data_11425 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 11425 _Entry.Title ; 1H, 13C, and 15N resonance assignment of the SPFH domain of human stomatin. ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2011-01-15 _Entry.Accession_date 2011-01-18 _Entry.Last_release_date . _Entry.Original_release_date . _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 3.1.0.46 _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 Tomoyuki Tsuruta . . . 11425 2 Natsuko Goda . . . 11425 3 Yoshitaka Umetsu . . . 11425 4 Naoko Iwaya . . . 11425 5 Yohta Kuwahara . . . 11425 6 Hidekazu Hiroaki . . . 11425 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 11425 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 453 11425 '15N chemical shifts' 122 11425 '1H chemical shifts' 763 11425 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 2 . . 2011-07-01 2011-01-15 update BMRB 'update entry citation' 11425 1 . . 2011-06-21 2011-01-15 original author 'original release' 11425 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 11425 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 21643969 _Citation.Full_citation . _Citation.Title '(1)H, (13)C, and (15)N resonance assignment of the SPFH domain of human stomatin.' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Biomol. NMR Assignments' _Citation.Journal_name_full 'Biomolecular NMR assignments' _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 2011 _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 Tomoyuki Tsuruta . . . 11425 1 2 Natsuko Goda . . . 11425 1 3 Yoshitaka Umetsu . . . 11425 1 4 Naoko Iwaya . . . 11425 1 5 Yohta Kuwahara . . . 11425 1 6 Hidekazu Hiroaki . . . 11425 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID 'heredity stomatocytosis' 11425 1 'membrane skeleton' 11425 1 oligomerization 11425 1 'SPFH domain' 11425 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 11425 _Assembly.ID 1 _Assembly.Name 'SPFH domain of human stomatin' _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds no _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 'SPFH domain of human stomatin' 1 $entity A . yes native no no . . . 11425 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity _Entity.Sf_category entity _Entity.Sf_framecode entity _Entity.Entry_ID 11425 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name 'SPFH domain of human stomatin' _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; GSDHVDMRTISFDIPPQEIL TKDSVTISVDGVVYYRVQNA TLAVANITNADSATRLLAQT TLRNVLGTKNLSQILSDREE IAHNMQSTLDDATDAWGIKV ERVEIKDVKLPVQ ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details ; Residues 1-4 represent a non-native affinity tag. This is SPFH domain of human stomatin (residues 94 202). ; _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 113 _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 DBJ BAG64120 . "unnamed protein product [Homo sapiens]" . . . . . 96.46 280 100.00 100.00 5.04e-69 . . . . 11425 1 2 no DBJ BAG65267 . "unnamed protein product [Homo sapiens]" . . . . . 96.46 237 100.00 100.00 5.48e-70 . . . . 11425 1 3 no DBJ BAG82675 . "erythrocyte band 7 integral membrane protein stomatin [Canis lupus familiaris]" . . . . . 97.35 284 97.27 97.27 2.76e-67 . . . . 11425 1 4 no DBJ BAG82676 . "erythrocyte band 7 integral membrane protein stomatin [Canis lupus familiaris]" . . . . . 97.35 284 97.27 97.27 2.76e-67 . . . . 11425 1 5 no DBJ BAI46539 . "stomatin [synthetic construct]" . . . . . 96.46 288 100.00 100.00 6.73e-69 . . . . 11425 1 6 no EMBL CAA42671 . "erythrocyte band 7 integral membrane protein [Homo sapiens]" . . . . . 96.46 288 100.00 100.00 6.73e-69 . . . . 11425 1 7 no EMBL CAA59436 . "band 7 integral membrane protein [Homo sapiens]" . . . . . 96.46 288 100.00 100.00 6.73e-69 . . . . 11425 1 8 no EMBL CAG46897 . "STOM [Homo sapiens]" . . . . . 96.46 288 100.00 100.00 6.73e-69 . . . . 11425 1 9 no GB AAA58432 . "stomatin peptide [Homo sapiens]" . . . . . 96.46 288 100.00 100.00 7.18e-69 . . . . 11425 1 10 no GB AAC50296 . "band 7.2b stomatin [Homo sapiens]" . . . . . 96.46 296 100.00 100.00 1.07e-68 . . . . 11425 1 11 no GB AAH10703 . "Stomatin [Homo sapiens]" . . . . . 96.46 288 100.00 100.00 7.74e-69 . . . . 11425 1 12 no GB AAI51432 . "STOM protein [Bos taurus]" . . . . . 97.35 284 97.27 97.27 2.35e-67 . . . . 11425 1 13 no GB AAX36989 . "stomatin [synthetic construct]" . . . . . 96.46 289 100.00 100.00 7.72e-69 . . . . 11425 1 14 no PRF 2201444A . "membrane protein band 7.2b" . . . . . 96.46 296 100.00 100.00 1.07e-68 . . . . 11425 1 15 no PRF 2204264A . "band 7 integral membrane protein" . . . . . 96.46 288 100.00 100.00 6.73e-69 . . . . 11425 1 16 no REF NP_001098943 . "erythrocyte band 7 integral membrane protein [Bos taurus]" . . . . . 97.35 284 97.27 97.27 2.35e-67 . . . . 11425 1 17 no REF NP_001136142 . "erythrocyte band 7 integral membrane protein [Canis lupus familiaris]" . . . . . 97.35 284 97.27 97.27 2.76e-67 . . . . 11425 1 18 no REF NP_001253158 . "erythrocyte band 7 integral membrane protein [Macaca mulatta]" . . . . . 96.46 288 100.00 100.00 6.95e-69 . . . . 11425 1 19 no REF NP_001257455 . "erythrocyte band 7 integral membrane protein isoform c [Homo sapiens]" . . . . . 91.15 197 100.00 100.00 9.09e-65 . . . . 11425 1 20 no REF NP_004090 . "erythrocyte band 7 integral membrane protein isoform a [Homo sapiens]" . . . . . 96.46 288 100.00 100.00 6.73e-69 . . . . 11425 1 21 no SP P27105 . "RecName: Full=Erythrocyte band 7 integral membrane protein; AltName: Full=Protein 7.2b; AltName: Full=Stomatin" . . . . . 96.46 288 100.00 100.00 6.73e-69 . . . . 11425 1 22 no TPG DAA26426 . "TPA: stomatin [Bos taurus]" . . . . . 97.35 284 97.27 97.27 2.04e-67 . . . . 11425 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 . 11425 1 2 . SER . 11425 1 3 . ASP . 11425 1 4 . HIS . 11425 1 5 . VAL . 11425 1 6 . ASP . 11425 1 7 . MET . 11425 1 8 . ARG . 11425 1 9 . THR . 11425 1 10 . ILE . 11425 1 11 . SER . 11425 1 12 . PHE . 11425 1 13 . ASP . 11425 1 14 . ILE . 11425 1 15 . PRO . 11425 1 16 . PRO . 11425 1 17 . GLN . 11425 1 18 . GLU . 11425 1 19 . ILE . 11425 1 20 . LEU . 11425 1 21 . THR . 11425 1 22 . LYS . 11425 1 23 . ASP . 11425 1 24 . SER . 11425 1 25 . VAL . 11425 1 26 . THR . 11425 1 27 . ILE . 11425 1 28 . SER . 11425 1 29 . VAL . 11425 1 30 . ASP . 11425 1 31 . GLY . 11425 1 32 . VAL . 11425 1 33 . VAL . 11425 1 34 . TYR . 11425 1 35 . TYR . 11425 1 36 . ARG . 11425 1 37 . VAL . 11425 1 38 . GLN . 11425 1 39 . ASN . 11425 1 40 . ALA . 11425 1 41 . THR . 11425 1 42 . LEU . 11425 1 43 . ALA . 11425 1 44 . VAL . 11425 1 45 . ALA . 11425 1 46 . ASN . 11425 1 47 . ILE . 11425 1 48 . THR . 11425 1 49 . ASN . 11425 1 50 . ALA . 11425 1 51 . ASP . 11425 1 52 . SER . 11425 1 53 . ALA . 11425 1 54 . THR . 11425 1 55 . ARG . 11425 1 56 . LEU . 11425 1 57 . LEU . 11425 1 58 . ALA . 11425 1 59 . GLN . 11425 1 60 . THR . 11425 1 61 . THR . 11425 1 62 . LEU . 11425 1 63 . ARG . 11425 1 64 . ASN . 11425 1 65 . VAL . 11425 1 66 . LEU . 11425 1 67 . GLY . 11425 1 68 . THR . 11425 1 69 . LYS . 11425 1 70 . ASN . 11425 1 71 . LEU . 11425 1 72 . SER . 11425 1 73 . GLN . 11425 1 74 . ILE . 11425 1 75 . LEU . 11425 1 76 . SER . 11425 1 77 . ASP . 11425 1 78 . ARG . 11425 1 79 . GLU . 11425 1 80 . GLU . 11425 1 81 . ILE . 11425 1 82 . ALA . 11425 1 83 . HIS . 11425 1 84 . ASN . 11425 1 85 . MET . 11425 1 86 . GLN . 11425 1 87 . SER . 11425 1 88 . THR . 11425 1 89 . LEU . 11425 1 90 . ASP . 11425 1 91 . ASP . 11425 1 92 . ALA . 11425 1 93 . THR . 11425 1 94 . ASP . 11425 1 95 . ALA . 11425 1 96 . TRP . 11425 1 97 . GLY . 11425 1 98 . ILE . 11425 1 99 . LYS . 11425 1 100 . VAL . 11425 1 101 . GLU . 11425 1 102 . ARG . 11425 1 103 . VAL . 11425 1 104 . GLU . 11425 1 105 . ILE . 11425 1 106 . LYS . 11425 1 107 . ASP . 11425 1 108 . VAL . 11425 1 109 . LYS . 11425 1 110 . LEU . 11425 1 111 . PRO . 11425 1 112 . VAL . 11425 1 113 . GLN . 11425 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 11425 1 . SER 2 2 11425 1 . ASP 3 3 11425 1 . HIS 4 4 11425 1 . VAL 5 5 11425 1 . ASP 6 6 11425 1 . MET 7 7 11425 1 . ARG 8 8 11425 1 . THR 9 9 11425 1 . ILE 10 10 11425 1 . SER 11 11 11425 1 . PHE 12 12 11425 1 . ASP 13 13 11425 1 . ILE 14 14 11425 1 . PRO 15 15 11425 1 . PRO 16 16 11425 1 . GLN 17 17 11425 1 . GLU 18 18 11425 1 . ILE 19 19 11425 1 . LEU 20 20 11425 1 . THR 21 21 11425 1 . LYS 22 22 11425 1 . ASP 23 23 11425 1 . SER 24 24 11425 1 . VAL 25 25 11425 1 . THR 26 26 11425 1 . ILE 27 27 11425 1 . SER 28 28 11425 1 . VAL 29 29 11425 1 . ASP 30 30 11425 1 . GLY 31 31 11425 1 . VAL 32 32 11425 1 . VAL 33 33 11425 1 . TYR 34 34 11425 1 . TYR 35 35 11425 1 . ARG 36 36 11425 1 . VAL 37 37 11425 1 . GLN 38 38 11425 1 . ASN 39 39 11425 1 . ALA 40 40 11425 1 . THR 41 41 11425 1 . LEU 42 42 11425 1 . ALA 43 43 11425 1 . VAL 44 44 11425 1 . ALA 45 45 11425 1 . ASN 46 46 11425 1 . ILE 47 47 11425 1 . THR 48 48 11425 1 . ASN 49 49 11425 1 . ALA 50 50 11425 1 . ASP 51 51 11425 1 . SER 52 52 11425 1 . ALA 53 53 11425 1 . THR 54 54 11425 1 . ARG 55 55 11425 1 . LEU 56 56 11425 1 . LEU 57 57 11425 1 . ALA 58 58 11425 1 . GLN 59 59 11425 1 . THR 60 60 11425 1 . THR 61 61 11425 1 . LEU 62 62 11425 1 . ARG 63 63 11425 1 . ASN 64 64 11425 1 . VAL 65 65 11425 1 . LEU 66 66 11425 1 . GLY 67 67 11425 1 . THR 68 68 11425 1 . LYS 69 69 11425 1 . ASN 70 70 11425 1 . LEU 71 71 11425 1 . SER 72 72 11425 1 . GLN 73 73 11425 1 . ILE 74 74 11425 1 . LEU 75 75 11425 1 . SER 76 76 11425 1 . ASP 77 77 11425 1 . ARG 78 78 11425 1 . GLU 79 79 11425 1 . GLU 80 80 11425 1 . ILE 81 81 11425 1 . ALA 82 82 11425 1 . HIS 83 83 11425 1 . ASN 84 84 11425 1 . MET 85 85 11425 1 . GLN 86 86 11425 1 . SER 87 87 11425 1 . THR 88 88 11425 1 . LEU 89 89 11425 1 . ASP 90 90 11425 1 . ASP 91 91 11425 1 . ALA 92 92 11425 1 . THR 93 93 11425 1 . ASP 94 94 11425 1 . ALA 95 95 11425 1 . TRP 96 96 11425 1 . GLY 97 97 11425 1 . ILE 98 98 11425 1 . LYS 99 99 11425 1 . VAL 100 100 11425 1 . GLU 101 101 11425 1 . ARG 102 102 11425 1 . VAL 103 103 11425 1 . GLU 104 104 11425 1 . ILE 105 105 11425 1 . LYS 106 106 11425 1 . ASP 107 107 11425 1 . VAL 108 108 11425 1 . LYS 109 109 11425 1 . LEU 110 110 11425 1 . PRO 111 111 11425 1 . VAL 112 112 11425 1 . GLN 113 113 11425 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 11425 _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 . 9606 organism . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . . . . . . . . . 11425 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 11425 _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 . 'recombinant technology' 'Escherichia coli' 'E. coli' . 83333 Escherichia coli K-12 . . . . . . . . . . . . . . . pGEX-4T3 . . . . . . 11425 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 11425 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details '0.6 mM stomatin, 50 mM sodium phosphate (pH6.4), 100 mM NaCl' _Sample.Aggregate_sample_number . _Sample.Solvent_system '95% H2O/5% 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 'SPFH domain of human stomatin' '[U-13C; U-15N]' . . 1 $entity . protein 0.6 . . mM . . . . 11425 1 2 'sodium phosphate' 'natural abundance' . . . . . salt 50 . . mM . . . . 11425 1 3 'sodium chloride' 'natural abundance' . . . . . salt 100 . . mM . . . . 11425 1 4 H2O . . . . . . solvent 95 . . % . . . . 11425 1 5 D2O . . . . . . solvent 5 . . % . . . . 11425 1 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID 11425 _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 pH 6.4 . pH 11425 1 pressure 1 . atm 11425 1 temperature 298 . K 11425 1 stop_ save_ ############################ # Computer software used # ############################ save_NMRPipe _Software.Sf_category software _Software.Sf_framecode NMRPipe _Software.Entry_ID 11425 _Software.ID 1 _Software.Name NMRPipe _Software.Version 5.2 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . 11425 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 11425 1 stop_ save_ save_SPARKY _Software.Sf_category software _Software.Sf_framecode SPARKY _Software.Entry_ID 11425 _Software.ID 2 _Software.Name SPARKY _Software.Version 3.110 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Goddard . . 11425 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 11425 2 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 11425 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model 'Avance III' _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 11425 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 Bruker 'Avance III' . 600 . . . 11425 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 11425 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 11425 1 2 '2D 1H-13C HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 11425 1 3 '3D CBCA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 11425 1 4 '3D HNCACB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 11425 1 5 '3D HN(CO)CA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 11425 1 6 '3D HNCA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 11425 1 7 '3D HNCO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 11425 1 8 '3D HN(CA)CO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 11425 1 9 '3D H(CCO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 11425 1 10 '3D C(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 11425 1 11 '3D 1H-13C NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 11425 1 12 '3D 1H-15N NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 11425 1 13 '3D HCCH-COSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 11425 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_reference_1 _Chem_shift_reference.Entry_ID 11425 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.