.030 . 2 . . . . 107 GLN HE22 . 11182 1 1294 . 1 1 107 107 GLN HG2 H 1 2.005 0.030 . 1 . . . . 107 GLN HG2 . 11182 1 1295 . 1 1 107 107 GLN HG3 H 1 2.005 0.030 . 1 . . . . 107 GLN HG3 . 11182 1 1296 . 1 1 107 107 GLN C C 13 173.894 0.300 . 1 . . . . 107 GLN C . 11182 1 1297 . 1 1 107 107 GLN CA C 13 54.057 0.300 . 1 . . . . 107 GLN CA . 11182 1 1298 . 1 1 107 107 GLN CB C 13 32.254 0.300 . 1 . . . . 107 GLN CB . 11182 1 1299 . 1 1 107 107 GLN CG C 13 33.980 0.300 . 1 . . . . 107 GLN CG . 11182 1 1300 . 1 1 107 107 GLN N N 15 115.221 0.300 . 1 . . . . 107 GLN N . 11182 1 1301 . 1 1 107 107 GLN NE2 N 15 112.565 0.300 . 1 . . . . 107 GLN NE2 . 11182 1 1302 . 1 1 108 108 VAL H H 1 8.471 0.030 . 1 . . . . 108 VAL H . 11182 1 1303 . 1 1 108 108 VAL HA H 1 4.481 0.030 . 1 . . . . 108 VAL HA . 11182 1 1304 . 1 1 108 108 VAL HB H 1 1.445 0.030 . 1 . . . . 108 VAL HB . 11182 1 1305 . 1 1 108 108 VAL HG11 H 1 0.242 0.030 . 1 . . . . 108 VAL HG1 . 11182 1 1306 . 1 1 108 108 VAL HG12 H 1 0.242 0.030 . 1 . . . . 108 VAL HG1 . 11182 1 1307 . 1 1 108 108 VAL HG13 H 1 0.242 0.030 . 1 . . . . 108 VAL HG1 . 11182 1 1308 . 1 1 108 108 VAL HG21 H 1 0.665 0.030 . 1 . . . . 108 VAL HG2 . 11182 1 1309 . 1 1 108 108 VAL HG22 H 1 0.665 0.030 . 1 . . . . 108 VAL HG2 . 11182 1 1310 . 1 1 108 108 VAL HG23 H 1 0.665 0.030 . 1 . . . . 108 VAL HG2 . 11182 1 1311 . 1 1 108 108 VAL C C 13 172.844 0.300 . 1 . . . . 108 VAL C . 11182 1 1312 . 1 1 108 108 VAL CA C 13 60.029 0.300 . 1 . . . . 108 VAL CA . 11182 1 1313 . 1 1 108 108 VAL CB C 13 35.416 0.300 . 1 . . . . 108 VAL CB . 11182 1 1314 . 1 1 108 108 VAL CG1 C 13 20.403 0.300 . 2 . . . . 108 VAL CG1 . 11182 1 1315 . 1 1 108 108 VAL CG2 C 13 20.906 0.300 . 2 . . . . 108 VAL CG2 . 11182 1 1316 . 1 1 108 108 VAL N N 15 120.937 0.300 . 1 . . . . 108 VAL N . 11182 1 1317 . 1 1 109 109 GLU H H 1 8.251 0.030 . 1 . . . . 109 GLU H . 11182 1 1318 . 1 1 109 109 GLU HA H 1 5.090 0.030 . 1 . . . . 109 GLU HA . 11182 1 1319 . 1 1 109 109 GLU HB2 H 1 1.685 0.030 . 2 . . . . 109 GLU HB2 . 11182 1 1320 . 1 1 109 109 GLU HB3 H 1 1.864 0.030 . 2 . . . . 109 GLU HB3 . 11182 1 1321 . 1 1 109 109 GLU HG2 H 1 1.800 0.030 . 2 . . . . 109 GLU HG2 . 11182 1 1322 . 1 1 109 109 GLU HG3 H 1 1.899 0.030 . 2 . . . . 109 GLU HG3 . 11182 1 1323 . 1 1 109 109 GLU C C 13 174.558 0.300 . 1 . . . . 109 GLU C . 11182 1 1324 . 1 1 109 109 GLU CA C 13 53.944 0.300 . 1 . . . . 109 GLU CA . 11182 1 1325 . 1 1 109 109 GLU CB C 13 31.942 0.300 . 1 . . . . 109 GLU CB . 11182 1 1326 . 1 1 109 109 GLU CG C 13 36.823 0.300 . 1 . . . . 109 GLU CG . 11182 1 1327 . 1 1 109 109 GLU N N 15 126.919 0.300 . 