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 external indirect 0.251449530 . . . . . . . . . 11425 1 H 1 DSS 'methyl protons' . . . . ppm 0 external direct 1.0 . . . . . . . . . 11425 1 N 15 DSS 'methyl protons' . . . . ppm 0 external indirect 0.101329118 . . . . . . . . . 11425 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 11425 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err 0.02 _Assigned_chem_shift_list.Chem_shift_13C_err 0.2 _Assigned_chem_shift_list.Chem_shift_15N_err 0.2 _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' 1 $sample_1 isotropic 11425 1 2 '2D 1H-13C HSQC' 1 $sample_1 isotropic 11425 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 2 2 SER HA H 1 4.373 0.02 . 1 . . . . 2 SER HA . 11425 1 2 . 1 1 2 2 SER C C 13 171.400 0.2 . 1 . . . . 2 SER C . 11425 1 3 . 1 1 2 2 SER CA C 13 55.541 0.2 . 1 . . . . 2 SER CA . 11425 1 4 . 1 1 2 2 SER CB C 13 60.940 0.2 . 1 . . . . 2 SER CB . 11425 1 5 . 1 1 2 2 SER N N 15 124.806 0.2 . 1 . . . . 2 SER N . 11425 1 6 . 1 1 3 3 ASP H H 1 8.404 0.02 . 1 . . . . 3 ASP H . 11425 1 7 . 1 1 3 3 ASP HA H 1 4.460 0.02 . 1 . . . . 3 ASP HA . 11425 1 8 . 1 1 3 3 ASP C C 13 173.100 0.2 . 1 . . . . 3 ASP C . 11425 1 9 . 1 1 3 3 ASP CA C 13 51.490 0.2 . 1 . . . . 3 ASP CA . 11425 1 10 . 1 1 3 3 ASP CB C 13 38.170 0.2 . 1 . . . . 3 ASP CB . 11425 1 11 . 1 1 3 3 ASP N N 15 122.016 0.2 . 1 . . . . 3 ASP N . 11425 1 12 . 1 1 4 4 HIS H H 1 8.199 0.02 . 1 . . . . 4 HIS H . 11425 1 13 . 1 1 4 4 HIS HA H 1 4.509 0.02 . 1 . . . . 4 HIS HA . 11425 1 14 . 1 1 4 4 HIS HB2 H 1 3.042 0.02 . 2 . . . . 4 HIS HB2 . 11425 1 15 . 1 1 4 4 HIS HB3 H 1 2.985 0.02 . 2 . . . . 4 HIS HB3 . 11425 1 16 . 1 1 4 4 HIS HE1 H 1 8.276 0.02 . 1 . . . . 4 HIS HE1 . 11425 1 17 . 1 1 4 4 HIS C C 13 171.781 0.2 . 1 . . . . 4 HIS C . 11425 1 18 . 1 1 4 4 HIS CA C 13 53.285 0.2 . 1 . . . . 4 HIS CA . 11425 1 19 . 1 1 4 4 HIS CB C 13 27.175 0.2 . 1 . . . . 4 HIS CB . 11425 1 20 . 1 1 4 4 HIS CE1 C 13 134.100 0.2 . 1 . . . . 4 HIS CE1 . 11425 1 21 . 1 1 4 4 HIS N N 15 118.900 0.2 . 1 . . . . 4 HIS N . 11425 1 22 . 1 1 5 5 VAL H H 1 8.014 0.02 . 1 . . . . 5 VAL H . 11425 1 23 . 1 1 5 5 VAL HA H 1 3.923 0.02 . 1 . . . . 5 VAL HA . 11425 1 24 . 1 1 5 5 VAL HB H 1 1.877 0.02 . 1 . . . . 5 VAL HB . 11425 1 25 . 1 1 5 5 VAL HG11 H 1 0.771 0.02 . 2 . . . . 5 VAL MG1 . 11425 1 26 . 1 1 5 5 VAL HG12 H 1 0.771 0.02 . 2 . . . . 5 VAL MG1 . 11425 1 27 . 1 1 5 5 VAL HG13 H 1 0.771 0.02 . 2 . . . . 5 VAL MG1 . 11425 1 28 . 1 1 5 5 VAL HG21 H 1 0.771 0.02 . 2 . . . . 5 VAL MG2 . 11425 1 29 . 1 1 5 5 VAL HG22 H 1 0.771 0.02 . 2 . . . . 5 VAL MG2 . 11425 1 30 . 1 1 5 5 VAL HG23 H 1 0.771 0.02 . 2 . . . . 5 VAL MG2 . 11425 1 31 . 1 1 5 5 VAL C C 13 172.551 0.2 . 1 . . . . 5 VAL C . 11425 1 32 . 1 1 5 5 VAL CA C 13 59.577 0.2 . 1 . . . . 5 VAL CA . 11425 1 33 . 1 1 5 5 VAL CB C 13 30.194 0.2 . 1 . . . . 5 VAL CB . 11425 1 34 . 1 1 5 5 VAL N N 15 122.148 0.2 . 1 . . . . 5 VAL N . 11425 1 35 . 1 1 6 6 ASP H H 1 8.440 0.02 . 1 . . . . 6 ASP H . 11425 1 36 . 1 1 6 6 ASP HA H 1 4.133 0.02 . 1 . . . . 6 ASP HA . 11425 1 37 . 1 1 6 6 ASP HB2 H 1 2.668 0.02 . 2 . . . . 6 ASP HB2 . 11425 1 38 . 1 1 6 6 ASP HB3 H 1 2.479 0.02 . 2 . . . . 6 ASP HB3 . 11425 1 39 . 1 1 6 6 ASP C C 13 173.531 0.2 . 1 . . . . 6 ASP C . 11425 1 40 . 1 1 6 6 ASP CA C 13 51.480 0.2 . 1 . . . . 6 ASP CA . 11425 1 41 . 1 1 6 6 ASP CB C 13 38.526 0.2 . 1 . . . . 6 ASP CB . 11425 1 42 . 1 1 6 6 ASP N N 15 124.656 0.2 . 1 . . . . 6 ASP N . 11425 1 43 . 1 1 7 7 MET H H 1 8.327 0.02 . 1 . . . . 7 MET H . 11425 1 44 . 1 1 7 7 MET HA H 1 4.453 0.02 . 1 . . . . 7 MET HA . 11425 1 45 . 1 1 7 7 MET HB2 H 1 2.115 0.02 . 1 . . . . 7 MET HB2 . 11425 1 46 . 1 1 7 7 MET HB3 H 1 1.823 0.02 . 1 . . . . 7 MET HB3 . 11425 1 47 . 1 1 7 7 MET HG2 H 1 2.502 0.02 . 2 . . . . 7 MET HG2 . 11425 1 48 . 1 1 7 7 MET HG3 H 1 2.405 0.02 . 2 . . . . 7 MET HG3 . 11425 1 49 . 1 1 7 7 MET C C 13 173.300 0.2 . 1 . . . . 7 MET C . 11425 1 50 . 1 1 7 7 MET CA C 13 52.442 0.2 . 1 . . . . 7 MET CA . 11425 1 51 . 1 1 7 7 MET CB C 13 29.640 0.2 . 1 . . . . 7 MET CB . 11425 1 52 . 1 1 7 7 MET CG C 13 29.489 0.2 . 1 . . . . 7 MET CG . 11425 1 53 . 1 1 7 7 MET N N 15 122.132 0.2 . 1 . . . . 7 MET N . 11425 1 54 . 1 1 8 8 ARG H H 1 8.104 0.02 . 1 . . . . 8 ARG H . 11425 1 55 . 1 1 8 8 ARG HA H 1 4.213 0.02 . 1 . . . . 8 ARG HA . 11425 1 56 . 1 1 8 8 ARG HB2 H 1 1.721 0.02 . 2 . . . . 8 ARG HB2 . 11425 1 57 . 1 1 8 8 ARG HB3 H 1 1.721 0.02 . 2 . . . . 8 ARG HB3 . 11425 1 58 . 1 1 8 8 ARG HD2 H 1 3.105 0.02 . 2 . . . . 8 ARG HD2 . 11425 1 59 . 1 1 8 8 ARG HD3 H 1 3.105 0.02 . 2 . . . . 8 ARG HD3 . 11425 1 60 . 1 1 8 8 ARG HG2 H 1 1.501 0.02 . 2 . . . . 8 ARG HG2 . 11425 1 61 . 1 1 8 8 ARG HG3 H 1 1.501 0.02 . 2 . . . . 8 ARG HG3 . 11425 1 62 . 1 1 8 8 ARG CA C 13 53.424 0.2 . 1 . . . . 8 ARG CA . 11425 1 63 . 1 1 8 8 ARG CB C 13 28.367 0.2 . 1 . . . . 8 ARG CB . 11425 1 64 . 1 1 8 8 ARG CD C 13 40.724 0.2 . 1 . . . . 8 ARG CD . 11425 1 65 . 1 1 8 8 ARG CG C 13 24.044 0.2 . 1 . . . . 8 ARG CG . 11425 1 66 . 1 1 8 8 ARG N N 15 121.000 0.2 . 1 . . . . 8 ARG N . 11425 1 67 . 1 1 9 9 THR H H 1 8.084 0.02 . 1 . . . . 9 THR H . 11425 1 68 . 1 1 9 9 THR HA H 1 4.241 0.02 . 1 . . . . 9 THR HA . 11425 1 69 . 1 1 9 9 THR HB H 1 3.854 0.02 . 1 . . . . 9 THR HB . 11425 1 70 . 1 1 9 9 THR HG21 H 1 1.101 0.02 . 1 . . . . 9 THR MG . 11425 1 71 . 1 1 9 9 THR HG22 H 1 1.101 0.02 . 1 . . . . 9 THR MG . 11425 1 72 . 1 1 9 9 THR HG23 H 1 1.101 0.02 . 1 . . . . 9 THR MG . 11425 1 73 . 1 1 9 9 THR C C 13 171.065 0.2 . 1 . . . . 9 THR C . 11425 1 74 . 1 1 9 9 THR CA C 13 60.740 0.2 . 1 . . . . 9 THR CA . 11425 1 75 . 1 1 9 9 THR CB C 13 66.828 0.2 . 1 . . . . 9 THR CB . 11425 1 76 . 1 1 9 9 THR CG2 C 13 19.759 0.2 . 1 . . . . 9 THR CG2 . 11425 1 77 . 1 1 9 9 THR N N 15 117.500 0.2 . 1 . . . . 9 THR N . 11425 1 78 . 1 1 10 10 ILE H H 1 9.196 0.02 . 1 . . . . 10 ILE H . 11425 1 79 . 1 1 10 10 ILE HA H 1 4.008 0.02 . 1 . . . . 10 ILE HA . 11425 1 80 . 1 1 10 10 ILE HB H 1 0.649 0.02 . 1 . . . . 10 ILE HB . 11425 1 81 . 1 1 10 10 ILE HD11 H 1 0.588 0.02 . 1 . . . . 10 ILE MD . 11425 1 82 . 1 1 10 10 ILE HD12 H 1 0.588 0.02 . 1 . . . . 10 ILE MD . 11425 1 83 . 1 1 10 10 ILE HD13 H 1 0.588 0.02 . 1 . . . . 10 ILE MD . 11425 1 84 . 1 1 10 10 ILE HG12 H 1 1.036 0.02 . 2 . . . . 10 ILE HG12 . 11425 1 85 . 1 1 10 10 ILE HG13 H 1 1.036 0.02 . 2 . . . . 10 ILE HG13 . 11425 1 86 . 1 1 10 10 ILE HG21 H 1 0.647 0.02 . 1 . . . . 10 ILE MG . 11425 1 87 . 1 1 10 10 ILE HG22 H 1 0.647 0.02 . 1 . . . . 10 ILE MG . 11425 1 88 . 1 1 10 10 ILE HG23 H 1 0.647 0.02 . 1 . . . . 10 ILE MG . 11425 1 89 . 1 1 10 10 ILE C C 13 170.800 0.2 . 1 . . . . 10 ILE C . 11425 1 90 . 1 1 10 10 ILE CA C 13 57.147 0.2 . 1 . . . . 10 ILE CA . 11425 1 91 . 1 1 10 10 ILE CB C 13 36.653 0.2 . 1 . . . . 10 ILE CB . 11425 1 92 . 1 1 10 10 ILE CD1 C 13 10.353 0.2 . 1 . . . . 10 ILE CD1 . 11425 1 93 . 1 1 10 10 ILE CG1 C 13 24.333 0.2 . 1 . . . . 10 ILE CG1 . 11425 1 94 . 1 1 10 10 ILE CG2 C 13 15.685 0.2 . 1 . . . . 10 ILE CG2 . 11425 1 95 . 1 1 10 10 ILE N N 15 130.212 0.2 . 1 . . . . 10 ILE N . 11425 1 96 . 1 1 11 11 SER H H 1 8.006 0.02 . 1 . . . . 11 SER H . 11425 1 97 . 1 1 11 11 SER HA H 1 5.498 0.02 . 1 . . . . 11 SER HA . 11425 1 98 . 1 1 11 11 SER HB2 H 1 3.077 0.02 . 1 . . . . 11 SER HB2 . 11425 1 99 . 1 1 11 11 SER HB3 H 1 2.910 0.02 . 1 . . . . 11 SER HB3 . 11425 1 100 . 1 1 11 11 SER C C 13 171.700 0.2 . 1 . . . . 11 SER C . 11425 1 101 . 1 1 11 11 SER CA C 13 52.508 0.2 . 1 . . . . 11 SER CA . 11425 1 102 . 1 1 11 11 SER CB C 13 64.309 0.2 . 1 . . . . 11 SER CB . 11425 1 103 . 1 1 11 11 SER N N 15 116.625 0.2 . 1 . . . . 11 SER N . 11425 1 104 . 1 1 12 12 PHE H H 1 8.184 0.02 . 1 . . . . 12 PHE H . 11425 1 105 . 1 1 12 12 PHE HA H 1 4.764 0.02 . 1 . . . . 12 PHE HA . 11425 1 106 . 1 1 12 12 PHE HB2 H 1 2.983 0.02 . 2 . . . . 12 PHE HB2 . 11425 1 107 . 1 1 12 12 PHE HB3 H 1 2.983 0.02 . 2 . . . . 12 PHE HB3 . 11425 1 108 . 1 1 12 12 PHE C C 13 169.500 0.2 . 1 . . . . 12 PHE C . 11425 1 109 . 1 1 12 12 PHE CA C 13 53.260 0.2 . 1 . . . . 12 PHE CA . 11425 1 110 . 1 1 12 12 PHE CB C 13 38.910 0.2 . 1 . . . . 12 PHE CB . 11425 1 111 . 1 1 12 12 PHE N N 15 116.400 0.2 . 1 . . . . 12 PHE N . 11425 1 112 . 1 1 13 13 ASP H H 1 8.474 0.02 . 1 . . . . 13 ASP H . 11425 1 113 . 1 1 13 13 ASP HA H 1 4.914 0.02 . 1 . . . . 13 ASP HA . 11425 1 114 . 1 1 13 13 ASP HB2 H 1 2.503 0.02 . 2 . . . . 13 ASP HB2 . 11425 1 115 . 1 1 13 13 ASP HB3 H 1 2.338 0.02 . 2 . . . . 13 ASP HB3 . 11425 1 116 . 1 1 13 13 ASP C C 13 173.600 0.2 . 1 . . . . 13 ASP C . 11425 1 117 . 1 1 13 13 ASP CA C 13 50.554 0.2 . 1 . . . . 13 ASP CA . 11425 1 118 . 1 1 13 13 ASP CB C 13 38.064 0.2 . 1 . . . . 13 ASP CB . 11425 1 119 . 1 1 13 13 ASP N N 15 120.928 0.2 . 1 . . . . 13 ASP N . 11425 1 120 . 1 1 14 14 ILE H H 1 8.675 0.02 . 1 . . . . 14 ILE H . 11425 1 121 . 1 1 14 14 ILE HA H 1 4.266 0.02 . 1 . . . . 14 ILE HA . 11425 1 122 . 1 1 14 14 ILE HB H 1 1.445 0.02 . 1 . . . . 14 ILE HB . 11425 1 123 . 1 1 14 14 ILE HD11 H 1 0.524 0.02 . 1 . . . . 14 ILE MD . 11425 1 124 . 1 1 14 14 ILE HD12 H 1 0.524 0.02 . 1 . . . . 14 ILE MD . 11425 1 125 . 1 1 14 14 ILE HD13 H 1 0.524 0.02 . 1 . . . . 14 ILE MD . 11425 1 126 . 1 1 14 14 ILE HG21 H 1 0.942 0.02 . 1 . . . . 14 ILE MG . 11425 1 127 . 1 1 14 14 ILE HG22 H 1 0.942 0.02 . 1 . . . . 14 ILE MG . 11425 1 128 . 1 1 14 14 ILE HG23 H 1 0.942 0.02 . 1 . . . . 14 ILE MG . 11425 1 129 . 1 1 14 14 ILE C C 13 171.400 0.2 . 1 . . . . 14 ILE C . 11425 1 130 . 1 1 14 14 ILE CA C 13 56.522 0.2 . 1 . . . . 14 ILE CA . 11425 1 131 . 1 1 14 14 ILE CB C 13 36.791 0.2 . 1 . . . . 14 ILE CB . 11425 1 132 . 1 1 14 14 ILE CD1 C 13 11.293 0.2 . 1 . . . . 14 ILE CD1 . 11425 1 133 . 1 1 14 14 ILE CG2 C 13 14.268 0.2 . 1 . . . . 14 ILE CG2 . 11425 1 134 . 1 1 14 14 ILE N N 15 126.638 0.2 . 1 . . . . 14 ILE N . 11425 1 135 . 1 1 15 15 PRO HD2 H 1 3.962 0.02 . 1 . . . . 15 PRO HD2 . 11425 1 136 . 1 1 15 15 PRO HD3 H 1 3.519 0.02 . 1 . . . . 15 PRO HD3 . 11425 1 137 . 1 1 15 15 PRO CD C 13 48.478 0.2 . 1 . . . . 15 PRO CD . 11425 1 138 . 1 1 15 15 PRO N N 15 126.147 0.2 . 1 . . . . 15 PRO N . 11425 1 139 . 1 1 16 16 PRO HA H 1 4.196 0.02 . 1 . . . . 16 PRO HA . 11425 1 140 . 1 1 16 16 PRO HB2 H 1 1.962 0.02 . 2 . . . . 16 PRO HB2 . 11425 1 141 . 1 1 16 16 PRO HB3 H 1 1.962 0.02 . 2 . . . . 16 PRO HB3 . 11425 1 142 . 1 1 16 16 PRO HD2 H 1 3.768 0.02 . 2 . . . . 16 PRO HD2 . 11425 1 143 . 1 1 16 16 PRO HD3 H 1 3.461 0.02 . 2 . . . . 16 PRO HD3 . 11425 1 144 . 1 1 16 16 PRO HG2 H 1 1.565 0.02 . 2 . . . . 16 PRO HG2 . 11425 1 145 . 1 1 16 16 PRO HG3 H 1 1.565 0.02 . 2 . . . . 16 PRO HG3 . 11425 1 146 . 1 1 16 16 PRO CA C 13 60.794 0.2 . 1 . . . . 16 PRO CA . 11425 1 147 . 1 1 16 16 PRO CB C 13 28.720 0.2 . 1 . . . . 16 PRO CB . 11425 1 148 . 1 1 16 16 PRO CD C 13 47.353 0.2 . 1 . . . . 16 PRO CD . 11425 1 149 . 1 1 16 16 PRO CG C 13 25.078 0.2 . 1 . . . . 16 PRO CG . 11425 1 150 . 1 1 16 16 PRO N N 15 128.229 0.2 . 1 . . . . 16 PRO N . 11425 1 151 . 1 1 17 17 GLN H H 1 8.531 0.02 . 1 . . . . 17 GLN H . 11425 1 152 . 1 1 17 17 GLN HA H 1 4.367 0.02 . 1 . . . . 17 GLN HA . 11425 1 153 . 1 1 17 17 GLN HG2 H 1 2.107 0.02 . 2 . . . . 17 GLN HG2 . 11425 1 154 . 1 1 17 17 GLN HG3 H 1 2.107 0.02 . 2 . . . . 17 GLN HG3 . 11425 1 155 . 1 1 17 17 GLN C C 13 171.600 0.2 . 1 . . . . 17 GLN C . 11425 1 156 . 1 1 17 17 GLN CA C 13 50.257 0.2 . 1 . . . . 17 GLN CA . 11425 1 157 . 1 1 17 17 GLN CB C 13 29.600 0.2 . 1 . . . . 17 GLN CB . 11425 1 158 . 1 1 17 17 GLN CG C 13 30.68 0.2 . 1 . . . . 17 GLN CG . 11425 1 159 . 1 1 17 17 GLN N N 15 121.800 0.2 . 1 . . . . 17 GLN N . 11425 1 160 . 1 1 18 18 GLU H H 1 8.471 0.02 . 1 . . . . 18 GLU H . 11425 1 161 . 1 1 18 18 GLU HA H 1 4.862 0.02 . 1 . . . . 18 GLU HA . 11425 1 162 . 1 1 18 18 GLU HB2 H 1 1.747 0.02 . 2 . . . . 18 GLU HB2 . 11425 1 163 . 1 1 18 18 GLU HB3 H 1 1.747 0.02 . 2 . . . . 18 GLU HB3 . 11425 1 164 . 1 1 18 18 GLU HG2 H 1 2.020 0.02 . 2 . . . . 18 GLU HG2 . 11425 1 165 . 1 1 18 18 GLU HG3 H 1 1.833 0.02 . 2 . . . . 18 GLU HG3 . 11425 1 166 . 1 1 18 18 GLU C C 13 173.200 0.2 . 1 . . . . 18 GLU C . 11425 1 167 . 1 1 18 18 GLU CA C 13 53.212 0.2 . 1 . . . . 18 GLU CA . 11425 1 168 . 1 1 18 18 GLU CB C 13 27.260 0.2 . 1 . . . . 18 GLU CB . 11425 1 169 . 1 1 18 18 GLU CG C 13 34.517 0.2 . 1 . . . . 18 GLU CG . 11425 1 170 . 1 1 18 18 GLU N N 15 123.539 0.2 . 1 . . . . 18 GLU N . 11425 1 171 . 1 1 19 19 ILE H H 1 9.041 0.02 . 1 . . . . 19 ILE H . 11425 1 172 . 1 1 19 19 ILE HA H 1 4.220 0.02 . 1 . . . . 19 ILE HA . 11425 1 173 . 1 1 19 19 ILE HB H 1 1.474 0.02 . 