1 . . . . 109 GLU N . 11182 1 1328 . 1 1 110 110 ILE H H 1 9.164 0.030 . 1 . . . . 110 ILE H . 11182 1 1329 . 1 1 110 110 ILE HA H 1 4.490 0.030 . 1 . . . . 110 ILE HA . 11182 1 1330 . 1 1 110 110 ILE HB H 1 1.294 0.030 . 1 . . . . 110 ILE HB . 11182 1 1331 . 1 1 110 110 ILE HD11 H 1 0.198 0.030 . 1 . . . . 110 ILE HD1 . 11182 1 1332 . 1 1 110 110 ILE HD12 H 1 0.198 0.030 . 1 . . . . 110 ILE HD1 . 11182 1 1333 . 1 1 110 110 ILE HD13 H 1 0.198 0.030 . 1 . . . . 110 ILE HD1 . 11182 1 1334 . 1 1 110 110 ILE HG12 H 1 -0.065 0.030 . 2 . . . . 110 ILE HG12 . 11182 1 1335 . 1 1 110 110 ILE HG13 H 1 0.875 0.030 . 2 . . . . 110 ILE HG13 . 11182 1 1336 . 1 1 110 110 ILE HG21 H 1 0.686 0.030 . 1 . . . . 110 ILE HG2 . 11182 1 1337 . 1 1 110 110 ILE HG22 H 1 0.686 0.030 . 1 . . . . 110 ILE HG2 . 11182 1 1338 . 1 1 110 110 ILE HG23 H 1 0.686 0.030 . 1 . . . . 110 ILE HG2 . 11182 1 1339 . 1 1 110 110 ILE C C 13 174.196 0.300 . 1 . . . . 110 ILE C . 11182 1 1340 . 1 1 110 110 ILE CA C 13 59.731 0.300 . 1 . . . . 110 ILE CA . 11182 1 1341 . 1 1 110 110 ILE CB C 13 42.123 0.300 . 1 . . . . 110 ILE CB . 11182 1 1342 . 1 1 110 110 ILE CD1 C 13 14.315 0.300 . 1 . . . . 110 ILE CD1 . 11182 1 1343 . 1 1 110 110 ILE CG1 C 13 26.547 0.300 . 1 . . . . 110 ILE CG1 . 11182 1 1344 . 1 1 110 110 ILE CG2 C 13 18.499 0.300 . 1 . . . . 110 ILE CG2 . 11182 1 1345 . 1 1 110 110 ILE N N 15 127.243 0.300 . 1 . . . . 110 ILE N . 11182 1 1346 . 1 1 111 111 ILE H H 1 8.222 0.030 . 1 . . . . 111 ILE H . 11182 1 1347 . 1 1 111 111 ILE HA H 1 5.349 0.030 . 1 . . . . 111 ILE HA . 11182 1 1348 . 1 1 111 111 ILE HB H 1 1.655 0.030 . 1 . . . . 111 ILE HB . 11182 1 1349 . 1 1 111 111 ILE HD11 H 1 0.655 0.030 . 1 . . . . 111 ILE HD1 . 11182 1 1350 . 1 1 111 111 ILE HD12 H 1 0.655 0.030 . 1 . . . . 111 ILE HD1 . 11182 1 1351 . 1 1 111 111 ILE HD13 H 1 0.655 0.030 . 1 . . . . 111 ILE HD1 . 11182 1 1352 . 1 1 111 111 ILE HG12 H 1 1.103 0.030 . 2 . . . . 111 ILE HG12 . 11182 1 1353 . 1 1 111 111 ILE HG13 H 1 1.376 0.030 . 2 . . . . 111 ILE HG13 . 11182 1 1354 . 1 1 111 111 ILE HG21 H 1 0.831 0.030 . 1 . . . . 111 ILE HG2 . 11182 1 1355 . 1 1 111 111 ILE HG22 H 1 0.831 0.030 . 1 . . . . 111 ILE HG2 . 11182 1 1356 . 1 1 111 111 ILE HG23 H 1 0.831 0.030 . 1 . . . . 111 ILE HG2 . 11182 1 1357 . 1 1 111 111 ILE C C 13 176.823 0.300 . 1 . . . . 111 ILE C . 11182 1 1358 . 1 1 111 111 ILE CA C 13 58.876 0.300 . 1 . . . . 111 ILE CA . 11182 1 1359 . 1 1 111 111 ILE CB C 13 38.165 0.300 . 1 . . . . 111 ILE CB . 11182 1 1360 . 1 1 111 111 ILE CD1 C 13 11.467 0.300 . 1 . . . . 111 ILE CD1 . 11182 1 1361 . 1 1 111 111 ILE CG1 C 13 27.087 0.300 . 1 . . . . 111 ILE CG1 . 11182 1 1362 . 1 1 111 111 ILE CG2 C 13 17.486 0.300 . 1 . . . . 111 ILE CG2 . 11182 1 1363 . 1 1 111 111 ILE N N 15 125.247 0.300 . 1 . . . . 111 ILE N . 11182 1 1364 . 1 1 112 112 VAL H H 1 9.368 0.030 . 1 . . . . 112 VAL H . 11182 1 1365 . 1 1 112 112 VAL HA H 1 5.733 0.030 . 1 . . . . 112 VAL HA . 11182 1 1366 . 1 1 112 112 VAL HB H 1 2.206 0.030 . 1 . . . . 112 VAL HB . 11182 1 1367 . 1 1 112 112 VAL HG11 H 1 0.773 0.030 . 1 . . . . 112 VAL HG1 . 11182 1 1368 . 1 1 112 112 VAL HG12 H 1 0.773 0.030 . 1 . . . . 112 VAL HG1 . 11182 1 1369 . 1 1 112 112 VAL HG13 H 1 0.773 0.030 . 1 . . . . 112 VAL HG1 . 11182 1 1370 . 1 1 112 112 VAL HG21 H 1 0.949 0.030 . 1 . . . . 112 VAL HG2 . 11182 1 1371 . 1 1 112 112 VAL HG22 H 1 0.949 0.030 . 1 . . . . 112 VAL HG2 . 11182 1 1372 . 1 1 112 112 VAL HG23 H 1 0.949 0.030 . 1 . . . . 112 VAL HG2 . 11182 1 1373 . 1 1 112 112 VAL C C 13 174.460 0.300 . 1 . . . . 112 VAL C . 11182 1 1374 . 1 1 112 112 VAL CA C 13 58.480 0.300 . 1 . . . . 112 VAL CA . 11182 1 1375 . 1 1 112 112 VAL CB C 13 36.177 0.300 . 1 . . . . 112 VAL CB . 11182 1 1376 . 1 1 112 112 VAL CG1 C 13 18.738 0.300 . 2 . . . . 112 VAL CG1 . 11182 1 1377 . 1 1 112 112 VAL CG2 C 13 22.026 0.300 . 2 . . . . 112 VAL CG2 . 11182 1 1378 . 1 1 112 112 VAL N N 15 121.215 0.300 . 1 . . . . 112 VAL N . 11182 1 1379 . 1 1 113 113 SER H H 1 9.472 0.030 . 1 . . . . 113 SER H . 11182 1 1380 . 1 1 113 113 SER HA H 1 5.789 0.030 . 1 . . . . 113 SER HA . 11182 1 1381 . 1 1 113 113 SER HB2 H 1 3.694 0.030 . 1 . . . . 113 SER HB2 . 11182 1 1382 . 1 1 113 113 SER HB3 H 1 3.694 0.030 . 1 . . . . 113 SER HB3 . 11182 1 1383 . 1 1 113 113 SER C C 13 173.380 0.300 . 1 . . . . 113 SER C . 11182 1 1384 . 1 1 113 113 SER CA C 13 55.879 0.300 . 1 . . . . 113 SER CA . 11182 1 1385 . 1 1 113 113 SER CB C 13 65.326 0.300 . 1 . . . . 113 SER CB . 11182 1 1386 . 1 1 113 113 SER N N 15 114.493 0.300 . 1 . . . . 113 SER N . 11182 1 1387 . 1 1 114 114 ARG H H 1 9.311 0.030 . 1 . . . . 114 ARG H . 11182 1 1388 . 1 1 114 114 ARG HA H 1 5.330 0.030 . 1 . . . . 114 ARG HA . 11182 1 1389 . 1 1 114 114 ARG HB2 H 1 1.922 0.030 . 2 . . . . 114 ARG HB2 . 11182 1 1390 . 1 1 114 114 ARG HB3 H 1 1.989 0.030 . 2 . . . . 114 ARG HB3 . 11182 1 1391 . 1 1 114 114 ARG HD2 H 1 2.438 0.030 . 2 . . . . 114 ARG HD2 . 11182 1 1392 . 1 1 114 114 ARG HD3 H 1 3.002 0.030 . 2 . . . . 114 ARG HD3 . 11182 1 1393 . 1 1 114 114 ARG HE H 1 9.568 0.030 . 1 . . . . 114 ARG HE . 11182 1 1394 . 1 1 114 114 ARG HG2 H 1 1.637 0.030 . 2 . . . . 114 ARG HG2 . 