1 . . . . 19 ILE HB . 11425 1 174 . 1 1 19 19 ILE HD11 H 1 0.609 0.02 . 1 . . . . 19 ILE MD . 11425 1 175 . 1 1 19 19 ILE HD12 H 1 0.609 0.02 . 1 . . . . 19 ILE MD . 11425 1 176 . 1 1 19 19 ILE HD13 H 1 0.609 0.02 . 1 . . . . 19 ILE MD . 11425 1 177 . 1 1 19 19 ILE HG12 H 1 0.891 0.02 . 2 . . . . 19 ILE HG12 . 11425 1 178 . 1 1 19 19 ILE HG13 H 1 0.891 0.02 . 2 . . . . 19 ILE HG13 . 11425 1 179 . 1 1 19 19 ILE HG21 H 1 0.619 0.02 . 1 . . . . 19 ILE MG . 11425 1 180 . 1 1 19 19 ILE HG22 H 1 0.619 0.02 . 1 . . . . 19 ILE MG . 11425 1 181 . 1 1 19 19 ILE HG23 H 1 0.619 0.02 . 1 . . . . 19 ILE MG . 11425 1 182 . 1 1 19 19 ILE C C 13 169.900 0.2 . 1 . . . . 19 ILE C . 11425 1 183 . 1 1 19 19 ILE CA C 13 56.578 0.2 . 1 . . . . 19 ILE CA . 11425 1 184 . 1 1 19 19 ILE CB C 13 39.850 0.2 . 1 . . . . 19 ILE CB . 11425 1 185 . 1 1 19 19 ILE CD1 C 13 12.084 0.2 . 1 . . . . 19 ILE CD1 . 11425 1 186 . 1 1 19 19 ILE CG1 C 13 25.127 0.2 . 1 . . . . 19 ILE CG1 . 11425 1 187 . 1 1 19 19 ILE CG2 C 13 14.999 0.2 . 1 . . . . 19 ILE CG2 . 11425 1 188 . 1 1 19 19 ILE N N 15 127.551 0.2 . 1 . . . . 19 ILE N . 11425 1 189 . 1 1 20 20 LEU H H 1 7.862 0.02 . 1 . . . . 20 LEU H . 11425 1 190 . 1 1 20 20 LEU HA H 1 4.943 0.02 . 1 . . . . 20 LEU HA . 11425 1 191 . 1 1 20 20 LEU HB2 H 1 1.591 0.02 . 2 . . . . 20 LEU HB2 . 11425 1 192 . 1 1 20 20 LEU HB3 H 1 1.299 0.02 . 2 . . . . 20 LEU HB3 . 11425 1 193 . 1 1 20 20 LEU HD11 H 1 0.713 0.02 . 2 . . . . 20 LEU MD1 . 11425 1 194 . 1 1 20 20 LEU HD12 H 1 0.713 0.02 . 2 . . . . 20 LEU MD1 . 11425 1 195 . 1 1 20 20 LEU HD13 H 1 0.713 0.02 . 2 . . . . 20 LEU MD1 . 11425 1 196 . 1 1 20 20 LEU HD21 H 1 0.713 0.02 . 2 . . . . 20 LEU MD2 . 11425 1 197 . 1 1 20 20 LEU HD22 H 1 0.713 0.02 . 2 . . . . 20 LEU MD2 . 11425 1 198 . 1 1 20 20 LEU HD23 H 1 0.713 0.02 . 2 . . . . 20 LEU MD2 . 11425 1 199 . 1 1 20 20 LEU HG H 1 1.621 0.02 . 1 . . . . 20 LEU HG . 11425 1 200 . 1 1 20 20 LEU C C 13 175.000 0.2 . 1 . . . . 20 LEU C . 11425 1 201 . 1 1 20 20 LEU CA C 13 50.320 0.2 . 1 . . . . 20 LEU CA . 11425 1 202 . 1 1 20 20 LEU CB C 13 41.174 0.2 . 1 . . . . 20 LEU CB . 11425 1 203 . 1 1 20 20 LEU CD1 C 13 22.947 0.2 . 1 . . . . 20 LEU CD1 . 11425 1 204 . 1 1 20 20 LEU CD2 C 13 21.433 0.2 . 1 . . . . 20 LEU CD2 . 11425 1 205 . 1 1 20 20 LEU CG C 13 24.273 0.2 . 1 . . . . 20 LEU CG . 11425 1 206 . 1 1 20 20 LEU N N 15 126.500 0.2 . 1 . . . . 20 LEU N . 11425 1 207 . 1 1 21 21 THR H H 1 8.950 0.02 . 1 . . . . 21 THR H . 11425 1 208 . 1 1 21 21 THR HA H 1 4.650 0.02 . 1 . . . . 21 THR HA . 11425 1 209 . 1 1 21 21 THR HB H 1 5.041 0.02 . 1 . . . . 21 THR HB . 11425 1 210 . 1 1 21 21 THR HG21 H 1 0.778 0.02 . 1 . . . . 21 THR MG . 11425 1 211 . 1 1 21 21 THR HG22 H 1 0.778 0.02 . 1 . . . . 21 THR MG . 11425 1 212 . 1 1 21 21 THR HG23 H 1 0.778 0.02 . 1 . . . . 21 THR MG . 11425 1 213 . 1 1 21 21 THR C C 13 173.700 0.2 . 1 . . . . 21 THR C . 11425 1 214 . 1 1 21 21 THR CA C 13 59.528 0.2 . 1 . . . . 21 THR CA . 11425 1 215 . 1 1 21 21 THR CB C 13 67.321 0.2 . 1 . . . . 21 THR CB . 11425 1 216 . 1 1 21 21 THR CG2 C 13 20.745 0.2 . 1 . . . . 21 THR CG2 . 11425 1 217 . 1 1 21 21 THR N N 15 116.007 0.2 . 1 . . . . 21 THR N . 11425 1 218 . 1 1 22 22 LYS H H 1 8.444 0.02 . 1 . . . . 22 LYS H . 11425 1 219 . 1 1 22 22 LYS HA H 1 3.907 0.02 . 1 . . . . 22 LYS HA . 11425 1 220 . 1 1 22 22 LYS HB2 H 1 1.460 0.02 . 1 . . . . 22 LYS HB2 . 11425 1 221 . 1 1 22 22 LYS HB3 H 1 1.222 0.02 . 1 . . . . 22 LYS HB3 . 11425 1 222 . 1 1 22 22 LYS HD2 H 1 1.438 0.02 . 2 . . . . 22 LYS HD2 . 11425 1 223 . 1 1 22 22 LYS HD3 H 1 1.438 0.02 . 2 . . . . 22 LYS HD3 . 11425 1 224 . 1 1 22 22 LYS HE2 H 1 2.844 0.02 . 2 . . . . 22 LYS HE2 . 11425 1 225 . 1 1 22 22 LYS HE3 H 1 2.844 0.02 . 2 . . . . 22 LYS HE3 . 11425 1 226 . 1 1 22 22 LYS HG2 H 1 1.266 0.02 . 2 . . . . 22 LYS HG2 . 11425 1 227 . 1 1 22 22 LYS HG3 H 1 1.266 0.02 . 2 . . . . 22 LYS HG3 . 11425 1 228 . 1 1 22 22 LYS C C 13 174.300 0.2 . 1 . . . . 22 LYS C . 11425 1 229 . 1 1 22 22 LYS CA C 13 56.710 0.2 . 1 . . . . 22 LYS CA . 11425 1 230 . 1 1 22 22 LYS CB C 13 29.360 0.2 . 1 . . . . 22 LYS CB . 11425 1 231 . 1 1 22 22 LYS CD C 13 26.642 0.2 . 1 . . . . 22 LYS CD . 11425 1 232 . 1 1 22 22 LYS CE C 13 39.362 0.2 . 1 . . . . 22 LYS CE . 11425 1 233 . 1 1 22 22 LYS CG C 13 21.819 0.2 . 1 . . . . 22 LYS CG . 11425 1 234 . 1 1 22 22 LYS N N 15 123.000 0.2 . 1 . . . . 22 LYS N . 11425 1 235 . 1 1 23 23 ASP H H 1 8.648 0.02 . 1 . . . . 23 ASP H . 11425 1 236 . 1 1 23 23 ASP HA H 1 4.548 0.02 . 1 . . . . 23 ASP HA . 11425 1 237 . 1 1 23 23 ASP HB2 H 1 2.942 0.02 . 2 . . . . 23 ASP HB2 . 11425 1 238 . 1 1 23 23 ASP HB3 H 1 2.542 0.02 . 2 . . . . 23 ASP HB3 . 11425 1 239 . 1 1 23 23 ASP C C 13 171.200 0.2 . 1 . . . . 23 ASP C . 11425 1 240 . 1 1 23 23 ASP CA C 13 49.411 0.2 . 1 . . . . 23 ASP CA . 11425 1 241 . 1 1 23 23 ASP CB C 13 34.153 0.2 . 1 . . . . 23 ASP CB . 11425 1 242 . 1 1 23 23 ASP N N 15 111.031 0.2 . 1 . . . . 23 ASP N . 11425 1 243 . 1 1 24 24 SER H H 1 7.900 0.02 . 1 . . . . 24 SER H . 11425 1 244 . 1 1 24 24 SER C C 13 170.740 0.2 . 1 . . . . 24 SER C . 11425 1 245 . 1 1 24 24 SER N N 15 110.500 0.2 . 1 . . . . 24 SER N . 11425 1 246 . 1 1 25 25 VAL H H 1 8.186 0.02 . 1 . . . . 25 VAL H . 11425 1 247 . 1 1 25 25 VAL HA H 1 4.611 0.02 . 1 . . . . 25 VAL HA . 11425 1 248 . 1 1 25 25 VAL HB H 1 1.921 0.02 . 1 . . . . 25 VAL HB . 11425 1 249 . 1 1 25 25 VAL HG11 H 1 0.786 0.02 . 2 . . . . 25 VAL MG1 . 11425 1 250 . 1 1 25 25 VAL HG12 H 1 0.786 0.02 . 2 . . . . 25 VAL MG1 . 11425 1 251 . 1 1 25 25 VAL HG13 H 1 0.786 0.02 . 2 . . . . 25 VAL MG1 . 11425 1 252 . 1 1 25 25 VAL HG21 H 1 0.786 0.02 . 2 . . . . 25 VAL MG2 . 11425 1 253 . 1 1 25 25 VAL HG22 H 1 0.786 0.02 . 2 . . . . 25 VAL MG2 . 11425 1 254 . 1 1 25 25 VAL HG23 H 1 0.786 0.02 . 2 . . . . 25 VAL MG2 . 11425 1 255 . 1 1 25 25 VAL C C 13 172.971 0.2 . 1 . . . . 25 VAL C . 11425 1 256 . 1 1 25 25 VAL CA C 13 58.712 0.2 . 1 . . . . 25 VAL CA . 11425 1 257 . 1 1 25 25 VAL CB C 13 29.668 0.2 . 1 . . . . 25 VAL CB . 11425 1 258 . 1 1 25 25 VAL CG1 C 13 19.299 0.2 . 1 . . . . 25 VAL CG1 . 11425 1 259 . 1 1 25 25 VAL CG2 C 13 18.465 0.2 . 1 . . . . 25 VAL CG2 . 11425 1 260 . 1 1 25 25 VAL N N 15 122.803 0.2 . 1 . . . . 25 VAL N . 11425 1 261 . 1 1 26 26 THR H H 1 8.361 0.02 . 1 . . . . 26 THR H . 11425 1 262 . 1 1 26 26 THR HA H 1 4.808 0.02 . 1 . . . . 26 THR HA . 11425 1 263 . 1 1 26 26 THR HB H 1 3.851 0.02 . 1 . . . . 26 THR HB . 11425 1 264 . 1 1 26 26 THR HG21 H 1 0.979 0.02 . 1 . . . . 26 THR MG . 11425 1 265 . 1 1 26 26 THR HG22 H 1 0.979 0.02 . 1 . . . . 26 THR MG . 11425 1 266 . 1 1 26 26 THR HG23 H 1 0.979 0.02 . 1 . . . . 26 THR MG . 11425 1 267 . 1 1 26 26 THR C C 13 171.166 0.2 . 1 . . . . 26 THR C . 11425 1 268 . 1 1 26 26 THR CA C 13 60.540 0.2 . 1 . . . . 26 THR CA . 11425 1 269 . 1 1 26 26 THR CB C 13 65.921 0.2 . 1 . . . . 26 THR CB . 11425 1 270 . 1 1 26 26 THR CG2 C 13 18.651 0.2 . 1 . . . . 26 THR CG2 . 11425 1 271 . 1 1 26 26 THR N N 15 124.898 0.2 . 1 . . . . 26 THR N . 11425 1 272 . 1 1 27 27 ILE H H 1 8.965 0.02 . 1 . . . . 27 ILE H . 11425 1 273 . 1 1 27 27 ILE HA H 1 4.921 0.02 . 1 . . . . 27 ILE HA . 11425 1 274 . 1 1 27 27 ILE HB H 1 1.613 0.02 . 1 . . . . 27 ILE HB . 11425 1 275 . 1 1 27 27 ILE HD11 H 1 0.469 0.02 . 1 . . . . 27 ILE MD . 11425 1 276 . 1 1 27 27 ILE HD12 H 1 0.469 0.02 . 1 . . . . 27 ILE MD . 11425 1 277 . 1 1 27 27 ILE HD13 H 1 0.469 0.02 . 1 . . . . 27 ILE MD . 11425 1 278 . 1 1 27 27 ILE HG21 H 1 0.641 0.02 . 1 . . . . 27 ILE MG . 11425 1 279 . 1 1 27 27 ILE HG22 H 1 0.641 0.02 . 1 . . . . 27 ILE MG . 11425 1 280 . 1 1 27 27 ILE HG23 H 1 0.641 0.02 . 1 . . . . 27 ILE MG . 11425 1 281 . 1 1 27 27 ILE C C 13 171.400 0.2 . 1 . . . . 27 ILE C . 11425 1 282 . 1 1 27 27 ILE CA C 13 56.253 0.2 . 1 . . . . 27 ILE CA . 11425 1 283 . 1 1 27 27 ILE CB C 13 39.379 0.2 . 1 . . . . 27 ILE CB . 11425 1 284 . 1 1 27 27 ILE CD1 C 13 12.088 0.2 . 1 . . . . 27 ILE CD1 . 11425 1 285 . 1 1 27 27 ILE CG2 C 13 15.925 0.2 . 1 . . . . 27 ILE CG2 . 11425 1 286 . 1 1 27 27 ILE N N 15 120.436 0.2 . 1 . . . . 27 ILE N . 11425 1 287 . 1 1 28 28 SER H H 1 8.319 0.02 . 1 . . . . 28 SER H . 11425 1 288 . 1 1 28 28 SER HA H 1 5.374 0.02 . 1 . . . . 28 SER HA . 11425 1 289 . 1 1 28 28 SER HB2 H 1 3.418 0.02 . 2 . . . . 28 SER HB2 . 11425 1 290 . 1 1 28 28 SER HB3 H 1 3.418 0.02 . 2 . . . . 28 SER HB3 . 11425 1 291 . 1 1 28 28 SER C C 13 171.900 0.2 . 1 . . . . 28 SER C . 11425 1 292 . 1 1 28 28 SER CA C 13 53.799 0.2 . 1 . . . . 28 SER CA . 11425 1 293 . 1 1 28 28 SER CB C 13 61.669 0.2 . 1 . . . . 28 SER CB . 11425 1 294 . 1 1 28 28 SER N N 15 114.296 0.2 . 1 . . . . 28 SER N . 11425 1 295 . 1 1 29 29 VAL H H 1 8.617 0.02 . 1 . . . . 29 VAL H . 11425 1 296 . 1 1 29 29 VAL HA H 1 4.997 0.02 . 1 . . . . 29 VAL HA . 11425 1 297 . 1 1 29 29 VAL HB H 1 1.632 0.02 . 1 . . . . 29 VAL HB . 11425 1 298 . 1 1 29 29 VAL HG11 H 1 0.809 0.02 . 2 . . . . 29 VAL MG1 . 11425 1 299 . 1 1 29 29 VAL HG12 H 1 0.809 0.02 . 2 . . . . 29 VAL MG1 . 11425 1 300 . 1 1 29 29 VAL HG13 H 1 0.809 0.02 . 2 . . . . 29 VAL MG1 . 11425 1 301 . 1 1 29 29 VAL HG21 H 1 0.809 0.02 . 2 . . . . 29 VAL MG2 . 11425 1 302 . 1 1 29 29 VAL HG22 H 1 0.809 0.02 . 2 . . . . 29 VAL MG2 . 11425 1 303 . 1 1 29 29 VAL HG23 H 1 0.809 0.02 . 2 . . . . 29 VAL MG2 . 11425 1 304 . 1 1 29 29 VAL C C 13 170.800 0.2 . 1 . . . . 29 VAL C . 11425 1 305 . 1 1 29 29 VAL CA C 13 57.861 0.2 . 1 . . . . 29 VAL CA . 11425 1 306 . 1 1 29 29 VAL CB C 13 32.797 0.2 . 1 . . . . 29 VAL CB . 11425 1 307 . 1 1 29 29 VAL CG1 C 13 19.250 0.2 . 1 . . . . 29 VAL CG1 . 11425 1 308 . 1 1 29 29 VAL N N 15 125.500 0.2 . 1 . . . . 29 VAL N . 11425 1 309 . 1 1 30 30 ASP H H 1 8.273 0.02 . 1 . . . . 30 ASP H . 11425 1 310 . 1 1 30 30 ASP HA H 1 4.716 0.02 . 1 . . . . 30 ASP HA . 11425 1 311 . 1 1 30 30 ASP HB2 H 1 3.052 0.02 . 1 . . . . 30 ASP HB2 . 11425 1 312 . 1 1 30 30 ASP HB3 H 1 2.336 0.02 . 1 . . . . 30 ASP HB3 . 11425 1 313 . 1 1 30 30 ASP C C 13 172.100 0.2 . 1 . . . . 30 ASP C . 11425 1 314 . 1 1 30 30 ASP CA C 13 49.200 0.2 . 1 . . . . 30 ASP CA . 11425 1 315 . 1 1 30 30 ASP CB C 13 40.100 0.2 . 1 . . . . 30 ASP CB . 11425 1 316 . 1 1 30 30 ASP N N 15 125.857 0.2 . 1 . . . . 30 ASP N . 11425 1 317 . 1 1 31 31 GLY H H 1 7.787 0.02 . 1 . . . . 31 GLY H . 11425 1 318 . 1 1 31 31 GLY HA2 H 1 4.490 0.02 . 2 . . . . 31 GLY HA2 . 11425 1 319 . 1 1 31 31 GLY HA3 H 1 3.880 0.02 . 2 . . . . 31 GLY HA3 . 11425 1 320 . 1 1 31 31 GLY C C 13 168.700 0.2 . 1 . . . . 31 GLY C . 11425 1 321 . 1 1 31 31 GLY CA C 13 43.369 0.2 . 1 . . . . 31 GLY CA . 11425 1 322 . 1 1 31 31 GLY N N 15 103.714 0.2 . 1 . . . . 31 GLY N . 11425 1 323 . 1 1 32 32 VAL H H 1 9.059 0.02 . 1 . . . . 32 VAL H . 11425 1 324 . 1 1 32 32 VAL HA H 1 4.703 0.02 . 1 . . . . 32 VAL HA . 11425 1 325 . 1 1 32 32 VAL HB H 1 1.722 0.02 . 1 . . . . 32 VAL HB . 11425 1 326 . 1 1 32 32 VAL HG11 H 1 0.654 0.02 . 1 . . . . 32 VAL MG1 . 11425 1 327 . 1 1 32 32 VAL HG12 H 1 0.654 0.02 . 1 . . . . 32 VAL MG1 . 11425 1 328 . 1 1 32 32 VAL HG13 H 1 0.654 0.02 . 1 . . . . 32 VAL MG1 . 11425 1 329 . 1 1 32 32 VAL HG21 H 1 0.654 0.02 . 1 . . . . 32 VAL MG2 . 11425 1 330 . 1 1 32 32 VAL HG22 H 1 0.654 0.02 . 1 . . . . 32 VAL MG2 . 11425 1 331 . 1 1 32 32 VAL HG23 H 1 0.654 0.02 . 1 . . . . 32 VAL MG2 . 11425 1 332 . 1 1 32 32 VAL C C 13 170.300 0.2 . 1 . . . . 32 VAL C . 11425 1 333 . 1 1 32 32 VAL CA C 13 58.575 0.2 . 1 . . . . 32 VAL CA . 11425 1 334 . 1 1 32 32 VAL CB C 13 33.441 0.2 . 1 . . . . 32 VAL CB . 11425 1 335 . 1 1 32 32 VAL CG1 C 13 18.629 0.2 . 1 . . . . 32 VAL CG1 . 11425 1 336 . 1 1 32 32 VAL CG2 C 13 18.239 0.2 . 1 . . . . 32 VAL CG2 . 11425 1 337 . 1 1 32 32 VAL N N 15 122.085 0.2 . 1 . . . . 32 VAL N . 11425 1 338 . 1 1 33 33 VAL H H 1 8.110 0.02 . 1 . . . . 33 VAL H . 11425 1 339 . 1 1 33 33 VAL HA H 1 4.365 0.02 . 1 . . . . 33 VAL HA . 11425 1 340 . 1 1 33 33 VAL HB H 1 0.348 0.02 . 1 . . . . 33 VAL HB . 11425 1 341 . 1 1 33 33 VAL HG11 H 1 0.538 0.02 . 2 . . . . 33 VAL MG1 . 11425 1 342 . 1 1 33 33 VAL HG12 H 1 0.538 0.02 . 2 . . . . 33 VAL MG1 . 11425 1 343 . 1 1 33 33 VAL HG13 H 1 0.538 0.02 . 2 . . . . 33 VAL MG1 . 11425 1 344 . 1 1 33 33 VAL HG21 H 1 0.538 0.02 . 2 . . . . 33 VAL MG2 . 11425 1 345 . 1 1 33 33 VAL HG22 H 1 0.538 0.02 . 2 . . . . 33 VAL MG2 . 11425 1 346 . 1 1 33 33 VAL HG23 H 1 0.538 0.02 . 2 . . . . 33 VAL MG2 . 11425 1 347 . 1 1 33 33 VAL CA C 13 57.916 0.2 . 1 . . . . 33 VAL CA . 11425 1 348 . 1 1 33 33 VAL CB C 13 30.967 0.2 . 1 . . . . 33 VAL CB . 11425 1 349 . 1 1 33 33 VAL CG1 C 13 19.690 0.2 . 1 . . . . 33 VAL CG1 . 11425 1 350 . 1 1 33 33 VAL CG2 C 13 19.143 0.2 . 1 . . . . 33 VAL CG2 . 11425 1 351 . 1 1 33 33 VAL N N 15 124.750 0.2 . 1 . . . . 33 VAL N . 11425 1 352 . 1 1 34 34 TYR H H 1 8.477 0.02 . 1 . . . . 34 TYR H . 11425 1 353 . 1 1 34 34 TYR HA H 1 5.176 0.02 . 1 . . . . 34 TYR HA . 11425 1 354 . 1 1 34 34 TYR HB2 H 1 2.589 0.02 . 2 . . . . 34 TYR HB2 . 11425 1 355 . 1 1 34 34 TYR HB3 H 1 2.589 0.02 . 2 . . . . 34 TYR HB3 . 11425 1 356 . 1 1 34 34 TYR HD1 H 1 6.681 0.02 . 1 . . . . 34 TYR HD1 . 11425 1 357 . 1 1 34 34 TYR HD2 H 1 6.681 0.02 . 1 . . . . 34 TYR HD2 . 11425 1 358 . 1 1 34 34 TYR HE1 H 1 6.438 0.02 . 1 . . . . 34 TYR HE1 . 11425 1 359 . 1 1 34 34 TYR HE2 H 1 6.438 0.02 . 1 . . . . 34 TYR HE2 . 11425 1 360 . 1 1 34 34 TYR C C 13 173.000 0.2 . 1 . . . . 34 TYR C . 11425 1 361 . 1 1 34 34 TYR CA C 13 53.210 0.2 . 1 . . . . 34 TYR CA . 11425 1 362 . 1 1 34 34 TYR CB C 13 36.810 0.2 . 1 . . . . 34 TYR CB . 11425 1 363 . 1 1 34 34 TYR CD1 C 13 130.500 0.2 . 1 . . . . 34 TYR CD1 . 11425 1 364 . 1 1 34 34 TYR CD2 C 13 130.500 0.2 . 1 . . . . 34 TYR CD2 . 11425 1 365 . 1 1 34 34 TYR CE1 C 13 115.100 0.2 . 1 . . . . 34 TYR CE1 . 11425 1 366 . 1 1 34 34 TYR CE2 C 13 115.100 0.2 . 1 . . . . 34 TYR CE2 . 11425 1 367 . 1 1 34 34 TYR N N 15 123.600 0.2 . 1 . . . . 34 TYR N . 11425 1 368 . 1 1 35 35 TYR H H 1 9.828 0.02 . 1 . . . . 35 TYR H . 11425 1 369 . 1 1 35 35 TYR HA H 1 5.504 0.02 . 1 . . . . 35 TYR HA . 11425 1 370 . 1 1 35 35 TYR HB2 H 1 3.057 0.02 . 2 . . . . 35 TYR HB2 . 11425 1 371 . 1 1 35 35 TYR HB3 H 1 2.463 0.02 . 2 . . . . 35 TYR HB3 . 11425 1 372 . 1 1 35 35 TYR HD1 H 1 6.915 0.02 . 1 . . . . 35 TYR HD1 . 11425 1 373 . 1 1 35 35 TYR HD2 H 1 6.915 0.02 . 1 . . . . 35 TYR HD2 . 11425 1 374 . 1 1 35 35 TYR HE1 H 1 6.551 0.02 . 1 . . . . 35 TYR HE1 . 11425 1 375 . 1 1 35 35 TYR HE2 H 1 6.551 0.02 . 1 . . . . 35 TYR HE2 . 11425 1 376 . 1 1 35 35 TYR C C 13 172.4 0.2 . 1 . . . . 35 TYR C . 11425 1 377 . 1 1 35 35 TYR CA C 13 53.156 0.2 . 1 . . . . 35 TYR CA . 11425 1 378 . 1 1 35 35 TYR CB C 13 39.581 0.2 . 1 . . . . 35 TYR CB . 11425 1 379 . 1 1 35 35 TYR CD1 C 13 130.500 0.2 . 1 . . . . 35 TYR CD1 . 11425 1 380 . 1 1 35 35 TYR CD2 C 13 130.500 0.2 . 1 . . . . 35 TYR CD2 . 11425 1 381 . 1 1 35 35 TYR CE1 C 13 114.700 0.2 . 1 . . . . 35 TYR CE1 . 11425 1 382 . 1 1 35 35 TYR CE2 C 13 114.700 0.2 . 1 . . . . 35 TYR CE2 . 11425 1 383 . 1 1 35 35 TYR N N 15 123.400 0.2 . 1 . . . . 35 TYR N . 11425 1 384 . 1 1 36 36 ARG H H 1 9.272 0.02 . 1 . . . . 36 ARG H . 11425 1 385 . 1 1 36 36 ARG HA H 1 4.806 0.02 . 1 . . . . 36 ARG HA . 11425 1 386 . 1 1 36 36 ARG HB2 H 1 1.572 0.02 . 2 . . . . 36 ARG HB2 . 11425 1 387 . 1 1 36 36 ARG HB3 H 1 1.572 0.02 . 2 . . . . 36 ARG HB3 . 11425 1 388 . 1 1 36 36 ARG HD2 H 1 3.002 0.02 . 2 . . . . 36 ARG HD2 . 11425 1 389 . 1 1 36 36 ARG HD3 H 1 3.002 0.02 . 2 . . . . 36 ARG HD3 . 11425 1 390 . 1 1 36 36 ARG HG2 H 1 1.246 0.02 . 2 . . . . 36 ARG HG2 . 11425 1 391 . 1 1 36 36 ARG HG3 H 1 1.246 0.02 . 2 . . . . 36 ARG HG3 . 11425 1 392 . 1 1 36 36 ARG C C 13 172.400 0.2 . 1 . . . . 36 ARG C . 11425 1 393 . 1 1 36 36 ARG CA C 13 51.430 0.2 . 1 . . . . 36 ARG CA . 11425 1 394 . 1 1 36 36 ARG CB C 13 31.693 0.2 . 1 . . . . 36 ARG CB . 11425 1 395 . 1 1 36 36 ARG CD C 13 40.719 0.2 . 1 . . . . 36 ARG CD . 11425 1 396 . 1 1 36 36 ARG CG C 13 24.343 0.2 . 1 . . . . 36 ARG CG . 11425 1 397 . 1 1 36 36 ARG N N 15 116.243 0.2 . 1 . . . . 36 ARG N . 11425 1 398 . 1 1 37 37 VAL H H 1 9.172 0.02 . 1 . . . . 37 VAL H . 11425 1 399 . 1 1 37 37 VAL HA H 1 4.100 0.02 . 1 . . . . 37 VAL HA . 11425 1 400 . 1 1 37 37 VAL HB H 1 2.042 0.02 . 1 . . . . 37 VAL HB . 11425 1 401 . 1 1 37 37 VAL HG11 H 1 0.922 0.02 . 2 . . . . 37 VAL MG1 . 11425 1 402 . 1 1 37 37 VAL HG12 H 1 0.922 0.02 . 2 . . . . 37 VAL MG1 . 11425 1 403 . 1 1 37 37 VAL HG13 H 1 0.922 0.02 . 2 . . . . 37 VAL MG1 . 11425 1 404 . 1 1 37 37 VAL HG21 H 1 0.922 0.02 . 2 . . . . 37 VAL MG2 . 11425 1 405 . 1 1 37 37 VAL HG22 H 1 0.922 0.02 . 2 . . . . 37 VAL MG2 . 11425 1 406 . 1 1 37 37 VAL HG23 H 1 0.922 0.02 . 2 . . . . 37 VAL MG2 . 11425 1 407 . 1 1 37 37 VAL C C 13 172.700 0.2 . 1 . . . . 37 VAL C . 11425 1 408 . 1 1 37 37 VAL CA C 13 60.656 0.2 . 1 . . . . 37 VAL CA . 11425 1 409 . 1 1 37 37 VAL CB C 13 29.140 0.2 . 1 . . . . 37 VAL CB . 11425 1 410 . 1 1 37 37 VAL CG1 C 13 18.336 0.2 . 1 . . . . 37 VAL CG1 . 11425 1 411 . 1 1 37 37 VAL CG2 C 13 18.482 0.2 . 1 . . . . 37 VAL CG2 . 11425 1 412 . 1 1 37 37 VAL N N 15 123.893 0.2 . 1 . . . . 37 VAL N . 11425 1 413 . 1 1 38 38 GLN H H 1 8.671 0.02 . 1 . . . . 38 GLN H . 11425 1 414 . 1 1 38 38 GLN HA H 1 4.389 0.02 . 1 . . . . 38 GLN HA . 11425 1 415 . 1 1 38 38 GLN HB2 H 1 1.793 0.02 . 2 . . . . 38 GLN HB2 . 11425 1 416 . 1 1 38 38 GLN HB3 H 1 1.793 0.02 . 2 . . . . 38 GLN HB3 . 11425 1 417 . 1 1 38 38 GLN HE21 H 1 6.785 0.02 . 2 . . . . 38 GLN HE21 . 11425 1 418 . 1 1 38 38 GLN HE22 H 1 7.263 0.02 . 2 . . . . 38 GLN HE22 . 11425 1 419 . 1 1 38 38 GLN HG2 H 1 2.130 0.02 . 2 . . . . 38 GLN HG2 . 11425 1 420 . 1 1 38 38 GLN HG3 H 1 2.130 0.02 . 2 . . . . 38 GLN HG3 . 11425 1 421 . 1 1 38 38 GLN C C 13 172.707 0.2 . 1 . . . . 38 GLN C . 11425 1 422 . 1 1 38 38 GLN CA C 13 53.550 0.2 . 1 . . . . 38 GLN CA . 11425 1 423 . 1 1 38 38 GLN CB C 13 27.460 0.2 . 1 . . . . 38 GLN CB . 11425 1 424 . 1 1 38 38 GLN CG C 13 30.790 0.2 . 1 . . . . 38 GLN CG . 11425 1 425 . 1 1 38 38 GLN N N 15 127.465 0.2 . 1 . . . . 38 GLN N . 11425 1 426 . 1 1 38 38 GLN NE2 N 15 111.700 0.2 . 1 . . . . 38 GLN NE2 . 11425 1 427 . 1 1 39 39 ASN H H 1 8.184 0.02 . 1 . . . . 39 ASN H . 11425 1 428 . 1 1 39 39 ASN HA H 1 4.716 0.02 . 1 . . . . 39 ASN HA . 11425 1 429 . 1 1 39 39 ASN HB2 H 1 2.809 0.02 . 1 . . . . 39 ASN HB2 . 11425 1 430 . 1 1 39 39 ASN HB3 H 1 2.660 0.02 . 1 . . . . 39 ASN HB3 . 11425 1 431 . 1 1 39 39 ASN HD21 H 1 6.962 0.02 . 1 . . . . 39 ASN HD21 . 11425 1 432 . 1 1 39 39 ASN HD22 H 1 7.731 0.02 . 1 . . . . 39 ASN HD22 . 11425 1 433 . 1 1 39 39 ASN C C 13 171.900 0.2 . 1 . . . . 39 ASN C . 11425 1 434 . 1 1 39 39 ASN CA C 13 49.920 0.2 . 1 . . . . 39 ASN CA . 11425 1 435 . 1 1 39 39 ASN CB C 13 36.433 0.2 . 1 . . . . 39 ASN CB . 11425 1 436 . 1 1 39 39 ASN N N 15 118.187 0.2 . 1 . . . . 39 ASN N . 11425 1 437 . 1 1 39 39 ASN ND2 N 15 112.900 0.2 . 1 . . . . 39 ASN ND2 . 11425 1 438 . 1 1 40 40 ALA H H 1 8.804 0.02 . 1 . . . . 40 ALA H . 11425 1 439 . 1 1 40 40 ALA HA H 1 3.976 0.02 . 1 . . . . 40 ALA HA . 11425 1 440 . 1 1 40 40 ALA HB1 H 1 1.333 0.02 . 1 . . . . 40 ALA MB . 11425 1 441 . 1 1 40 40 ALA HB2 H 1 1.333 0.02 . 1 . . . . 40 ALA MB . 11425 1 442 . 1 1 40 40 ALA HB3 H 1 1.333 0.02 . 1 . . . . 40 ALA MB . 11425 1 443 . 1 1 40 40 ALA C C 13 175.800 0.2 . 1 . . . . 40 ALA C . 11425 1 444 . 1 1 40 40 ALA CA C 13 51.680 0.2 . 1 . . . . 40 ALA CA . 11425 1 445 . 1 1 40 40 ALA CB C 13 16.206 0.2 . 1 . . . . 40 ALA CB . 11425 1 446 . 1 1 40 40 ALA N N 15 126.161 0.2 . 1 . . . . 40 ALA N . 11425 1 447 . 1 1 41 41 THR H H 1 7.963 0.02 . 1 . . . . 41 THR H . 11425 1 448 . 1 1 41 41 THR HA H 1 4.005 0.02 . 1 . . . . 41 THR HA . 11425 1 449 . 1 1 41 41 THR HB H 1 4.187 0.02 . 1 . . . . 41 THR HB . 11425 1 450 . 1 1 41 41 THR HG21 H 1 1.103 0.02 . 1 . . . . 41 THR MG . 11425 1 451 . 1 1 41 41 THR HG22 H 1 1.103 0.02 . 1 . . . . 41 THR MG . 11425 1 452 . 1 1 41 41 THR HG23 H 1 1.103 0.02 . 1 . . . . 41 THR MG . 11425 1 453 . 1 1 41 41 THR C C 13 173.100 0.2 . 1 . . . . 41 THR C . 11425 1 454 . 1 1 41 41 THR CA C 13 61.748 0.2 . 1 . . . . 41 THR CA . 11425 1 455 . 1 1 41 41 THR CB C 13 66.153 0.2 . 1 . . . . 41 THR CB . 11425 1 456 . 1 1 41 41 THR CG2 C 13 19.068 0.2 . 1 . . . . 41 THR CG2 . 11425 1 457 . 1 1 41 41 THR N N 15 112.468 0.2 . 1 . . . . 41 THR N . 11425 1 458 . 1 1 42 42 LEU H H 1 7.333 0.02 . 1 . . . . 42 LEU H . 11425 1 459 . 1 1 42 42 LEU HA H 1 4.333 0.02 . 1 . . . . 42 LEU HA . 11425 1 460 . 1 1 42 42 LEU HB2 H 1 1.503 0.02 . 2 . . . . 42 LEU HB2 . 11425 1 461 . 1 1 42 42 LEU HB3 H 1 1.503 0.02 . 2 . . . . 42 LEU HB3 . 11425 1 462 . 1 1 42 42 LEU HD11 H 1 0.762 0.02 . 1 . . . . 42 LEU MD1 . 11425 1 463 . 1 1 42 42 LEU HD12 H 1 0.762 0.02 . 1 . . . . 42 LEU MD1 . 11425 1 464 . 1 1 42 42 LEU HD13 H 1 0.762 0.02 . 1 . . . . 42 LEU MD1 . 11425 1 465 . 1 1 42 42 LEU HD21 H 1 0.762 0.02 . 1 . . . . 42 LEU MD2 . 11425 1 466 . 1 1 42 42 LEU HD22 H 1 0.762 0.02 . 1 . . . . 42 LEU MD2 . 11425 1 467 . 1 1 42 42 LEU HD23 H 1 0.762 0.02 . 1 . . . . 42 LEU MD2 . 11425 1 468 . 1 1 42 42 LEU HG H 1 1.511 0.02 . 1 . . . . 42 LEU HG . 11425 1 469 . 1 1 42 42 LEU C C 13 175.200 0.2 . 1 . . . . 42 LEU C . 11425 1 470 . 1 1 42 42 LEU CA C 13 53.610 0.2 . 1 . . . . 42 LEU CA . 11425 1 471 . 1 1 42 42 LEU CB C 13 39.413 0.2 . 1 . . . . 42 LEU CB . 11425 1 472 . 1 1 42 42 LEU CD1 C 13 22.10 0.2 . 1 . . . . 42 LEU CD1 . 11425 1 473 . 1 1 42 42 LEU CD2 C 13 20.45 0.2 . 1 . . . . 42 LEU CD2 . 11425 1 474 . 1 1 42 42 LEU CG C 13 24.28 0.2 . 1 . . . . 42 LEU CG . 11425 1 475 . 1 1 42 42 LEU N N 15 121.765 0.2 . 1 . . . . 42 LEU N . 11425 1 476 . 1 1 43 43 ALA H H 1 7.801 0.02 . 1 . . . . 43 ALA H . 11425 1 477 . 1 1 43 43 ALA HA H 1 4.290 0.02 . 1 . . . . 43 ALA HA . 11425 1 478 . 1 1 43 43 ALA HB1 H 1 1.392 0.02 . 1 . . . . 43 ALA MB . 11425 1 479 . 1 1 43 43 ALA HB2 H 1 1.392 0.02 . 1 . . . . 43 ALA MB . 11425 1 480 . 1 1 43 43 ALA HB3 H 1 1.392 0.02 . 1 . . . . 43 ALA MB . 11425 1 481 . 1 1 43 43 ALA C C 13 176.000 0.2 . 1 . . . . 43 ALA C . 11425 1 482 . 1 1 43 43 ALA CA C 13 51.379 0.2 . 1 . . . . 43 ALA CA . 11425 1 483 . 1 1 43 43 ALA CB C 13 16.243 0.2 . 1 . . . . 43 ALA CB . 11425 1 484 . 1 1 43 43 ALA N N 15 122.330 0.2 . 1 . . . . 43 ALA N . 11425 1 485 . 1 1 44 44 VAL H H 1 7.612 0.02 . 1 . . . . 44 VAL H . 11425 1 486 . 1 1 44 44 VAL HA H 1 3.974 0.02 . 1 . . . . 44 VAL HA . 11425 1 487 . 1 1 44 44 VAL HB H 1 2.076 0.02 . 1 . . . . 44 VAL HB . 11425 1 488 . 1 1 44 44 VAL HG11 H 1 0.869 0.02 . 2 . . . . 44 VAL MG1 . 11425 1 489 . 1 1 44 44 VAL HG12 H 1 0.869 0.02 . 2 . . . . 44 VAL MG1 . 11425 1 490 . 1 1 44 44 VAL HG13 H 1 0.869 0.02 . 2 . . . . 44 VAL MG1 . 11425 1 491 . 1 1 44 44 VAL HG21 H 1 0.869 0.02 . 2 . . . . 44 VAL MG2 . 11425 1 492 . 1 1 44 44 VAL HG22 H 1 0.869 0.02 . 2 . . . . 44 VAL MG2 . 11425 1 493 . 1 1 44 44 VAL HG23 H 1 0.869 0.02 . 2 . . . . 44 VAL MG2 . 11425 1 494 . 1 1 44 44 VAL C C 13 174.100 0.2 . 1 . . . . 44 VAL C . 11425 1 495 . 1 1 44 44 VAL CA C 13 60.650 0.2 . 1 . . . . 44 VAL CA . 11425 1 496 . 1 1 44 44 VAL CB C 13 29.463 0.2 . 1 . . . . 44 VAL CB . 11425 1 497 . 1 1 44 44 VAL CG1 C 13 18.343 0.2 . 1 . . . . 44 VAL CG1 . 11425 1 498 . 1 1 44 44 VAL N N 15 115.156 0.2 . 1 . . . . 44 VAL N . 11425 1 499 . 1 1 45 45 ALA H H 1 7.817 0.02 . 1 . . . . 45 ALA H . 11425 1 500 . 1 1 45 45 ALA HA H 1 4.172 0.02 . 1 . . . . 45 ALA HA . 11425 1 501 . 1 1 45 45 ALA HB1 H 1 1.329 0.02 . 1 . . . . 45 ALA MB . 11425 1 502 . 1 1 45 45 ALA HB2 H 1 1.329 0.02 . 1 . . . . 45 ALA MB . 11425 1 503 . 1 1 45 45 ALA HB3 H 1 1.329 0.02 . 1 . . . . 45 ALA MB . 11425 1 504 . 1 1 45 45 ALA C C 13 175.400 0.2 . 1 . . . . 45 ALA C . 11425 1 505 . 1 1 45 45 ALA CA C 13 50.781 0.2 . 1 . . . . 45 ALA CA . 11425 1 506 . 1 1 45 45 ALA CB C 13 16.440 0.2 . 1 . . . . 45 ALA CB . 11425 1 507 . 1 1 45 45 ALA N N 15 123.140 0.2 . 1 . . . . 45 ALA N . 11425 1 508 . 1 1 46 46 ASN H H 1 7.859 0.02 . 1 . . . . 46 ASN H . 11425 1 509 . 1 1 46 46 ASN HA H 1 4.637 0.02 . 1 . . . . 46 ASN HA . 11425 1 510 . 1 1 46 46 ASN HB2 H 1 2.721 0.02 . 2 . . . . 46 ASN HB2 . 11425 1 511 . 1 1 46 46 ASN HB3 H 1 2.721 0.02 . 2 . . . . 46 ASN HB3 . 11425 1 512 . 1 1 46 46 ASN HD21 H 1 6.801 0.02 . 2 . . . . 46 ASN HD21 . 11425 1 513 . 1 1 46 46 ASN HD22 H 1 7.484 0.02 . 2 . . . . 46 ASN HD22 . 11425 1 514 . 1 1 46 46 ASN C C 13 172.600 0.2 . 1 . . . . 46 ASN C . 11425 1 515 . 1 1 46 46 ASN CA C 13 50.953 0.2 . 1 . . . . 46 ASN CA . 11425 1 516 . 1 1 46 46 ASN CB C 13 36.690 0.2 . 1 . . . . 46 ASN CB . 11425 1 517 . 1 1 46 46 ASN N N 15 115.325 0.2 . 1 . . . . 46 ASN N . 11425 1 518 . 1 1 46 46 ASN ND2 N 15 113.000 0.2 . 1 . . . . 46 ASN ND2 . 11425 1 519 . 1 1 47 47 ILE H H 1 7.772 0.02 . 1 . . . . 47 ILE H . 11425 1 520 . 1 1 47 47 ILE HA H 1 4.026 0.02 . 1 . . . . 47 ILE HA . 11425 1 521 . 1 1 47 47 ILE HB H 1 1.673 0.02 . 1 . . . . 47 ILE HB . 11425 1 522 . 1 1 47 47 ILE HD11 H 1 0.568 0.02 . 1 . . . . 47 ILE MD . 11425 1 523 . 1 1 47 47 ILE HD12 H 1 0.568 0.02 . 1 . . . . 47 ILE MD . 11425 1 524 . 1 1 47 47 ILE HD13 H 1 0.568 0.02 . 1 . . . . 47 ILE MD . 11425 1 525 . 1 1 47 47 ILE HG12 H 1 1.171 0.02 . 2 . . . . 47 ILE HG12 . 11425 1 526 . 1 1 47 47 ILE HG13 H 1 1.171 0.02 . 2 . . . . 47 ILE HG13 . 11425 1 527 . 1 1 47 47 ILE HG21 H 1 0.643 0.02 . 1 . . . . 47 ILE MG . 11425 1 528 . 1 1 47 47 ILE HG22 H 1 0.643 0.02 . 1 . . . . 47 ILE MG . 11425 1 529 . 1 1 47 47 ILE HG23 H 1 0.643 0.02 . 1 . . . . 47 ILE MG . 11425 1 530 . 1 1 47 47 ILE C C 13 173.200 0.2 . 1 . . . . 47 ILE C . 11425 1 531 . 1 1 47 47 ILE CA C 13 58.757 0.2 . 1 . . . . 47 ILE CA . 11425 1 532 . 1 1 47 47 ILE CB C 13 36.134 0.2 . 1 . . . . 47 ILE CB . 11425 1 533 . 1 1 47 47 ILE CD1 C 13 10.473 0.2 . 1 . . . . 47 ILE CD1 . 11425 1 534 . 1 1 47 47 ILE CG1 C 13 25.231 0.2 . 1 . . . . 47 ILE CG1 . 11425 1 535 . 1 1 47 47 ILE CG2 C 13 14.923 0.2 . 1 . . . . 47 ILE CG2 . 11425 1 536 . 1 1 47 47 ILE N N 15 120.048 0.2 . 1 . . . . 47 ILE N . 11425 1 537 . 1 1 48 48 THR H H 1 7.853 0.02 . 1 . . . . 48 THR H . 11425 1 538 . 1 1 48 48 THR HA H 1 4.008 0.02 . 1 . . . . 48 THR HA . 11425 1 539 . 1 1 48 48 THR HB H 1 3.995 0.02 . 1 . . . . 48 THR HB . 11425 1 540 . 1 1 48 48 THR HG21 H 1 1.030 0.02 . 1 . . . . 48 THR MG . 11425 1 541 . 1 1 48 48 THR HG22 H 1 1.030 0.02 . 1 . . . . 48 THR MG . 