11182 1 1395 . 1 1 114 114 ARG HG3 H 1 1.783 0.030 . 2 . . . . 114 ARG HG3 . 11182 1 1396 . 1 1 114 114 ARG C C 13 173.371 0.300 . 1 . . . . 114 ARG C . 11182 1 1397 . 1 1 114 114 ARG CA C 13 52.993 0.300 . 1 . . . . 114 ARG CA . 11182 1 1398 . 1 1 114 114 ARG CB C 13 34.778 0.300 . 1 . . . . 114 ARG CB . 11182 1 1399 . 1 1 114 114 ARG CD C 13 43.655 0.300 . 1 . . . . 114 ARG CD . 11182 1 1400 . 1 1 114 114 ARG CG C 13 25.269 0.300 . 1 . . . . 114 ARG CG . 11182 1 1401 . 1 1 114 114 ARG N N 15 127.568 0.300 . 1 . . . . 114 ARG N . 11182 1 1402 . 1 1 114 114 ARG NE N 15 85.265 0.300 . 1 . . . . 114 ARG NE . 11182 1 1403 . 1 1 115 115 PRO HA H 1 4.646 0.030 . 1 . . . . 115 PRO HA . 11182 1 1404 . 1 1 115 115 PRO HB2 H 1 1.983 0.030 . 2 . . . . 115 PRO HB2 . 11182 1 1405 . 1 1 115 115 PRO HB3 H 1 2.492 0.030 . 2 . . . . 115 PRO HB3 . 11182 1 1406 . 1 1 115 115 PRO HD2 H 1 3.792 0.030 . 2 . . . . 115 PRO HD2 . 11182 1 1407 . 1 1 115 115 PRO HD3 H 1 4.170 0.030 . 2 . . . . 115 PRO HD3 . 11182 1 1408 . 1 1 115 115 PRO HG2 H 1 2.061 0.030 . 2 . . . . 115 PRO HG2 . 11182 1 1409 . 1 1 115 115 PRO HG3 H 1 2.195 0.030 . 2 . . . . 115 PRO HG3 . 11182 1 1410 . 1 1 115 115 PRO C C 13 176.529 0.300 . 1 . . . . 115 PRO C . 11182 1 1411 . 1 1 115 115 PRO CA C 13 63.519 0.300 . 1 . . . . 115 PRO CA . 11182 1 1412 . 1 1 115 115 PRO CB C 13 32.261 0.300 . 1 . . . . 115 PRO CB . 11182 1 1413 . 1 1 115 115 PRO CD C 13 51.227 0.300 . 1 . . . . 115 PRO CD . 11182 1 1414 . 1 1 115 115 PRO CG C 13 27.945 0.300 . 1 . . . . 115 PRO CG . 11182 1 1415 . 1 1 116 116 SER H H 1 8.081 0.030 . 1 . . . . 116 SER H . 11182 1 1416 . 1 1 116 116 SER HA H 1 4.282 0.030 . 1 . . . . 116 SER HA . 11182 1 1417 . 1 1 116 116 SER HB2 H 1 3.549 0.030 . 2 . . . . 116 SER HB2 . 11182 1 1418 . 1 1 116 116 SER HB3 H 1 3.815 0.030 . 2 . . . . 116 SER HB3 . 11182 1 1419 . 1 1 116 116 SER C C 13 174.551 0.300 . 1 . . . . 116 SER C . 11182 1 1420 . 1 1 116 116 SER CA C 13 58.086 0.300 . 1 . . . . 116 SER CA . 11182 1 1421 . 1 1 116 116 SER CB C 13 64.096 0.300 . 1 . . . . 116 SER CB . 11182 1 1422 . 1 1 116 116 SER N N 15 116.914 0.300 . 1 . . . . 116 SER N . 11182 1 1423 . 1 1 117 117 GLY H H 1 8.184 0.030 . 1 . . . . 117 GLY H . 11182 1 1424 . 1 1 117 117 GLY HA2 H 1 4.126 0.030 . 1 . . . . 117 GLY HA2 . 11182 1 1425 . 1 1 117 117 GLY HA3 H 1 4.126 0.030 . 1 . . . . 117 GLY HA3 . 11182 1 1426 . 1 1 117 117 GLY C C 13 171.770 0.300 . 1 . . . . 117 GLY C . 11182 1 1427 . 1 1 117 117 GLY CA C 13 44.659 0.300 . 1 . . . . 117 GLY CA . 11182 1 1428 . 1 1 117 117 GLY N N 15 110.341 0.300 . 1 . . . . 117 GLY N . 11182 1 1429 . 