11425 1 542 . 1 1 48 48 THR HG23 H 1 1.030 0.02 . 1 . . . . 48 THR MG . 11425 1 543 . 1 1 48 48 THR C C 13 172.200 0.2 . 1 . . . . 48 THR C . 11425 1 544 . 1 1 48 48 THR CA C 13 60.968 0.2 . 1 . . . . 48 THR CA . 11425 1 545 . 1 1 48 48 THR CB C 13 66.117 0.2 . 1 . . . . 48 THR CB . 11425 1 546 . 1 1 48 48 THR CG2 C 13 18.944 0.2 . 1 . . . . 48 THR CG2 . 11425 1 547 . 1 1 48 48 THR N N 15 116.317 0.2 . 1 . . . . 48 THR N . 11425 1 548 . 1 1 49 49 ASN H H 1 7.928 0.02 . 1 . . . . 49 ASN H . 11425 1 549 . 1 1 49 49 ASN HA H 1 4.450 0.02 . 1 . . . . 49 ASN HA . 11425 1 550 . 1 1 49 49 ASN HB2 H 1 2.620 0.02 . 2 . . . . 49 ASN HB2 . 11425 1 551 . 1 1 49 49 ASN HB3 H 1 2.620 0.02 . 2 . . . . 49 ASN HB3 . 11425 1 552 . 1 1 49 49 ASN HD21 H 1 6.901 0.02 . 2 . . . . 49 ASN HD21 . 11425 1 553 . 1 1 49 49 ASN HD22 H 1 7.535 0.02 . 2 . . . . 49 ASN HD22 . 11425 1 554 . 1 1 49 49 ASN C C 13 173.100 0.2 . 1 . . . . 49 ASN C . 11425 1 555 . 1 1 49 49 ASN CA C 13 50.971 0.2 . 1 . . . . 49 ASN CA . 11425 1 556 . 1 1 49 49 ASN CB C 13 36.010 0.2 . 1 . . . . 49 ASN CB . 11425 1 557 . 1 1 49 49 ASN N N 15 119.914 0.2 . 1 . . . . 49 ASN N . 11425 1 558 . 1 1 49 49 ASN ND2 N 15 113.200 0.2 . 1 . . . . 49 ASN ND2 . 11425 1 559 . 1 1 50 50 ALA H H 1 8.405 0.02 . 1 . . . . 50 ALA H . 11425 1 560 . 1 1 50 50 ALA HA H 1 3.410 0.02 . 1 . . . . 50 ALA HA . 11425 1 561 . 1 1 50 50 ALA HB1 H 1 1.314 0.02 . 1 . . . . 50 ALA MB . 11425 1 562 . 1 1 50 50 ALA HB2 H 1 1.314 0.02 . 1 . . . . 50 ALA MB . 11425 1 563 . 1 1 50 50 ALA HB3 H 1 1.314 0.02 . 1 . . . . 50 ALA MB . 11425 1 564 . 1 1 50 50 ALA C C 13 176.624 0.2 . 1 . . . . 50 ALA C . 11425 1 565 . 1 1 50 50 ALA CA C 13 52.356 0.2 . 1 . . . . 50 ALA CA . 11425 1 566 . 1 1 50 50 ALA CB C 13 15.831 0.2 . 1 . . . . 50 ALA CB . 11425 1 567 . 1 1 50 50 ALA N N 15 125.200 0.2 . 1 . . . . 50 ALA N . 11425 1 568 . 1 1 51 51 ASP H H 1 8.354 0.02 . 1 . . . . 51 ASP H . 11425 1 569 . 1 1 51 51 ASP HA H 1 4.006 0.02 . 1 . . . . 51 ASP HA . 11425 1 570 . 1 1 51 51 ASP HB2 H 1 2.573 0.02 . 2 . . . . 51 ASP HB2 . 11425 1 571 . 1 1 51 51 ASP HB3 H 1 2.573 0.02 . 2 . . . . 51 ASP HB3 . 11425 1 572 . 1 1 51 51 ASP C C 13 174.611 0.2 . 1 . . . . 51 ASP C . 11425 1 573 . 1 1 51 51 ASP CA C 13 55.179 0.2 . 1 . . . . 51 ASP CA . 11425 1 574 . 1 1 51 51 ASP CB C 13 38.915 0.2 . 1 . . . . 51 ASP CB . 11425 1 575 . 1 1 51 51 ASP N N 15 120.333 0.2 . 1 . . . . 51 ASP N . 11425 1 576 . 1 1 52 52 SER H H 1 7.935 0.02 . 1 . . . . 52 SER H . 11425 1 577 . 1 1 52 52 SER HA H 1 4.684 0.02 . 1 . . . . 52 SER HA . 11425 1 578 . 1 1 52 52 SER HB2 H 1 3.700 0.02 . 1 . . . . 52 SER HB2 . 11425 1 579 . 1 1 52 52 SER HB3 H 1 3.655 0.02 . 1 . . . . 52 SER HB3 . 11425 1 580 . 1 1 52 52 SER C C 13 173.792 0.2 . 1 . . . . 52 SER C . 11425 1 581 . 1 1 52 52 SER CA C 13 58.715 0.2 . 1 . . . . 52 SER CA . 11425 1 582 . 1 1 52 52 SER CB C 13 59.749 0.2 . 1 . . . . 52 SER CB . 11425 1 583 . 1 1 52 52 SER N N 15 114.489 0.2 . 1 . . . . 52 SER N . 11425 1 584 . 1 1 53 53 ALA H H 1 8.007 0.02 . 1 . . . . 53 ALA H . 11425 1 585 . 1 1 53 53 ALA HA H 1 3.749 0.02 . 1 . . . . 53 ALA HA . 11425 1 586 . 1 1 53 53 ALA HB1 H 1 0.541 0.02 . 1 . . . . 53 ALA MB . 11425 1 587 . 1 1 53 53 ALA HB2 H 1 0.541 0.02 . 1 . . . . 53 ALA MB . 11425 1 588 . 1 1 53 53 ALA HB3 H 1 0.541 0.02 . 1 . . . . 53 ALA MB . 11425 1 589 . 1 1 53 53 ALA C C 13 177.787 0.2 . 1 . . . . 53 ALA C . 11425 1 590 . 1 1 53 53 ALA CA C 13 52.301 0.2 . 1 . . . . 53 ALA CA . 11425 1 591 . 1 1 53 53 ALA CB C 13 14.958 0.2 . 1 . . . . 53 ALA CB . 11425 1 592 . 1 1 53 53 ALA N N 15 123.165 0.2 . 1 . . . . 53 ALA N . 11425 1 593 . 1 1 54 54 THR H H 1 7.762 0.02 . 1 . . . . 54 THR H . 11425 1 594 . 1 1 54 54 THR HA H 1 4.361 0.02 . 1 . . . . 54 THR HA . 11425 1 595 . 1 1 54 54 THR HB H 1 3.608 0.02 . 1 . . . . 54 THR HB . 11425 1 596 . 1 1 54 54 THR HG21 H 1 0.786 0.02 . 1 . . . . 54 THR MG . 11425 1 597 . 1 1 54 54 THR HG22 H 1 0.786 0.02 . 1 . . . . 54 THR MG . 11425 1 598 . 1 1 54 54 THR HG23 H 1 0.786 0.02 . 1 . . . . 54 THR MG . 11425 1 599 . 1 1 54 54 THR C C 13 176.500 0.2 . 1 . . . . 54 THR C . 11425 1 600 . 1 1 54 54 THR CB C 13 65.307 0.2 . 1 . . . . 54 THR CB . 11425 1 601 . 1 1 54 54 THR CG2 C 13 17.378 0.2 . 1 . . . . 54 THR CG2 . 11425 1 602 . 1 1 54 54 THR N N 15 117.300 0.2 . 1 . . . . 54 THR N . 11425 1 603 . 1 1 55 55 ARG H H 1 7.677 0.02 . 1 . . . . 55 ARG H . 11425 1 604 . 1 1 55 55 ARG HA H 1 3.487 0.02 . 1 . . . . 55 ARG HA . 11425 1 605 . 1 1 55 55 ARG HB2 H 1 1.334 0.02 . 1 . . . . 55 ARG HB2 . 11425 1 606 . 1 1 55 55 ARG HB3 H 1 1.257 0.02 . 1 . . . . 55 ARG HB3 . 11425 1 607 . 1 1 55 55 ARG HD2 H 1 2.460 0.02 . 2 . . . . 55 ARG HD2 . 11425 1 608 . 1 1 55 55 ARG HD3 H 1 2.460 0.02 . 2 . . . . 55 ARG HD3 . 11425 1 609 . 1 1 55 55 ARG C C 13 176.600 0.2 . 1 . . . . 55 ARG C . 11425 1 610 . 1 1 55 55 ARG CA C 13 57.236 0.2 . 1 . . . . 55 ARG CA . 11425 1 611 . 1 1 55 55 ARG CB C 13 26.719 0.2 . 1 . . . . 55 ARG CB . 11425 1 612 . 1 1 55 55 ARG CD C 13 40.631 0.2 . 1 . . . . 55 ARG CD . 11425 1 613 . 1 1 55 55 ARG N N 15 121.800 0.2 . 1 . . . . 55 ARG N . 11425 1 614 . 1 1 56 56 LEU H H 1 7.665 0.02 . 1 . . . . 56 LEU H . 11425 1 615 . 1 1 56 56 LEU HA H 1 3.969 0.02 . 1 . . . . 56 LEU HA . 11425 1 616 . 1 1 56 56 LEU HB2 H 1 1.515 0.02 . 2 . . . . 56 LEU HB2 . 11425 1 617 . 1 1 56 56 LEU HB3 H 1 1.515 0.02 . 2 . . . . 56 LEU HB3 . 11425 1 618 . 1 1 56 56 LEU HD11 H 1 0.721 0.02 . 2 . . . . 56 LEU MD1 . 11425 1 619 . 1 1 56 56 LEU HD12 H 1 0.721 0.02 . 2 . . . . 56 LEU MD1 . 11425 1 620 . 1 1 56 56 LEU HD13 H 1 0.721 0.02 . 2 . . . . 56 LEU MD1 . 11425 1 621 . 1 1 56 56 LEU HD21 H 1 0.721 0.02 . 2 . . . . 56 LEU MD2 . 11425 1 622 . 1 1 56 56 LEU HD22 H 1 0.721 0.02 . 2 . . . . 56 LEU MD2 . 11425 1 623 . 1 1 56 56 LEU HD23 H 1 0.721 0.02 . 2 . . . . 56 LEU MD2 . 11425 1 624 . 1 1 56 56 LEU HG H 1 1.525 0.02 . 1 . . . . 56 LEU HG . 11425 1 625 . 1 1 56 56 LEU C C 13 176.900 0.2 . 1 . . . . 56 LEU C . 11425 1 626 . 1 1 56 56 LEU CA C 13 55.247 0.2 . 1 . . . . 56 LEU CA . 11425 1 627 . 1 1 56 56 LEU CB C 13 38.629 0.2 . 1 . . . . 56 LEU CB . 11425 1 628 . 1 1 56 56 LEU CD1 C 13 21.080 0.2 . 1 . . . . 56 LEU CD1 . 11425 1 629 . 1 1 56 56 LEU CD2 C 13 20.605 0.2 . 1 . . . . 56 LEU CD2 . 11425 1 630 . 1 1 56 56 LEU CG C 13 24.21 0.2 . 1 . . . . 56 LEU CG . 11425 1 631 . 1 1 56 56 LEU N N 15 120.200 0.2 . 1 . . . . 56 LEU N . 11425 1 632 . 1 1 57 57 LEU H H 1 8.071 0.02 . 1 . . . . 57 LEU H . 11425 1 633 . 1 1 57 57 LEU HA H 1 4.081 0.02 . 1 . . . . 57 LEU HA . 11425 1 634 . 1 1 57 57 LEU HB2 H 1 1.392 0.02 . 1 . . . . 57 LEU HB2 . 11425 1 635 . 1 1 57 57 LEU HB3 H 1 1.738 0.02 . 1 . . . . 57 LEU HB3 . 11425 1 636 . 1 1 57 57 LEU HD11 H 1 0.739 0.02 . 1 . . . . 57 LEU MD1 . 11425 1 637 . 1 1 57 57 LEU HD12 H 1 0.739 0.02 . 1 . . . . 57 LEU MD1 . 11425 1 638 . 1 1 57 57 LEU HD13 H 1 0.739 0.02 . 1 . . . . 57 LEU MD1 . 11425 1 639 . 1 1 57 57 LEU HD21 H 1 0.739 0.02 . 1 . . . . 57 LEU MD2 . 11425 1 640 . 1 1 57 57 LEU HD22 H 1 0.739 0.02 . 1 . . . . 57 LEU MD2 . 11425 1 641 . 1 1 57 57 LEU HD23 H 1 0.739 0.02 . 1 . . . . 57 LEU MD2 . 11425 1 642 . 1 1 57 57 LEU HG H 1 1.721 0.02 . 1 . . . . 57 LEU HG . 11425 1 643 . 1 1 57 57 LEU C C 13 178.100 0.2 . 1 . . . . 57 LEU C . 11425 1 644 . 1 1 57 57 LEU CA C 13 53.468 0.2 . 1 . . . . 57 LEU CA . 11425 1 645 . 1 1 57 57 LEU CB C 13 39.384 0.2 . 1 . . . . 57 LEU CB . 11425 1 646 . 1 1 57 57 LEU CD1 C 13 20.439 0.2 . 1 . . . . 57 LEU CD1 . 11425 1 647 . 1 1 57 57 LEU CD2 C 13 23.373 0.2 . 1 . . . . 57 LEU CD2 . 11425 1 648 . 1 1 57 57 LEU CG C 13 24.285 0.2 . 1 . . . . 57 LEU CG . 11425 1 649 . 1 1 57 57 LEU N N 15 120.628 0.2 . 1 . . . . 57 LEU N . 11425 1 650 . 1 1 58 58 ALA H H 1 8.746 0.02 . 1 . . . . 58 ALA H . 11425 1 651 . 1 1 58 58 ALA HA H 1 3.884 0.02 . 1 . . . . 58 ALA HA . 11425 1 652 . 1 1 58 58 ALA HB1 H 1 1.560 0.02 . 1 . . . . 58 ALA MB . 11425 1 653 . 1 1 58 58 ALA HB2 H 1 1.560 0.02 . 1 . . . . 58 ALA MB . 11425 1 654 . 1 1 58 58 ALA HB3 H 1 1.560 0.02 . 1 . . . . 58 ALA MB . 11425 1 655 . 1 1 58 58 ALA C C 13 175.400 0.2 . 1 . . . . 58 ALA C . 11425 1 656 . 1 1 58 58 ALA CA C 13 53.261 0.2 . 1 . . . . 58 ALA CA . 11425 1 657 . 1 1 58 58 ALA CB C 13 15.743 0.2 . 1 . . . . 58 ALA CB . 11425 1 658 . 1 1 58 58 ALA N N 15 123.956 0.2 . 1 . . . . 58 ALA N . 11425 1 659 . 1 1 59 59 GLN H H 1 7.572 0.02 . 1 . . . . 59 GLN H . 11425 1 660 . 1 1 59 59 GLN HA H 1 3.693 0.02 . 1 . . . . 59 GLN HA . 11425 1 661 . 1 1 59 59 GLN HB2 H 1 2.176 0.02 . 2 . . . . 59 GLN HB2 . 11425 1 662 . 1 1 59 59 GLN HB3 H 1 2.176 0.02 . 2 . . . . 59 GLN HB3 . 11425 1 663 . 1 1 59 59 GLN HE21 H 1 6.819 0.02 . 1 . . . . 59 GLN HE21 . 11425 1 664 . 1 1 59 59 GLN HE22 H 1 7.187 0.02 . 1 . . . . 59 GLN HE22 . 11425 1 665 . 1 1 59 59 GLN HG2 H 1 2.415 0.02 . 2 . . . . 59 GLN HG2 . 11425 1 666 . 1 1 59 59 GLN HG3 H 1 2.415 0.02 . 2 . . . . 59 GLN HG3 . 11425 1 667 . 1 1 59 59 GLN C C 13 174.900 0.2 . 1 . . . . 59 GLN C . 11425 1 668 . 1 1 59 59 GLN CA C 13 57.183 0.2 . 1 . . . . 59 GLN CA . 11425 1 669 . 1 1 59 59 GLN CB C 13 26.213 0.2 . 1 . . . . 59 GLN CB . 11425 1 670 . 1 1 59 59 GLN CG C 13 31.663 0.2 . 1 . . . . 59 GLN CG . 11425 1 671 . 1 1 59 59 GLN N N 15 116.508 0.2 . 1 . . . . 59 GLN N . 11425 1 672 . 1 1 59 59 GLN NE2 N 15 110.700 0.2 . 1 . . . . 59 GLN NE2 . 11425 1 673 . 1 1 60 60 THR H H 1 8.178 0.02 . 1 . . . . 60 THR H . 11425 1 674 . 1 1 60 60 THR HA H 1 3.751 0.02 . 1 . . . . 60 THR HA . 11425 1 675 . 1 1 60 60 THR HB H 1 4.095 0.02 . 1 . . . . 60 THR HB . 11425 1 676 . 1 1 60 60 THR HG21 H 1 1.157 0.02 . 1 . . . . 60 THR MG . 11425 1 677 . 1 1 60 60 THR HG22 H 1 1.157 0.02 . 1 . . . . 60 THR MG . 11425 1 678 . 1 1 60 60 THR HG23 H 1 1.157 0.02 . 1 . . . . 60 THR MG . 11425 1 679 . 1 1 60 60 THR C C 13 173.400 0.2 . 1 . . . . 60 THR C . 11425 1 680 . 1 1 60 60 THR CA C 13 63.447 0.2 . 1 . . . . 60 THR CA . 11425 1 681 . 1 1 60 60 THR CB C 13 66.301 0.2 . 1 . . . . 60 THR CB . 11425 1 682 . 1 1 60 60 THR CG2 C 13 19.107 0.2 . 1 . . . . 60 THR CG2 . 11425 1 683 . 1 1 60 60 THR N N 15 114.936 0.2 . 1 . . . . 60 THR N . 11425 1 684 . 1 1 61 61 THR H H 1 8.441 0.02 . 1 . . . . 61 THR H . 11425 1 685 . 1 1 61 61 THR HA H 1 4.026 0.02 . 1 . . . . 61 THR HA . 11425 1 686 . 1 1 61 61 THR HB H 1 3.812 0.02 . 1 . . . . 61 THR HB . 11425 1 687 . 1 1 61 61 THR HG21 H 1 1.127 0.02 . 1 . . . . 61 THR MG . 11425 1 688 . 1 1 61 61 THR HG22 H 1 1.127 0.02 . 1 . . . . 61 THR MG . 11425 1 689 . 1 1 61 61 THR HG23 H 1 1.127 0.02 . 1 . . . . 61 THR MG . 11425 1 690 . 1 1 61 61 THR C C 13 172.300 0.2 . 1 . . . . 61 THR C . 11425 1 691 . 1 1 61 61 THR CA C 13 65.203 0.2 . 1 . . . . 61 THR CA . 11425 1 692 . 1 1 61 61 THR CB C 13 64.814 0.2 . 1 . . . . 61 THR CB . 11425 1 693 . 1 1 61 61 THR CG2 C 13 18.412 0.2 . 1 . . . . 61 THR CG2 . 11425 1 694 . 1 1 61 61 THR N N 15 118.500 0.2 . 1 . . . . 61 THR N . 11425 1 695 . 1 1 62 62 LEU H H 1 7.814 0.02 . 1 . . . . 62 LEU H . 11425 1 696 . 1 1 62 62 LEU HA H 1 3.967 0.02 . 1 . . . . 62 LEU HA . 11425 1 697 . 1 1 62 62 LEU HB2 H 1 1.734 0.02 . 1 . . . . 62 LEU HB2 . 11425 1 698 . 1 1 62 62 LEU HB3 H 1 1.436 0.02 . 1 . . . . 62 LEU HB3 . 11425 1 699 . 1 1 62 62 LEU HD11 H 1 0.639 0.02 . 1 . . . . 62 LEU MD1 . 11425 1 700 . 1 1 62 62 LEU HD12 H 1 0.639 0.02 . 1 . . . . 62 LEU MD1 . 11425 1 701 . 1 1 62 62 LEU HD13 H 1 0.639 0.02 . 1 . . . . 62 LEU MD1 . 11425 1 702 . 1 1 62 62 LEU HD21 H 1 0.639 0.02 . 1 . . . . 62 LEU MD2 . 11425 1 703 . 1 1 62 62 LEU HD22 H 1 0.639 0.02 . 1 . . . . 62 LEU MD2 . 11425 1 704 . 1 1 62 62 LEU HD23 H 1 0.639 0.02 . 1 . . . . 62 LEU MD2 . 11425 1 705 . 1 1 62 62 LEU HG H 1 1.338 0.02 . 1 . . . . 62 LEU HG . 11425 1 706 . 1 1 62 62 LEU C C 13 175.000 0.2 . 1 . . . . 62 LEU C . 11425 1 707 . 1 1 62 62 LEU CA C 13 56.300 0.2 . 1 . . . . 62 LEU CA . 11425 1 708 . 1 1 62 62 LEU CB C 13 39.633 0.2 . 1 . . . . 62 LEU CB . 11425 1 709 . 1 1 62 62 LEU CD1 C 13 21.466 0.2 . 1 . . . . 62 LEU CD1 . 11425 1 710 . 1 1 62 62 LEU CD2 C 13 23.543 0.2 . 1 . . . . 62 LEU CD2 . 11425 1 711 . 1 1 62 62 LEU CG C 13 23.566 0.2 . 1 . . . . 62 LEU CG . 11425 1 712 . 1 1 62 62 LEU N N 15 121.734 0.2 . 1 . . . . 62 LEU N . 11425 1 713 . 1 1 63 63 ARG H H 1 7.295 0.02 . 1 . . . . 63 ARG H . 11425 1 714 . 1 1 63 63 ARG HA H 1 3.703 0.02 . 1 . . . . 63 ARG HA . 11425 1 715 . 1 1 63 63 ARG HB2 H 1 1.825 0.02 . 2 . . . . 63 ARG HB2 . 11425 1 716 . 1 1 63 63 ARG HB3 H 1 1.825 0.02 . 2 . . . . 63 ARG HB3 . 11425 1 717 . 1 1 63 63 ARG HD2 H 1 3.197 0.02 . 2 . . . . 63 ARG HD2 . 11425 1 718 . 1 1 63 63 ARG HD3 H 1 3.241 0.02 . 2 . . . . 63 ARG HD3 . 11425 1 719 . 1 1 63 63 ARG HE H 1 7.279 0.02 . 1 . . . . 63 ARG HE . 11425 1 720 . 1 1 63 63 ARG HG2 H 1 1.173 0.02 . 2 . . . . 63 ARG HG2 . 11425 1 721 . 1 1 63 63 ARG HG3 H 1 1.173 0.02 . 2 . . . . 63 ARG HG3 . 11425 1 722 . 1 1 63 63 ARG C C 13 176.400 0.2 . 1 . . . . 63 ARG C . 11425 1 723 . 1 1 63 63 ARG CA C 13 57.481 0.2 . 1 . . . . 63 ARG CA . 11425 1 724 . 1 1 63 63 ARG CB C 13 27.520 0.2 . 1 . . . . 63 ARG CB . 11425 1 725 . 1 1 63 63 ARG CD C 13 40.710 0.2 . 1 . . . . 63 ARG CD . 11425 1 726 . 1 1 63 63 ARG CG C 13 25.107 0.2 . 