1 1 118 118 PRO HA H 1 4.458 0.030 . 1 . . . . 118 PRO HA . 11182 1 1430 . 1 1 118 118 PRO HB2 H 1 1.960 0.030 . 2 . . . . 118 PRO HB2 . 11182 1 1431 . 1 1 118 118 PRO HB3 H 1 2.284 0.030 . 2 . . . . 118 PRO HB3 . 11182 1 1432 . 1 1 118 118 PRO HD2 H 1 3.612 0.030 . 1 . . . . 118 PRO HD2 . 11182 1 1433 . 1 1 118 118 PRO HD3 H 1 3.612 0.030 . 1 . . . . 118 PRO HD3 . 11182 1 1434 . 1 1 118 118 PRO HG2 H 1 2.004 0.030 . 1 . . . . 118 PRO HG2 . 11182 1 1435 . 1 1 118 118 PRO HG3 H 1 2.004 0.030 . 1 . . . . 118 PRO HG3 . 11182 1 1436 . 1 1 118 118 PRO C C 13 177.419 0.300 . 1 . . . . 118 PRO C . 11182 1 1437 . 1 1 118 118 PRO CA C 13 63.239 0.300 . 1 . . . . 118 PRO CA . 11182 1 1438 . 1 1 118 118 PRO CB C 13 32.189 0.300 . 1 . . . . 118 PRO CB . 11182 1 1439 . 1 1 118 118 PRO CD C 13 49.748 0.300 . 1 . . . . 118 PRO CD . 11182 1 1440 . 1 1 118 118 PRO CG C 13 27.121 0.300 . 1 . . . . 118 PRO CG . 11182 1 1441 . 1 1 119 119 SER H H 1 8.541 0.030 . 1 . . . . 119 SER H . 11182 1 1442 . 1 1 119 119 SER HA H 1 4.504 0.030 . 1 . . . . 119 SER HA . 11182 1 1443 . 1 1 119 119 SER HB2 H 1 3.904 0.030 . 2 . . . . 119 SER HB2 . 11182 1 1444 . 1 1 119 119 SER HB3 H 1 3.967 0.030 . 2 . . . . 119 SER HB3 . 11182 1 1445 . 1 1 119 119 SER C C 13 174.702 0.300 . 1 . . . . 119 SER C . 11182 1 1446 . 1 1 119 119 SER CA C 13 58.396 0.300 . 1 . . . . 119 SER CA . 11182 1 1447 . 1 1 119 119 SER CB C 13 63.764 0.300 . 1 . . . . 119 SER CB . 11182 1 1448 . 1 1 119 119 SER N N 15 116.369 0.300 . 1 . . . . 119 SER N . 11182 1 1449 . 1 1 120 120 SER H H 1 8.337 0.030 . 1 . . . . 120 SER H . 11182 1 1450 . 1 1 120 120 SER HA H 1 4.499 0.030 . 1 . . . . 120 SER HA . 11182 1 1451 . 1 1 120 120 SER HB2 H 1 3.871 0.030 . 2 . . . . 120 SER HB2 . 11182 1 1452 . 1 1 120 120 SER HB3 H 1 3.902 0.030 . 2 . . . . 120 SER HB3 . 11182 1 1453 . 1 1 120 120 SER C C 13 173.901 0.300 . 1 . . . . 120 SER C . 11182 1 1454 . 1 1 120 120 SER CA C 13 58.405 0.300 . 1 . . . . 120 SER CA . 11182 1 1455 . 1 1 120 120 SER CB C 13 64.262 0.300 . 1 . . . . 120 SER CB . 11182 1 1456 . 1 1 120 120 SER N N 15 117.918 0.300 . 1 . . . . 120 SER N . 11182 1 1457 . 1 1 121 121 GLY H H 1 8.044 0.030 . 1 . . . . 121 GLY H . 11182 1 1458 . 1 1 121 121 GLY HA2 H 1 3.737 0.030 . 1 . . . . 121 GLY HA2 . 11182 1 1459 . 1 1 121 121 GLY HA3 H 1 3.737 0.030 . 1 . . . . 121 GLY HA3 . 11182 1 1460 . 1 1 121 121 GLY C C 13 178.976 0.300 . 1 . . . . 121 GLY C . 11182 1 1461 . 1 1 121 121 GLY CA C 13 46.116 0.300 . 1 . . . . 121 GLY CA . 11182 1 1462 . 1 1 121 121 GLY N N 15 116.824 0.300 . 1 . . . . 121 GLY N . 11182 1 stop_ save_