1 . . . . 63 ARG CG . 11425 1 727 . 1 1 63 63 ARG N N 15 115.300 0.2 . 1 . . . . 63 ARG N . 11425 1 728 . 1 1 64 64 ASN H H 1 8.315 0.02 . 1 . . . . 64 ASN H . 11425 1 729 . 1 1 64 64 ASN HA H 1 4.315 0.02 . 1 . . . . 64 ASN HA . 11425 1 730 . 1 1 64 64 ASN HB2 H 1 2.866 0.02 . 2 . . . . 64 ASN HB2 . 11425 1 731 . 1 1 64 64 ASN HB3 H 1 2.717 0.02 . 2 . . . . 64 ASN HB3 . 11425 1 732 . 1 1 64 64 ASN HD21 H 1 6.805 0.02 . 2 . . . . 64 ASN HD21 . 11425 1 733 . 1 1 64 64 ASN HD22 H 1 7.522 0.02 . 2 . . . . 64 ASN HD22 . 11425 1 734 . 1 1 64 64 ASN C C 13 175.800 0.2 . 1 . . . . 64 ASN C . 11425 1 735 . 1 1 64 64 ASN CA C 13 52.922 0.2 . 1 . . . . 64 ASN CA . 11425 1 736 . 1 1 64 64 ASN CB C 13 35.178 0.2 . 1 . . . . 64 ASN CB . 11425 1 737 . 1 1 64 64 ASN N N 15 118.450 0.2 . 1 . . . . 64 ASN N . 11425 1 738 . 1 1 64 64 ASN ND2 N 15 111.400 0.2 . 1 . . . . 64 ASN ND2 . 11425 1 739 . 1 1 65 65 VAL H H 1 8.664 0.02 . 1 . . . . 65 VAL H . 11425 1 740 . 1 1 65 65 VAL HA H 1 3.723 0.02 . 1 . . . . 65 VAL HA . 11425 1 741 . 1 1 65 65 VAL HB H 1 1.932 0.02 . 1 . . . . 65 VAL HB . 11425 1 742 . 1 1 65 65 VAL HG11 H 1 0.931 0.02 . 1 . . . . 65 VAL MG1 . 11425 1 743 . 1 1 65 65 VAL HG12 H 1 0.931 0.02 . 1 . . . . 65 VAL MG1 . 11425 1 744 . 1 1 65 65 VAL HG13 H 1 0.931 0.02 . 1 . . . . 65 VAL MG1 . 11425 1 745 . 1 1 65 65 VAL HG21 H 1 0.931 0.02 . 1 . . . . 65 VAL MG2 . 11425 1 746 . 1 1 65 65 VAL HG22 H 1 0.931 0.02 . 1 . . . . 65 VAL MG2 . 11425 1 747 . 1 1 65 65 VAL HG23 H 1 0.931 0.02 . 1 . . . . 65 VAL MG2 . 11425 1 748 . 1 1 65 65 VAL C C 13 176.900 0.2 . 1 . . . . 65 VAL C . 11425 1 749 . 1 1 65 65 VAL CA C 13 63.190 0.2 . 1 . . . . 65 VAL CA . 11425 1 750 . 1 1 65 65 VAL CB C 13 29.020 0.2 . 1 . . . . 65 VAL CB . 11425 1 751 . 1 1 65 65 VAL CG1 C 13 20.140 0.2 . 1 . . . . 65 VAL CG1 . 11425 1 752 . 1 1 65 65 VAL CG2 C 13 18.575 0.2 . 1 . . . . 65 VAL CG2 . 11425 1 753 . 1 1 65 65 VAL N N 15 118.562 0.2 . 1 . . . . 65 VAL N . 11425 1 754 . 1 1 66 66 LEU H H 1 7.889 0.02 . 1 . . . . 66 LEU H . 11425 1 755 . 1 1 66 66 LEU HA H 1 3.855 0.02 . 1 . . . . 66 LEU HA . 11425 1 756 . 1 1 66 66 LEU HB2 H 1 1.849 0.02 . 1 . . . . 66 LEU HB2 . 11425 1 757 . 1 1 66 66 LEU HB3 H 1 1.236 0.02 . 1 . . . . 66 LEU HB3 . 11425 1 758 . 1 1 66 66 LEU HD11 H 1 0.735 0.02 . 2 . . . . 66 LEU MD1 . 11425 1 759 . 1 1 66 66 LEU HD12 H 1 0.735 0.02 . 2 . . . . 66 LEU MD1 . 11425 1 760 . 1 1 66 66 LEU HD13 H 1 0.735 0.02 . 2 . . . . 66 LEU MD1 . 11425 1 761 . 1 1 66 66 LEU HD21 H 1 0.735 0.02 . 2 . . . . 66 LEU MD2 . 11425 1 762 . 1 1 66 66 LEU HD22 H 1 0.735 0.02 . 2 . . . . 66 LEU MD2 . 11425 1 763 . 1 1 66 66 LEU HD23 H 1 0.735 0.02 . 2 . . . . 66 LEU MD2 . 11425 1 764 . 1 1 66 66 LEU HG H 1 1.897 0.02 . 1 . . . . 66 LEU HG . 11425 1 765 . 1 1 66 66 LEU C C 13 175.100 0.2 . 1 . . . . 66 LEU C . 11425 1 766 . 1 1 66 66 LEU CA C 13 55.754 0.2 . 1 . . . . 66 LEU CA . 11425 1 767 . 1 1 66 66 LEU CB C 13 37.494 0.2 . 1 . . . . 66 LEU CB . 11425 1 768 . 1 1 66 66 LEU CD1 C 13 23.904 0.2 . 1 . . . . 66 LEU CD1 . 11425 1 769 . 1 1 66 66 LEU CD2 C 13 21.293 0.2 . 1 . . . . 66 LEU CD2 . 11425 1 770 . 1 1 66 66 LEU CG C 13 24.960 0.2 . 1 . . . . 66 LEU CG . 11425 1 771 . 1 1 66 66 LEU N N 15 119.381 0.2 . 1 . . . . 66 LEU N . 11425 1 772 . 1 1 67 67 GLY H H 1 7.475 0.02 . 1 . . . . 67 GLY H . 11425 1 773 . 1 1 67 67 GLY HA2 H 1 4.255 0.02 . 1 . . . . 67 GLY HA2 . 11425 1 774 . 1 1 67 67 GLY HA3 H 1 3.823 0.02 . 1 . . . . 67 GLY HA3 . 11425 1 775 . 1 1 67 67 GLY C C 13 172.000 0.2 . 1 . . . . 67 GLY C . 11425 1 776 . 1 1 67 67 GLY CA C 13 43.317 0.2 . 1 . . . . 67 GLY CA . 11425 1 777 . 1 1 67 67 GLY N N 15 101.800 0.2 . 1 . . . . 67 GLY N . 11425 1 778 . 1 1 68 68 THR H H 1 7.227 0.02 . 1 . . . . 68 THR H . 11425 1 779 . 1 1 68 68 THR HA H 1 4.370 0.02 . 1 . . . . 68 THR HA . 11425 1 780 . 1 1 68 68 THR HB H 1 4.427 0.02 . 1 . . . . 68 THR HB . 11425 1 781 . 1 1 68 68 THR HG21 H 1 1.245 0.02 . 1 . . . . 68 THR MG . 11425 1 782 . 1 1 68 68 THR HG22 H 1 1.245 0.02 . 1 . . . . 68 THR MG . 11425 1 783 . 1 1 68 68 THR HG23 H 1 1.245 0.02 . 1 . . . . 68 THR MG . 11425 1 784 . 1 1 68 68 THR C C 13 171.300 0.2 . 1 . . . . 68 THR C . 11425 1 785 . 1 1 68 68 THR CA C 13 58.748 0.2 . 1 . . . . 68 THR CA . 11425 1 786 . 1 1 68 68 THR CB C 13 67.486 0.2 . 1 . . . . 68 THR CB . 11425 1 787 . 1 1 68 68 THR CG2 C 13 18.687 0.2 . 1 . . . . 68 THR CG2 . 11425 1 788 . 1 1 68 68 THR N N 15 106.200 0.2 . 1 . . . . 68 THR N . 11425 1 789 . 1 1 69 69 LYS H H 1 7.510 0.02 . 1 . . . . 69 LYS H . 11425 1 790 . 1 1 69 69 LYS HA H 1 4.590 0.02 . 1 . . . . 69 LYS HA . 11425 1 791 . 1 1 69 69 LYS HB2 H 1 1.705 0.02 . 2 . . . . 69 LYS HB2 . 11425 1 792 . 1 1 69 69 LYS HB3 H 1 1.705 0.02 . 2 . . . . 69 LYS HB3 . 11425 1 793 . 1 1 69 69 LYS HD2 H 1 1.433 0.02 . 2 . . . . 69 LYS HD2 . 11425 1 794 . 1 1 69 69 LYS HD3 H 1 1.433 0.02 . 2 . . . . 69 LYS HD3 . 11425 1 795 . 1 1 69 69 LYS HE2 H 1 2.565 0.02 . 2 . . . . 69 LYS HE2 . 11425 1 796 . 1 1 69 69 LYS HE3 H 1 2.565 0.02 . 2 . . . . 69 LYS HE3 . 11425 1 797 . 1 1 69 69 LYS HG2 H 1 1.062 0.02 . 2 . . . . 69 LYS HG2 . 11425 1 798 . 1 1 69 69 LYS HG3 H 1 1.062 0.02 . 2 . . . . 69 LYS HG3 . 11425 1 799 . 1 1 69 69 LYS C C 13 173.400 0.2 . 1 . . . . 69 LYS C . 11425 1 800 . 1 1 69 69 LYS CA C 13 50.020 0.2 . 1 . . . . 69 LYS CA . 11425 1 801 . 1 1 69 69 LYS CB C 13 32.230 0.2 . 1 . . . . 69 LYS CB . 11425 1 802 . 1 1 69 69 LYS CD C 13 25.992 0.2 . 1 . . . . 69 LYS CD . 11425 1 803 . 1 1 69 69 LYS CE C 13 39.549 0.2 . 1 . . . . 69 LYS CE . 11425 1 804 . 1 1 69 69 LYS CG C 13 21.339 0.2 . 1 . . . . 69 LYS CG . 11425 1 805 . 1 1 69 69 LYS N N 15 120.900 0.2 . 1 . . . . 69 LYS N . 11425 1 806 . 1 1 70 70 ASN H H 1 8.843 0.02 . 1 . . . . 70 ASN H . 11425 1 807 . 1 1 70 70 ASN HA H 1 4.837 0.02 . 1 . . . . 70 ASN HA . 11425 1 808 . 1 1 70 70 ASN HB2 H 1 2.775 0.02 . 1 . . . . 70 ASN HB2 . 11425 1 809 . 1 1 70 70 ASN HB3 H 1 2.510 0.02 . 1 . . . . 70 ASN HB3 . 11425 1 810 . 1 1 70 70 ASN HD21 H 1 6.880 0.02 . 2 . . . . 70 ASN HD21 . 11425 1 811 . 1 1 70 70 ASN HD22 H 1 7.583 0.02 . 2 . . . . 70 ASN HD22 . 11425 1 812 . 1 1 70 70 ASN C C 13 174.600 0.2 . 1 . . . . 70 ASN C . 11425 1 813 . 1 1 70 70 ASN CA C 13 49.920 0.2 . 1 . . . . 70 ASN CA . 11425 1 814 . 1 1 70 70 ASN CB C 13 36.363 0.2 . 1 . . . . 70 ASN CB . 11425 1 815 . 1 1 70 70 ASN N N 15 120.400 0.2 . 1 . . . . 70 ASN N . 11425 1 816 . 1 1 70 70 ASN ND2 N 15 112.700 0.2 . 1 . . . . 70 ASN ND2 . 11425 1 817 . 1 1 71 71 LEU H H 1 9.763 0.02 . 1 . . . . 71 LEU H . 11425 1 818 . 1 1 71 71 LEU HA H 1 3.929 0.02 . 1 . . . . 71 LEU HA . 11425 1 819 . 1 1 71 71 LEU HB2 H 1 1.985 0.02 . 1 . . . . 71 LEU HB2 . 11425 1 820 . 1 1 71 71 LEU HB3 H 1 1.399 0.02 . 1 . . . . 71 LEU HB3 . 11425 1 821 . 1 1 71 71 LEU HD11 H 1 0.840 0.02 . 2 . . . . 71 LEU MD1 . 11425 1 822 . 1 1 71 71 LEU HD12 H 1 0.840 0.02 . 2 . . . . 71 LEU MD1 . 11425 1 823 . 1 1 71 71 LEU HD13 H 1 0.840 0.02 . 2 . . . . 71 LEU MD1 . 11425 1 824 . 1 1 71 71 LEU HD21 H 1 0.840 0.02 . 2 . . . . 71 LEU MD2 . 11425 1 825 . 1 1 71 71 LEU HD22 H 1 0.840 0.02 . 2 . . . . 71 LEU MD2 . 11425 1 826 . 1 1 71 71 LEU HD23 H 1 0.840 0.02 . 2 . . . . 71 LEU MD2 . 11425 1 827 . 1 1 71 71 LEU HG H 1 1.423 0.02 . 1 . . . . 71 LEU HG . 11425 1 828 . 1 1 71 71 LEU C C 13 175.200 0.2 . 1 . . . . 71 LEU C . 11425 1 829 . 1 1 71 71 LEU CA C 13 56.680 0.2 . 1 . . . . 71 LEU CA . 11425 1 830 . 1 1 71 71 LEU CB C 13 38.446 0.2 . 1 . . . . 71 LEU CB . 11425 1 831 . 1 1 71 71 LEU CD1 C 13 23.397 0.2 . 1 . . . . 71 LEU CD1 . 11425 1 832 . 1 1 71 71 LEU CG C 13 24.105 0.2 . 1 . . . . 71 LEU CG . 11425 1 833 . 1 1 71 71 LEU N N 15 124.904 0.2 . 1 . . . . 71 LEU N . 11425 1 834 . 1 1 72 72 SER H H 1 9.354 0.02 . 1 . . . . 72 SER H . 11425 1 835 . 1 1 72 72 SER HA H 1 3.771 0.02 . 1 . . . . 72 SER HA . 11425 1 836 . 1 1 72 72 SER HB2 H 1 3.854 0.02 . 2 . . . . 72 SER HB2 . 11425 1 837 . 1 1 72 72 SER HB3 H 1 3.854 0.02 . 2 . . . . 72 SER HB3 . 11425 1 838 . 1 1 72 72 SER C C 13 174.500 0.2 . 1 . . . . 72 SER C . 11425 1 839 . 1 1 72 72 SER CA C 13 59.108 0.2 . 1 . . . . 72 SER CA . 11425 1 840 . 1 1 72 72 SER N N 15 111.786 0.2 . 1 . . . . 72 SER N . 11425 1 841 . 1 1 73 73 GLN H H 1 7.163 0.02 . 1 . . . . 73 GLN H . 11425 1 842 . 1 1 73 73 GLN HA H 1 4.125 0.02 . 1 . . . . 73 GLN HA . 11425 1 843 . 1 1 73 73 GLN HB2 H 1 2.349 0.02 . 1 . . . . 73 GLN HB2 . 11425 1 844 . 1 1 73 73 GLN HB3 H 1 2.031 0.02 . 1 . . . . 73 GLN HB3 . 11425 1 845 . 1 1 73 73 GLN HE21 H 1 6.825 0.02 . 2 . . . . 73 GLN HE21 . 11425 1 846 . 1 1 73 73 GLN HE22 H 1 7.805 0.02 . 2 . . . . 73 GLN HE22 . 11425 1 847 . 1 1 73 73 GLN HG2 H 1 2.344 0.02 . 2 . . . . 73 GLN HG2 . 11425 1 848 . 1 1 73 73 GLN HG3 H 1 2.344 0.02 . 2 . . . . 73 GLN HG3 . 11425 1 849 . 1 1 73 73 GLN C C 13 174.800 0.2 . 1 . . . . 73 GLN C . 11425 1 850 . 1 1 73 73 GLN CA C 13 55.280 0.2 . 1 . . . . 73 GLN CA . 11425 1 851 . 1 1 73 73 GLN CB C 13 27.614 0.2 . 1 . . . . 73 GLN CB . 11425 1 852 . 1 1 73 73 GLN CG C 13 32.686 0.2 . 1 . . . . 73 GLN CG . 11425 1 853 . 1 1 73 73 GLN N N 15 120.300 0.2 . 1 . . . . 73 GLN N . 11425 1 854 . 1 1 73 73 GLN NE2 N 15 113.200 0.2 . 1 . . . . 73 GLN NE2 . 11425 1 855 . 1 1 74 74 ILE H H 1 7.568 0.02 . 1 . . . . 74 ILE H . 11425 1 856 . 1 1 74 74 ILE HA H 1 3.246 0.02 . 1 . . . . 74 ILE HA . 11425 1 857 . 1 1 74 74 ILE HB H 1 1.855 0.02 . 1 . . . . 74 ILE HB . 11425 1 858 . 1 1 74 74 ILE HD11 H 1 0.772 0.02 . 1 . . . . 74 ILE MD . 11425 1 859 . 1 1 74 74 ILE HD12 H 1 0.772 0.02 . 1 . . . . 74 ILE MD . 11425 1 860 . 1 1 74 74 ILE HD13 H 1 0.772 0.02 . 1 . . . . 74 ILE MD . 11425 1 861 . 1 1 74 74 ILE HG12 H 1 0.771 0.02 . 2 . . . . 74 ILE HG12 . 11425 1 862 . 1 1 74 74 ILE HG13 H 1 0.771 0.02 . 2 . . . . 74 ILE HG13 . 11425 1 863 . 1 1 74 74 ILE HG21 H 1 0.627 0.02 . 1 . . . . 74 ILE MG . 11425 1 864 . 1 1 74 74 ILE HG22 H 1 0.627 0.02 . 1 . . . . 74 ILE MG . 11425 1 865 . 1 1 74 74 ILE HG23 H 1 0.627 0.02 . 1 . . . . 74 ILE MG . 11425 1 866 . 1 1 74 74 ILE C C 13 173.500 0.2 . 1 . . . . 74 ILE C . 11425 1 867 . 1 1 74 74 ILE CA C 13 62.671 0.2 . 1 . . . . 74 ILE CA . 11425 1 868 . 1 1 74 74 ILE CB C 13 35.277 0.2 . 1 . . . . 74 ILE CB . 11425 1 869 . 1 1 74 74 ILE CD1 C 13 12.187 0.2 . 1 . . . . 74 ILE CD1 . 11425 1 870 . 1 1 74 74 ILE CG1 C 13 26.753 0.2 . 1 . . . . 74 ILE CG1 . 11425 1 871 . 1 1 74 74 ILE CG2 C 13 13.805 0.2 . 1 . . . . 74 ILE CG2 . 11425 1 872 . 1 1 74 74 ILE N N 15 120.300 0.2 . 1 . . . . 74 ILE N . 11425 1 873 . 1 1 75 75 LEU H H 1 7.662 0.02 . 1 . . . . 75 LEU H . 11425 1 874 . 1 1 75 75 LEU HA H 1 4.006 0.02 . 1 . . . . 75 LEU HA . 11425 1 875 . 1 1 75 75 LEU HB2 H 1 1.689 0.02 . 2 . . . . 75 LEU HB2 . 11425 1 876 . 1 1 75 75 LEU HB3 H 1 1.420 0.02 . 2 . . . . 75 LEU HB3 . 11425 1 877 . 1 1 75 75 LEU HD11 H 1 0.700 0.02 . 2 . . . . 75 LEU MD1 . 11425 1 878 . 1 1 75 75 LEU HD12 H 1 0.700 0.02 . 2 . . . . 75 LEU MD1 . 11425 1 879 . 1 1 75 75 LEU HD13 H 1 0.700 0.02 . 2 . . . . 75 LEU MD1 . 11425 1 880 . 1 1 75 75 LEU HD21 H 1 0.700 0.02 . 2 . . . . 75 LEU MD2 . 11425 1 881 . 1 1 75 75 LEU HD22 H 1 0.700 0.02 . 2 . . . . 75 LEU MD2 . 11425 1 882 . 1 1 75 75 LEU HD23 H 1 0.700 0.02 . 2 . . . . 75 LEU MD2 . 11425 1 883 . 1 1 75 75 LEU HG H 1 1.704 0.02 . 1 . . . . 75 LEU HG . 11425 1 884 . 1 1 75 75 LEU C C 13 177.300 0.2 . 1 . . . . 75 LEU C . 11425 1 885 . 1 1 75 75 LEU CA C 13 54.171 0.2 . 1 . . . . 75 LEU CA . 11425 1 886 . 1 1 75 75 LEU CB C 13 38.775 0.2 . 1 . . . . 75 LEU CB . 11425 1 887 . 1 1 75 75 LEU CD1 C 13 19.365 0.2 . 1 . . . . 75 LEU CD1 . 11425 1 888 . 1 1 75 75 LEU CD2 C 13 22.307 0.2 . 1 . . . . 75 LEU CD2 . 11425 1 889 . 1 1 75 75 LEU CG C 13 23.842 0.2 . 1 . . . . 75 LEU CG . 11425 1 890 . 1 1 75 75 LEU N N 15 112.798 0.2 . 1 . . . . 75 LEU N . 11425 1 891 . 1 1 76 76 SER H H 1 7.822 0.02 . 1 . . . . 76 SER H . 11425 1 892 . 1 1 76 76 SER HA H 1 3.598 0.02 . 1 . . . . 76 SER HA . 11425 1 893 . 1 1 76 76 SER HB2 H 1 4.009 0.02 . 2 . . . . 76 SER HB2 . 11425 1 894 . 1 1 76 76 SER HB3 H 1 3.892 0.02 . 2 . . . . 76 SER HB3 . 11425 1 895 . 1 1 76 76 SER C C 13 173.100 0.2 . 1 . . . . 76 SER C . 11425 1 896 . 1 1 76 76 SER CA C 13 57.689 0.2 . 1 . . . . 76 SER CA . 11425 1 897 . 1 1 76 76 SER CB C 13 61.526 0.2 . 1 . . . . 76 SER CB . 11425 1 898 . 1 1 76 76 SER N N 15 112.300 0.2 . 1 . . . . 76 SER N . 11425 1 899 . 1 1 77 77 ASP H H 1 8.279 0.02 . 1 . . . . 77 ASP H . 11425 1 900 . 1 1 77 77 ASP HA H 1 5.094 0.02 . 1 . . . . 77 ASP HA . 11425 1 901 . 1 1 77 77 ASP HB2 H 1 2.937 0.02 . 1 . . . . 77 ASP HB2 . 11425 1 902 . 1 1 77 77 ASP HB3 H 1 2.640 0.02 . 1 . . . . 77 ASP HB3 . 11425 1 903 . 1 1 77 77 ASP C C 13 173.327 0.2 . 1 . . . . 77 ASP C . 11425 1 904 . 1 1 77 77 ASP CA C 13 50.851 0.2 . 1 . . . . 77 ASP CA . 11425 1 905 . 1 1 77 77 ASP CB C 13 37.710 0.2 . 1 . . . . 77 ASP CB . 11425 1 906 . 1 1 77 77 ASP N N 15 122.700 0.2 . 1 . . . . 77 ASP N . 11425 1 907 . 1 1 78 78 ARG H H 1 7.393 0.02 . 1 . . . . 78 ARG H . 11425 1 908 . 1 1 78 78 ARG HA H 1 3.704 0.02 . 1 . . . . 78 ARG HA . 11425 1 909 . 1 1 78 78 ARG HB2 H 1 1.907 0.02 . 2 . . . . 78 ARG HB2 . 11425 1 910 . 1 1 78 78 ARG HB3 H 1 1.907 0.02 . 2 . . . . 78 ARG HB3 . 11425 1 911 . 1 1 78 78 ARG HD2 H 1 3.116 0.02 . 2 . . . . 78 ARG HD2 . 11425 1 912 . 1 1 78 78 ARG HD3 H 1 3.116 0.02 . 2 . . . . 78 ARG HD3 . 11425 1 913 . 1 1 78 78 ARG HG2 H 1 1.593 0.02 . 2 . . . . 78 ARG HG2 . 11425 1 914 . 1 1 78 78 ARG HG3 H 1 1.593 0.02 . 2 . . . . 78 ARG HG3 . 11425 1 915 . 1 1 78 78 ARG C C 13 174.900 0.2 . 1 . . . . 78 ARG C . 11425 1 916 . 1 1 78 78 ARG CA C 13 57.920 0.2 . 1 . . . . 78 ARG CA . 11425 1 917 . 1 1 78 78 ARG CB C 13 27.944 0.2 . 1 . . . . 78 ARG CB . 11425 1 918 . 1 1 78 78 ARG CD C 13 40.942 0.2 . 1 . . . . 78 ARG CD . 11425 1 919 . 1 1 78 78 ARG CG C 13 24.205 0.2 . 1 . . . . 78 ARG CG . 11425 1 920 . 1 1 78 78 ARG N N 15 119.769 0.2 . 1 . . . . 78 ARG N . 11425 1 921 . 1 1 79 79 GLU H H 1 8.540 0.02 . 1 . . . . 79 GLU H . 11425 1 922 . 1 1 79 79 GLU HA H 1 4.009 0.02 . 1 . . . . 79 GLU HA . 11425 1 923 . 1 1 79 79 GLU HB2 H 1 1.913 0.02 . 2 . . . . 79 GLU HB2 . 11425 1 924 . 1 1 79 79 GLU HB3 H 1 1.913 0.02 . 2 . . . . 79 GLU HB3 . 11425 1 925 . 1 1 79 79 GLU HG2 H 1 2.216 0.02 . 1 . . . . 79 GLU HG2 . 11425 1 926 . 1 1 79 79 GLU HG3 H 1 2.176 0.02 . 1 . . . . 79 GLU HG3 . 11425 1 927 . 1 1 79 79 GLU C C 13 176.100 0.2 . 1 . . . . 79 GLU C . 11425 1 928 . 1 1 79 79 GLU CA C 13 57.293 0.2 . 1 . . . . 79 GLU CA . 11425 1 929 . 1 1 79 79 GLU CB C 13 26.294 0.2 . 1 . . . . 79 GLU CB . 11425 1 930 . 1 1 79 79 GLU CG C 13 34.043 0.2 . 1 . . . . 79 GLU CG . 11425 1 931 . 1 1 79 79 GLU N N 15 118.193 0.2 . 1 . . . . 79 GLU N . 11425 1 932 . 1 1 80 80 GLU H H 1 7.931 0.02 . 1 . . . . 80 GLU H . 11425 1 933 . 1 1 80 80 GLU HA H 1 4.049 0.02 . 1 . . . . 80 GLU HA . 11425 1 934 . 1 1 80 80 GLU HB2 H 1 2.025 0.02 . 2 . . . . 80 GLU HB2 . 11425 1 935 . 1 1 80 80 GLU HB3 H 1 2.025 0.02 . 2 . . . . 80 GLU HB3 . 11425 1 936 . 1 1 80 80 GLU HG2 H 1 2.200 0.02 . 2 . . . . 80 GLU HG2 . 11425 1 937 . 1 1 80 80 GLU HG3 H 1 2.200 0.02 . 2 . . . . 80 GLU HG3 . 11425 1 938 . 1 1 80 80 GLU C C 13 176.496 0.2 . 1 . . . . 80 GLU C . 11425 1 939 . 1 1 80 80 GLU CA C 13 56.440 0.2 . 1 . . . . 80 GLU CA . 11425 1 940 . 1 1 80 80 GLU CB C 13 26.610 0.2 . 1 . . . . 80 GLU CB . 11425 1 941 . 1 1 80 80 GLU CG C 13 33.211 0.2 . 1 . . . . 80 GLU CG . 11425 1 942 . 1 1 80 80 GLU N N 15 122.363 0.2 . 1 . . . . 80 GLU N . 11425 1 943 . 1 1 81 81 ILE H H 1 8.167 0.02 . 1 . . . . 81 ILE H . 11425 1 944 . 1 1 81 81 ILE HA H 1 3.559 0.02 . 1 . . . . 81 ILE HA . 11425 1 945 . 1 1 81 81 ILE HB H 1 1.667 0.02 . 1 . . . . 81 ILE HB . 11425 1 946 . 1 1 81 81 ILE HD11 H 1 0.602 0.02 . 1 . . . . 81 ILE MD . 11425 1 947 . 1 1 81 81 ILE HD12 H 1 0.602 0.02 . 1 . . . . 81 ILE MD . 11425 1 948 . 1 1 81 81 ILE HD13 H 1 0.602 0.02 . 1 . . . . 81 ILE MD . 11425 1 949 . 1 1 81 81 ILE HG12 H 1 1.257 0.02 . 2 . . . . 81 ILE HG12 . 11425 1 950 . 1 1 81 81 ILE HG13 H 1 1.257 0.02 . 2 . . . . 81 ILE HG13 . 11425 1 951 . 1 1 81 81 ILE HG21 H 1 0.681 0.02 . 1 . . . . 81 ILE MG . 11425 1 952 . 1 1 81 81 ILE HG22 H 1 0.681 0.02 . 1 . . . . 81 ILE MG . 11425 1 953 . 1 1 81 81 ILE HG23 H 1 0.681 0.02 . 1 . . . . 81 ILE MG . 11425 1 954 . 1 1 81 81 ILE C C 13 175.751 0.2 . 1 . . . . 81 ILE C . 11425 1 955 . 1 1 81 81 ILE CA C 13 62.322 0.2 . 1 . . . . 81 ILE CA . 11425 1 956 . 1 1 81 81 ILE CB C 13 35.216 0.2 . 1 . . . . 81 ILE CB . 11425 1 957 . 1 1 81 81 ILE CD1 C 13 11.731 0.2 . 1 . . . . 81 ILE CD1 . 11425 1 958 . 1 1 81 81 ILE CG1 C 13 29.370 0.2 . 1 . . . . 81 ILE CG1 . 11425 1 959 . 1 1 81 81 ILE CG2 C 13 14.485 0.2 . 1 . . . . 81 ILE CG2 . 11425 1 960 . 1 1 81 81 ILE N N 15 120.382 0.2 . 1 . . . . 81 ILE N . 11425 1 961 . 1 1 82 82 ALA H H 1 8.272 0.02 . 1 . . . . 82 ALA H . 11425 1 962 . 1 1 82 82 ALA HA H 1 3.760 0.02 . 1 . . . . 82 ALA HA . 11425 1 963 . 1 1 82 82 ALA HB1 H 1 1.501 0.02 . 1 . . . . 82 ALA MB . 11425 1 964 . 1 1 82 82 ALA HB2 H 1 1.501 0.02 . 1 . . . . 82 ALA MB . 11425 1 965 . 1 1 82 82 ALA HB3 H 1 1.501 0.02 . 1 . . . . 82 ALA MB . 11425 1 966 . 1 1 82 82 ALA C C 13 177.080 0.2 . 1 . . . . 82 ALA C . 11425 1 967 . 1 1 82 82 ALA CA C 13 53.096 0.2 . 1 . . . . 82 ALA CA . 11425 1 968 . 1 1 82 82 ALA CB C 13 15.105 0.2 . 1 . . . . 82 ALA CB . 11425 1 969 . 1 1 82 82 ALA N N 15 122.800 0.2 . 1 . . . . 82 ALA N . 11425 1 970 . 1 1 83 83 HIS H H 1 8.069 0.02 . 1 . . . . 83 HIS H . 11425 1 971 . 1 1 83 83 HIS HA H 1 4.418 0.02 . 1 . . . . 83 HIS HA . 11425 1 972 . 1 1 83 83 HIS HB2 H 1 3.307 0.02 . 2 . . . . 83 HIS HB2 . 11425 1 973 . 1 1 83 83 HIS HB3 H 1 3.307 0.02 . 2 . . . . 83 HIS HB3 . 11425 1 974 . 1 1 83 83 HIS HE1 H 1 8.079 0.02 . 1 . . . . 83 HIS HE1 . 11425 1 975 . 1 1 83 83 HIS C C 13 174.600 0.2 . 1 . . . . 83 HIS C . 11425 1 976 . 1 1 83 83 HIS CA C 13 56.024 0.2 . 1 . . . . 83 HIS CA . 11425 1 977 . 1 1 83 83 HIS CB C 13 25.855 0.2 . 1 . . . . 83 HIS CB . 11425 1 978 . 1 1 83 83 HIS CE1 C 13 134.700 0.2 . 1 . . . . 83 HIS CE1 . 11425 1 979 . 1 1 83 83 HIS N N 15 117.500 0.2 . 1 . . . . 83 HIS N . 11425 1 980 . 1 1 84 84 ASN H H 1 8.371 0.02 . 1 . . . . 84 ASN H . 11425 1 981 . 1 1 84 84 ASN HA H 1 4.346 0.02 . 1 . . . . 84 ASN HA . 11425 1 982 . 1 1 84 84 ASN HB2 H 1 2.876 0.02 . 2 . . . . 84 ASN HB2 . 11425 1 983 . 1 1 84 84 ASN HB3 H 1 2.782 0.02 . 2 . . . . 84 ASN HB3 . 11425 1 984 . 1 1 84 84 ASN HD21 H 1 6.971 0.02 . 1 . . . . 84 ASN HD21 . 11425 1 985 . 1 1 84 84 ASN HD22 H 1 7.435 0.02 . 1 . . . . 84 ASN HD22 . 11425 1 986 . 1 1 84 84 ASN C C 13 175.441 0.2 . 1 . . . . 84 ASN C . 11425 1 987 . 1 1 84 84 ASN CA C 13 53.630 0.2 . 1 . . . . 84 ASN CA . 11425 1 988 . 1 1 84 84 ASN CB C 13 35.932 0.2 . 1 . . . . 84 ASN CB . 11425 1 989 . 1 1 84 84 ASN N N 15 120.044 0.2 . 1 . . . . 84 ASN N . 11425 1 990 . 1 1 84 84 ASN ND2 N 15 111.700 0.2 . 1 . . . . 84 ASN ND2 . 11425 1 991 . 1 1 85 85 MET H H 1 8.464 0.02 . 1 . . . . 85 MET H . 11425 1 992 . 1 1 85 85 MET HA H 1 3.882 0.02 . 1 . . . . 85 MET HA . 11425 1 993 . 1 1 85 85 MET HB2 H 1 2.153 0.02 . 1 . . . . 85 MET HB2 . 11425 1 994 . 1 1 85 85 MET HB3 H 1 1.870 0.02 . 1 . . . . 85 MET HB3 . 11425 1 995 . 1 1 85 85 MET HE1 H 1 1.858 0.02 . 1 . . . . 85 MET ME . 11425 1 996 . 1 1 85 85 MET HE2 H 1 1.858 0.02 . 1 . . . . 85 MET ME . 11425 1 997 . 1 1 85 85 MET HE3 H 1 1.858 0.02 . 1 . . . . 85 MET ME . 11425 1 998 . 1 1 85 85 MET HG2 H 1 2.579 0.02 . 2 . . . . 85 MET HG2 . 11425 1 999 . 1 1 85 85 MET HG3 H 1 2.579 0.02 . 2 . . . . 85 MET HG3 . 11425 1 1000 . 1 1 85 85 MET C C 13 174.400 0.2 . 1 . . . . 85 MET C . 11425 1 1001 . 1 1 85 85 MET CA C 13 56.308 0.2 . 1 . . . . 85 MET CA . 11425 1 1002 . 1 1 85 85 MET CB C 13 29.606 0.2 . 1 . . . . 85 MET CB . 11425 1 1003 . 1 1 85 85 MET CG C 13 30.126 0.2 . 1 . . . . 85 MET CG . 11425 1 1004 . 1 1 85 85 MET N N 15 119.175 0.2 . 1 . . . . 85 MET N . 11425 1 1005 . 1 1 86 86 GLN H H 1 8.362 0.02 . 1 . . . . 86 GLN H . 11425 1 1006 . 1 1 86 86 GLN HA H 1 3.501 0.02 . 1 . . . . 86 GLN HA . 11425 1 1007 . 1 1 86 86 GLN HB2 H 1 2.545 0.02 . 1 . . . . 86 GLN HB2 . 11425 1 1008 . 1 1 86 86 GLN HB3 H 1 1.978 0.02 . 1 . . . . 86 GLN HB3 . 11425 1 1009 . 1 1 86 86 GLN HE21 H 1 6.628 0.02 . 2 . . . . 86 GLN HE21 . 11425 1 1010 . 1 1 86 86 GLN HE22 H 1 7.358 0.02 . 2 . . . . 86 GLN HE22 . 11425 1 1011 . 1 1 86 86 GLN HG2 H 1 2.097 0.02 . 2 . . . . 86 GLN HG2 . 11425 1 1012 . 1 1 86 86 GLN HG3 H 1 2.097 0.02 . 2 . . . . 86 GLN HG3 . 11425 1 1013 . 1 1 86 86 GLN C C 13 174.300 0.2 . 1 . . . . 86 GLN C . 11425 1 1014 . 1 1 86 86 GLN CA C 13 57.830 0.2 . 1 . . . . 86 GLN CA . 11425 1 1015 . 1 1 86 86 GLN CB C 13 24.202 0.2 . 1 . . . . 86 GLN CB . 11425 1 1016 . 1 1 86 86 GLN CG C 13 29.697 0.2 . 1 . . . . 86 GLN CG . 11425 1 1017 . 1 1 86 86 GLN N N 15 120.533 0.2 . 1 . . . . 86 GLN N . 11425 1 1018 . 1 1 86 86 GLN NE2 N 15 111.200 0.2 . 1 . . . . 86 GLN NE2 . 11425 1 1019 . 1 1 87 87 SER H H 1 7.828 0.02 . 1 . . . . 87 SER H . 11425 1 1020 . 1 1 87 87 SER HA H 1 3.990 0.02 . 1 . . . . 87 SER HA . 11425 1 1021 . 1 1 87 87 SER HB2 H 1 3.835 0.02 . 2 . . . . 87 SER HB2 . 11425 1 1022 . 1 1 87 87 SER HB3 H 1 3.835 0.02 . 2 . . . . 87 SER HB3 . 11425 1 1023 . 1 1 87 87 SER C C 13 174.100 0.2 . 1 . . . . 87 SER C . 11425 1 1024 . 1 1 87 87 SER CA C 13 58.950 0.2 . 1 . . . . 87 SER CA . 11425 1 1025 . 1 1 87 87 SER CB C 13 59.963 0.2 . 1 . . . . 87 SER CB . 11425 1 1026 . 1 1 87 87 SER N N 15 114.652 0.2 . 1 . . . . 87 SER N . 11425 1 1027 . 1 1 88 88 THR H H 1 7.888 0.02 . 1 . . . . 88 THR H . 11425 1 1028 . 1 1 88 88 THR HA H 1 3.896 0.02 . 1 . . . . 88 THR HA . 11425 1 1029 . 1 1 88 88 THR HB H 1 3.964 0.02 . 1 . . . . 88 THR HB . 11425 1 1030 . 1 1 88 88 THR HG21 H 1 1.110 0.02 . 1 . . . . 88 THR MG . 11425 1 1031 . 1 1 88 88 THR HG22 H 1 1.110 0.02 . 1 . . . . 88 THR MG . 11425 1 1032 . 1 1 88 88 THR HG23 H 1 1.110 0.02 . 1 . . . . 88 THR MG . 11425 1 1033 . 1 1 88 88 THR C C 13 174.700 0.2 . 1 . . . . 88 THR C . 11425 1 1034 . 1 1 88 88 THR CA C 13 63.569 0.2 . 1 . . . . 88 THR CA . 11425 1 1035 . 1 1 88 88 THR CB C 13 66.165 0.2 . 1 . . . . 88 THR CB . 11425 1 1036 . 1 1 88 88 THR CG2 C 13 18.961 0.2 . 1 . . . . 88 THR CG2 . 11425 1 1037 . 1 1 88 88 THR N N 15 117.884 0.2 . 1 . . . . 88 THR N . 11425 1 1038 . 1 1 89 89 LEU H H 1 8.627 0.02 . 1 . . . . 89 LEU H . 11425 1 1039 . 1 1 89 89 LEU HA H 1 3.964 0.02 . 1 . . . . 89 LEU HA . 11425 1 1040 . 1 1 89 89 LEU HB2 H 1 1.373 0.02 . 2 . . . . 89 LEU HB2 . 11425 1 1041 . 1 1 89 89 LEU HB3 H 1 1.373 0.02 . 2 . . . . 89 LEU HB3 . 11425 1 1042 . 1 1 89 89 LEU HD11 H 1 0.693 0.02 . 2 . . . . 89 LEU MD1 . 11425 1 1043 . 1 1 89 89 LEU HD12 H 1 0.693 0.02 . 2 . . . . 89 LEU MD1 . 11425 1 1044 . 1 1 89 89 LEU HD13 H 1 0.693 0.02 . 2 . . . . 89 LEU MD1 . 11425 1 1045 . 1 1 89 89 LEU HD21 H 1 0.693 0.02 . 2 . . . . 89 LEU MD2 . 11425 1 1046 . 1 1 89 89 LEU HD22 H 1 0.693 0.02 . 2 . . . . 89 LEU MD2 . 11425 1 1047 . 1 1 89 89 LEU HD23 H 1 0.693 0.02 . 2 . . . . 89 LEU MD2 . 11425 1 1048 . 1 1 89 89 LEU HG H 1 1.045 0.02 . 1 . . . . 89 LEU HG . 11425 1 1049 . 1 1 89 89 LEU C C 13 176.900 0.2 . 1 . . . . 89 LEU C . 11425 1 1050 . 1 1 89 89 LEU CA C 13 54.838 0.2 . 1 . . . . 89 LEU CA . 11425 1 1051 . 1 1 89 89 LEU CB C 13 39.750 0.2 . 1 . . . . 89 LEU CB . 11425 1 1052 . 1 1 89 89 LEU CD1 C 13 21.894 0.2 . 1 . . . . 89 LEU CD1 . 11425 1 1053 . 1 1 89 89 LEU CD2 C 13 22.430 0.2 . 1 . . . . 89 LEU CD2 . 11425 1 1054 . 1 1 89 89 LEU CG C 13 24.520 0.2 . 1 . . . . 89 LEU CG . 11425 1 1055 . 1 1 89 89 LEU N N 15 121.262 0.2 . 1 . . . . 89 LEU N . 11425 1 1056 . 1 1 90 90 ASP H H 1 8.865 0.02 . 1 . . . . 90 ASP H . 11425 1 1057 . 1 1 90 90 ASP HA H 1 4.317 0.02 . 1 . . . . 90 ASP HA . 11425 1 1058 . 1 1 90 90 ASP HB2 H 1 2.924 0.02 . 2 . . . . 90 ASP HB2 . 11425 1 1059 . 1 1 90 90 ASP HB3 H 1 2.648 0.02 . 2 . . . . 90 ASP HB3 . 11425 1 1060 . 1 1 90 90 ASP C C 13 175.900 0.2 . 1 . . . . 90 ASP C . 11425 1 1061 . 1 1 90 90 ASP CA C 13 54.900 0.2 . 1 . . . . 90 ASP CA . 11425 1 1062 . 1 1 90 90 ASP CB C 13 38.356 0.2 . 1 . . . . 90 ASP CB . 11425 1 1063 . 1 1 90 90 ASP N N 15 120.400 0.2 . 1 . . . . 90 ASP N . 11425 1 1064 . 1 1 91 91 ASP H H 1 7.714 0.02 . 1 . . . . 91 ASP H . 11425 1 1065 . 1 1 91 91 ASP HA H 1 4.148 0.02 . 1 . . . . 91 ASP HA . 11425 1 1066 . 1 1 91 91 ASP HB2 H 1 2.602 0.02 . 2 . . . . 91 ASP HB2 . 11425 1 1067 . 1 1 91 91 ASP HB3 H 1 2.602 0.02 . 2 . . . . 91 ASP HB3 . 11425 1 1068 . 1 1 91 91 ASP C C 13 175.400 0.2 . 1 . . . . 91 ASP C . 11425 1 1069 . 1 1 91 91 ASP CA C 13 54.599 0.2 . 1 . . . . 91 ASP CA . 11425 1 1070 . 1 1 91 91 ASP CB C 13 37.679 0.2 . 1 . . . . 91 ASP CB . 11425 1 1071 . 1 1 91 91 ASP N N 15 118.009 0.2 . 1 . . . . 91 ASP N . 11425 1 1072 . 1 1 92 92 ALA H H 1 7.293 0.02 . 1 . . . . 92 ALA H . 11425 1 1073 . 1 1 92 92 ALA HA H 1 3.959 0.02 . 1 . . . . 92 ALA HA . 11425 1 1074 . 1 1 92 92 ALA HB1 H 1 1.280 0.02 . 1 . . . . 92 ALA MB . 11425 1 1075 . 1 1 92 92 ALA HB2 H 1 1.280 0.02 . 1 . . . . 92 ALA MB . 11425 1 1076 . 1 1 92 92 ALA HB3 H 1 1.280 0.02 . 1 . . . . 92 ALA MB . 11425 1 1077 . 1 1 92 92 ALA C C 13 175.800 0.2 . 1 . . . . 92 ALA C . 11425 1 1078 . 1 1 92 92 ALA CA C 13 51.350 0.2 . 1 . . . . 92 ALA CA . 11425 1 1079 . 1 1 92 92 ALA CB C 13 17.007 0.2 . 1 . . . . 92 ALA CB . 11425 1 1080 . 1 1 92 92 ALA N N 15 118.974 0.2 . 1 . . . . 92 ALA N . 11425 1 1081 . 1 1 93 93 THR H H 1 7.514 0.02 . 1 . . . . 93 THR H . 11425 1 1082 . 1 1 93 93 THR HA H 1 3.240 0.02 . 1 . . . . 93 THR HA . 11425 1 1083 . 1 1 93 93 THR HB H 1 4.120 0.02 . 1 . . . . 93 THR HB . 11425 1 1084 . 1 1 93 93 THR HG21 H 1 1.064 0.02 . 1 . . . . 93 THR MG . 11425 1 1085 . 1 1 93 93 THR HG22 H 1 1.064 0.02 . 1 . . . . 93 THR MG . 11425 1 1086 . 1 1 93 93 THR HG23 H 1 1.064 0.02 . 1 . . . . 93 THR MG . 11425 1 1087 . 1 1 93 93 THR C C 13 174.600 0.2 . 1 . . . . 93 THR C . 11425 1 1088 . 1 1 93 93 THR CA C 13 59.675 0.2 . 1 . . . . 93 THR CA . 11425 1 1089 . 1 1 93 93 THR CB C 13 67.225 0.2 . 1 . . . . 93 THR CB . 11425 1 1090 . 1 1 93 93 THR CG2 C 13 19.160 0.2 . 1 . . . . 93 THR CG2 . 11425 1 1091 . 1 1 93 93 THR N N 15 103.900 0.2 . 1 . . . . 93 THR N . 11425 1 1092 . 1 1 94 94 ASP H H 1 7.213 0.02 . 1 . . . . 94 ASP H . 11425 1 1093 . 1 1 94 94 ASP HA H 1 4.371 0.02 . 1 . . . . 94 ASP HA . 11425 1 1094 . 1 1 94 94 ASP HB2 H 1 2.545 0.02 . 2 . . . . 94 ASP HB2 . 11425 1 1095 . 1 1 94 94 ASP HB3 H 1 2.545 0.02 . 2 . . . . 94 ASP HB3 . 11425 1 1096 . 1 1 94 94 ASP C C 13 176.500 0.2 . 1 . . . . 94 ASP C . 11425 1 1097 . 1 1 94 94 ASP CA C 13 55.247 0.2 . 1 . . . . 94 ASP CA . 11425 1 1098 . 1 1 94 94 ASP CB C 13 37.370 0.2 . 1 . . . . 94 ASP CB . 11425 1 1099 . 1 1 94 94 ASP N N 15 124.100 0.2 . 1 . . . . 94 ASP N . 11425 1 1100 . 1 1 95 95 ALA H H 1 7.693 0.02 . 1 . . . . 95 ALA H . 11425 1 1101 . 1 1 95 95 ALA HA H 1 3.996 0.02 . 1 . . . . 95 ALA HA . 11425 1 1102 . 1 1 95 95 ALA HB1 H 1 1.094 0.02 . 1 . . . . 95 ALA MB . 11425 1 1103 . 1 1 95 95 ALA HB2 H 1 1.094 0.02 . 1 . . . . 95 ALA MB . 11425 1 1104 . 1 1 95 95 ALA HB3 H 1 1.094 0.02 . 1 . . . . 95 ALA MB . 11425 1 1105 . 1 1 95 95 ALA C C 13 174.800 0.2 . 1 . . . . 95 ALA C . 11425 1 1106 . 1 1 95 95 ALA CA C 13 51.330 0.2 . 1 . . . . 95 ALA CA . 11425 1 1107 . 1 1 95 95 ALA CB C 13 15.249 0.2 . 1 . . . . 95 ALA CB . 11425 1 1108 . 1 1 95 95 ALA N N 15 121.344 0.2 . 1 . . . . 95 ALA N . 11425 1 1109 . 1 1 96 96 TRP H H 1 7.233 0.02 . 1 . . . . 96 TRP H . 11425 1 1110 . 1 1 96 96 TRP HA H 1 4.751 0.02 . 1 . . . . 96 TRP HA . 11425 1 1111 . 1 1 96 96 TRP HB2 H 1 3.206 0.02 . 2 . . . . 96 TRP HB2 . 11425 1 1112 . 1 1 96 96 TRP HB3 H 1 3.206 0.02 . 2 . . . . 96 TRP HB3 . 11425 1 1113 . 1 1 96 96 TRP HD1 H 1 6.789 0.02 . 1 . . . . 96 TRP HD1 . 11425 1 1114 . 1 1 96 96 TRP HE1 H 1 9.811 0.02 . 1 . . . . 96 TRP HE1 . 11425 1 1115 . 1 1 96 96 TRP HH2 H 1 6.895 0.02 . 1 . . . . 96 TRP HH2 . 11425 1 1116 . 1 1 96 96 TRP HZ2 H 1 7.169 0.02 . 1 . . . . 96 TRP HZ2 . 11425 1 1117 . 1 1 96 96 TRP C C 13 172.500 0.2 . 1 . . . . 96 TRP C . 11425 1 1118 . 1 1 96 96 TRP CA C 13 51.910 0.2 . 1 . . . . 96 TRP CA . 11425 1 1119 . 1 1 96 96 TRP CB C 13 26.270 0.2 . 1 . . . . 96 TRP CB . 11425 1 1120 . 1 1 96 96 TRP CD1 C 13 121.900 0.2 . 1 . . . . 96 TRP CD1 . 11425 1 1121 . 1 1 96 96 TRP CH2 C 13 121.800 0.2 . 1 . . . . 96 TRP CH2 . 11425 1 1122 . 1 1 96 96 TRP CZ2 C 13 111.300 0.2 . 1 . . . . 96 TRP CZ2 . 11425 1 1123 . 1 1 96 96 TRP N N 15 115.122 0.2 . 1 . . . . 96 TRP N . 11425 1 1124 . 1 1 97 97 GLY H H 1 7.701 0.02 . 1 . . . . 97 GLY H . 11425 1 1125 . 1 1 97 97 GLY HA2 H 1 4.239 0.02 . 1 . . . . 97 GLY HA2 . 11425 1 1126 . 1 1 97 97 GLY HA3 H 1 3.942 0.02 . 1 . . . . 97 GLY HA3 . 11425 1 1127 . 1 1 97 97 GLY C C 13 171.300 0.2 . 1 . . . . 97 GLY C . 11425 1 1128 . 1 1 97 97 GLY CA C 13 43.788 0.2 . 1 . . . . 97 GLY CA . 11425 1 1129 . 1 1 97 97 GLY N N 15 103.935 0.2 . 1 . . . . 97 GLY N . 11425 1 1130 . 1 1 98 98 ILE H H 1 7.189 0.02 . 1 . . . . 98 ILE H . 11425 1 1131 . 1 1 98 98 ILE HA H 1 4.603 0.02 . 1 . . . . 98 ILE HA . 11425 1 1132 . 1 1 98 98 ILE HB H 1 1.720 0.02 . 1 . . . . 98 ILE HB . 11425 1 1133 . 1 1 98 98 ILE HD11 H 1 0.708 0.02 . 1 . . . . 98 ILE MD . 11425 1 1134 . 1 1 98 98 ILE HD12 H 1 0.708 0.02 . 1 . . . . 98 ILE MD . 11425 1 1135 . 1 1 98 98 ILE HD13 H 1 0.708 0.02 . 1 . . . . 98 ILE MD . 11425 1 1136 . 1 1 98 98 ILE HG12 H 1 1.546 0.02 . 1 . . . . 98 ILE HG12 . 11425 1 1137 . 1 1 98 98 ILE HG13 H 1 1.341 0.02 . 1 . . . . 98 ILE HG13 . 11425 1 1138 . 1 1 98 98 ILE HG21 H 1 0.747 0.02 . 1 . . . . 98 ILE MG . 11425 1 1139 . 1 1 98 98 ILE HG22 H 1 0.747 0.02 . 1 . . . . 98 ILE MG . 11425 1 1140 . 1 1 98 98 ILE HG23 H 1 0.747 0.02 . 1 . . . . 98 ILE MG . 11425 1 1141 . 1 1 98 98 ILE C C 13 171.300 0.2 . 1 . . . . 98 ILE C . 11425 1 1142 . 1 1 98 98 ILE CA C 13 56.543 0.2 . 1 . . . . 98 ILE CA . 11425 1 1143 . 1 1 98 98 ILE CB C 13 39.383 0.2 . 1 . . . . 98 ILE CB . 11425 1 1144 . 1 1 98 98 ILE CD1 C 13 10.041 0.2 . 1 . . . . 98 ILE CD1 . 11425 1 1145 . 1 1 98 98 ILE CG1 C 13 26.916 0.2 . 1 . . . . 98 ILE CG1 . 11425 1 1146 . 1 1 98 98 ILE CG2 C 13 14.725 0.2 . 1 . . . . 98 ILE CG2 . 11425 1 1147 . 1 1 98 98 ILE N N 15 119.400 0.2 . 1 . . . . 98 ILE N . 11425 1 1148 . 1 1 99 99 LYS H H 1 9.047 0.02 . 1 . . . . 99 LYS H . 11425 1 1149 . 1 1 99 99 LYS HA H 1 4.767 0.02 . 1 . . . . 99 LYS HA . 11425 1 1150 . 1 1 99 99 LYS HB2 H 1 1.713 0.02 . 2 . . . . 99 LYS HB2 . 11425 1 1151 . 1 1 99 99 LYS HB3 H 1 1.713 0.02 . 2 . . . . 99 LYS HB3 . 11425 1 1152 . 1 1 99 99 LYS HD2 H 1 1.353 0.02 . 2 . . . . 99 LYS HD2 . 11425 1 1153 . 1 1 99 99 LYS HD3 H 1 1.353 0.02 . 2 . . . . 99 LYS HD3 . 11425 1 1154 . 1 1 99 99 LYS HE2 H 1 2.783 0.02 . 2 . . . . 99 LYS HE2 . 11425 1 1155 . 1 1 99 99 LYS HE3 H 1 2.783 0.02 . 2 . . . . 99 LYS HE3 . 11425 1 1156 . 1 1 99 99 LYS HG2 H 1 1.107 0.02 . 2 . . . . 99 LYS HG2 . 11425 1 1157 . 1 1 99 99 LYS HG3 H 1 1.107 0.02 . 2 . . . . 99 LYS HG3 . 11425 1 1158 . 1 1 99 99 LYS CA C 13 49.974 0.2 . 1 . . . . 99 LYS CA . 11425 1 1159 . 1 1 99 99 LYS CB C 13 30.699 0.2 . 1 . . . . 99 LYS CB . 11425 1 1160 . 1 1 99 99 LYS CD C 13 24.984 0.2 . 1 . . . . 99 LYS CD . 11425 1 1161 . 1 1 99 99 LYS CE C 13 39.125 0.2 . 1 . . . . 99 LYS CE . 11425 1 1162 . 1 1 99 99 LYS CG C 13 20.874 0.2 . 1 . . . . 99 LYS CG . 11425 1 1163 . 1 1 99 99 LYS N N 15 127.500 0.2 . 1 . . . . 99 LYS N . 11425 1 1164 . 1 1 100 100 VAL H H 1 8.876 0.02 . 1 . . . . 100 VAL H . 11425 1 1165 . 1 1 100 100 VAL HA H 1 4.366 0.02 . 1 . . . . 100 VAL HA . 11425 1 1166 . 1 1 100 100 VAL HB H 1 1.771 0.02 . 1 . . . . 100 VAL HB . 11425 1 1167 . 1 1 100 100 VAL HG11 H 1 0.538 0.02 . 2 . . . . 100 VAL MG1 . 11425 1 1168 . 1 1 100 100 VAL HG12 H 1 0.538 0.02 . 2 . . . . 100 VAL MG1 . 11425 1 1169 . 1 1 100 100 VAL HG13 H 1 0.538 0.02 . 2 . . . . 100 VAL MG1 . 11425 1 1170 . 1 1 100 100 VAL HG21 H 1 0.538 0.02 . 2 . . . . 100 VAL MG2 . 11425 1 1171 . 1 1 100 100 VAL HG22 H 1 0.538 0.02 . 2 . . . . 100 VAL MG2 . 11425 1 1172 . 1 1 100 100 VAL HG23 H 1 0.538 0.02 . 2 . . . . 100 VAL MG2 . 11425 1 1173 . 1 1 100 100 VAL CA C 13 57.808 0.2 . 1 . . . . 100 VAL CA . 11425 1 1174 . 1 1 100 100 VAL CB C 13 30.747 0.2 . 1 . . . . 100 VAL CB . 11425 1 1175 . 1 1 100 100 VAL CG1 C 13 19.813 0.2 . 1 . . . . 100 VAL CG1 . 11425 1 1176 . 1 1 100 100 VAL N N 15 128.268 0.2 . 1 . . . . 100 VAL N . 11425 1 1177 . 1 1 101 101 GLU H H 1 7.616 0.02 . 1 . . . . 101 GLU H . 11425 1 1178 . 1 1 101 101 GLU HA H 1 4.237 0.02 . 1 . . . . 101 GLU HA . 11425 1 1179 . 1 1 101 101 GLU HB2 H 1 1.513 0.02 . 2 . . . . 101 GLU HB2 . 11425 1 1180 . 1 1 101 101 GLU HB3 H 1 1.513 0.02 . 2 . . . . 101 GLU HB3 . 11425 1 1181 . 1 1 101 101 GLU HG2 H 1 2.060 0.02 . 2 . . . . 101 GLU HG2 . 11425 1 1182 . 1 1 101 101 GLU HG3 H 1 1.893 0.02 . 2 . . . . 101 GLU HG3 . 11425 1 1183 . 1 1 101 101 GLU CA C 13 54.382 0.2 . 1 . . . . 101 GLU CA . 11425 1 1184 . 1 1 101 101 GLU CB C 13 29.211 0.2 . 1 . . . . 101 GLU CB . 11425 1 1185 . 1 1 101 101 GLU CG C 13 33.402 0.2 . 1 . . . . 101 GLU CG . 11425 1 1186 . 1 1 101 101 GLU N N 15 115.752 0.2 . 1 . . . . 101 GLU N . 11425 1 1187 . 1 1 102 102 ARG H H 1 7.616 0.02 . 1 . . . . 102 ARG H . 11425 1 1188 . 1 1 102 102 ARG HA H 1 4.380 0.02 . 1 . . . . 102 ARG HA . 11425 1 1189 . 1 1 102 102 ARG HB2 H 1 1.440 0.02 . 2 . . . . 102 ARG HB2 . 11425 1 1190 . 1 1 102 102 ARG HB3 H 1 1.440 0.02 . 2 . . . . 102 ARG HB3 . 11425 1 1191 . 1 1 102 102 ARG HD2 H 1 2.773 0.02 . 1 . . . . 102 ARG HD2 . 11425 1 1192 . 1 1 102 102 ARG HD3 H 1 2.573 0.02 . 1 . . . . 102 ARG HD3 . 11425 1 1193 . 1 1 102 102 ARG HG2 H 1 1.114 0.02 . 2 . . . . 102 ARG HG2 . 11425 1 1194 . 1 1 102 102 ARG HG3 H 1 1.114 0.02 . 2 . . . . 102 ARG HG3 . 11425 1 1195 . 1 1 102 102 ARG C C 13 170.100 0.2 . 1 . . . . 102 ARG C . 11425 1 1196 . 1 1 102 102 ARG CA C 13 53.390 0.2 . 1 . . . . 102 ARG CA . 11425 1 1197 . 1 1 102 102 ARG CB C 13 30.813 0.2 . 1 . . . . 102 ARG CB . 11425 1 1198 . 1 1 102 102 ARG CD C 13 40.413 0.2 . 1 . . . . 102 ARG CD . 11425 1 1199 . 1 1 102 102 ARG CG C 13 24.665 0.2 . 1 . . . . 102 ARG CG . 11425 1 1200 . 1 1 102 102 ARG N N 15 115.585 0.2 . 1 . . . . 102 ARG N . 11425 1 1201 . 1 1 103 103 VAL H H 1 8.472 0.02 . 1 . . . . 103 VAL H . 11425 1 1202 . 1 1 103 103 VAL HA H 1 4.687 0.02 . 1 . . . . 103 VAL HA . 11425 1 1203 . 1 1 103 103 VAL HB H 1 1.913 0.02 . 1 . . . . 103 VAL HB . 11425 1 1204 . 1 1 103 103 VAL HG11 H 1 0.717 0.02 . 2 . . . . 103 VAL MG1 . 11425 1 1205 . 1 1 103 103 VAL HG12 H 1 0.717 0.02 . 2 . . . . 103 VAL MG1 . 11425 1 1206 . 1 1 103 103 VAL HG13 H 1 0.717 0.02 . 2 . . . . 103 VAL MG1 . 11425 1 1207 . 1 1 103 103 VAL HG21 H 1 0.717 0.02 . 2 . . . . 103 VAL MG2 . 11425 1 1208 . 1 1 103 103 VAL HG22 H 1 0.717 0.02 . 2 . . . . 103 VAL MG2 . 11425 1 1209 . 1 1 103 103 VAL HG23 H 1 0.717 0.02 . 2 . . . . 103 VAL MG2 . 11425 1 1210 . 1 1 103 103 VAL C C 13 170.900 0.2 . 1 . . . . 103 VAL C . 11425 1 1211 . 1 1 103 103 VAL CA C 13 58.410 0.2 . 1 . . . . 103 VAL CA . 11425 1 1212 . 1 1 103 103 VAL CB C 13 32.100 0.2 . 1 . . . . 103 VAL CB . 11425 1 1213 . 1 1 103 103 VAL CG1 C 13 19.558 0.2 . 1 . . . . 103 VAL CG1 . 11425 1 1214 . 1 1 103 103 VAL CG2 C 13 17.652 0.2 . 1 . . . . 103 VAL CG2 . 11425 1 1215 . 1 1 103 103 VAL N N 15 124.751 0.2 . 1 . . . . 103 VAL N . 11425 1 1216 . 1 1 104 104 GLU H H 1 9.032 0.02 . 1 . . . . 104 GLU H . 11425 1 1217 . 1 1 104 104 GLU HA H 1 4.586 0.02 . 1 . . . . 104 GLU HA . 11425 1 1218 . 1 1 104 104 GLU HB2 H 1 1.762 0.02 . 2 . . . . 104 GLU HB2 . 11425 1 1219 . 1 1 104 104 GLU HB3 H 1 1.762 0.02 . 2 . . . . 104 GLU HB3 . 11425 1 1220 . 1 1 104 104 GLU HG2 H 1 2.012 0.02 . 2 . . . . 104 GLU HG2 . 11425 1 1221 . 1 1 104 104 GLU HG3 H 1 2.012 0.02 . 2 . . . . 104 GLU HG3 . 11425 1 1222 . 1 1 104 104 GLU C C 13 172.700 0.2 . 1 . . . . 104 GLU C . 11425 1 1223 . 1 1 104 104 GLU CA C 13 51.646 0.2 . 1 . . . . 104 GLU CA . 11425 1 1224 . 1 1 104 104 GLU CB C 13 30.330 0.2 . 1 . . . . 104 GLU CB . 11425 1 1225 . 1 1 104 104 GLU CG C 13 33.350 0.2 . 1 . . . . 104 GLU CG . 11425 1 1226 . 1 1 104 104 GLU N N 15 124.444 0.2 . 1 . . . . 104 GLU N . 11425 1 1227 . 1 1 105 105 ILE H H 1 8.739 0.02 . 1 . . . . 105 ILE H . 11425 1 1228 . 1 1 105 105 ILE HA H 1 4.083 0.02 . 1 . . . . 105 ILE HA . 11425 1 1229 . 1 1 105 105 ILE HB H 1 1.591 0.02 . 1 . . . . 105 ILE HB . 11425 1 1230 . 1 1 105 105 ILE HD11 H 1 0.646 0.02 . 1 . . . . 105 ILE MD . 11425 1 1231 . 1 1 105 105 ILE HD12 H 1 0.646 0.02 . 1 . . . . 105 ILE MD . 11425 1 1232 . 1 1 105 105 ILE HD13 H 1 0.646 0.02 . 1 . . . . 105 ILE MD . 11425 1 1233 . 1 1 105 105 ILE HG12 H 1 1.257 0.02 . 1 . . . . 105 ILE HG12 . 11425 1 1234 . 1 1 105 105 ILE HG13 H 1 1.439 0.02 . 1 . . . . 105 ILE HG13 . 11425 1 1235 . 1 1 105 105 ILE HG21 H 1 0.626 0.02 . 1 . . . . 105 ILE MG . 11425 1 1236 . 1 1 105 105 ILE HG22 H 1 0.626 0.02 . 1 . . . . 105 ILE MG . 11425 1 1237 . 1 1 105 105 ILE HG23 H 1 0.626 0.02 . 1 . . . . 105 ILE MG . 11425 1 1238 . 1 1 105 105 ILE C C 13 172.800 0.2 . 1 . . . . 105 ILE C . 11425 1 1239 . 1 1 105 105 ILE CA C 13 58.346 0.2 . 1 . . . . 105 ILE CA . 11425 1 1240 . 1 1 105 105 ILE CB C 13 35.213 0.2 . 1 . . . . 105 ILE CB . 11425 1 1241 . 1 1 105 105 ILE CD1 C 13 9.545 0.2 . 1 . . . . 105 ILE CD1 . 11425 1 1242 . 1 1 105 105 ILE CG1 C 13 24.979 0.2 . 1 . . . . 105 ILE CG1 . 11425 1 1243 . 1 1 105 105 ILE CG2 C 13 14.122 0.2 . 1 . . . . 105 ILE CG2 . 11425 1 1244 . 1 1 105 105 ILE N N 15 124.438 0.2 . 1 . . . . 105 ILE N . 11425 1 1245 . 1 1 106 106 LYS H H 1 8.312 0.02 . 1 . . . . 106 LYS H . 11425 1 1246 . 1 1 106 106 LYS HA H 1 4.142 0.02 . 1 . . . . 106 LYS HA . 11425 1 1247 . 1 1 106 106 LYS HB2 H 1 1.258 0.02 . 2 . . . . 106 LYS HB2 . 11425 1 1248 . 1 1 106 106 LYS HB3 H 1 1.258 0.02 . 2 . . . . 106 LYS HB3 . 11425 1 1249 . 1 1 106 106 LYS HD2 H 1 1.259 0.02 . 2 . . . . 106 LYS HD2 . 11425 1 1250 . 1 1 106 106 LYS HD3 H 1 1.259 0.02 . 2 . . . . 106 LYS HD3 . 11425 1 1251 . 1 1 106 106 LYS HE2 H 1 2.706 0.02 . 2 . . . . 106 LYS HE2 . 11425 1 1252 . 1 1 106 106 LYS HE3 H 1 2.706 0.02 . 2 . . . . 106 LYS HE3 . 11425 1 1253 . 1 1 106 106 LYS HG2 H 1 1.248 0.02 . 2 . . . . 106 LYS HG2 . 11425 1 1254 . 1 1 106 106 LYS HG3 H 1 1.248 0.02 . 2 . . . . 106 LYS HG3 . 11425 1 1255 . 1 1 106 106 LYS CA C 13 54.233 0.2 . 1 . . . . 106 LYS CA . 11425 1 1256 . 1 1 106 106 LYS CB C 13 29.563 0.2 . 1 . . . . 106 LYS CB . 11425 1 1257 . 1 1 106 106 LYS CD C 13 25.864 0.2 . 1 . . . . 106 LYS CD . 11425 1 1258 . 1 1 106 106 LYS CE C 13 38.816 0.2 . 1 . . . . 106 LYS CE . 11425 1 1259 . 1 1 106 106 LYS CG C 13 22.040 0.2 . 1 . . . . 106 LYS CG . 11425 1 1260 . 1 1 106 106 LYS N N 15 129.600 0.2 . 1 . . . . 106 LYS N . 11425 1 1261 . 1 1 107 107 ASP H H 1 8.185 0.02 . 1 . . . . 107 ASP H . 11425 1 1262 . 1 1 107 107 ASP HA H 1 4.512 0.02 . 1 . . . . 107 ASP HA . 11425 1 1263 . 1 1 107 107 ASP HB2 H 1 2.594 0.02 . 2 . . . . 107 ASP HB2 . 11425 1 1264 . 1 1 107 107 ASP HB3 H 1 2.594 0.02 . 2 . . . . 107 ASP HB3 . 11425 1 1265 . 1 1 107 107 ASP CA C 13 52.970 0.2 . 1 . . . . 107 ASP CA . 11425 1 1266 . 1 1 107 107 ASP CB C 13 39.671 0.2 . 1 . . . . 107 ASP CB . 11425 1 1267 . 1 1 107 107 ASP N N 15 118.900 0.2 . 1 . . . . 107 ASP N . 11425 1 1268 . 1 1 108 108 VAL H H 1 7.988 0.02 . 1 . . . . 108 VAL H . 11425 1 1269 . 1 1 108 108 VAL HA H 1 4.205 0.02 . 1 . . . . 108 VAL HA . 11425 1 1270 . 1 1 108 108 VAL HB H 1 1.836 0.02 . 1 . . . . 108 VAL HB . 11425 1 1271 . 1 1 108 108 VAL HG11 H 1 0.611 0.02 . 2 . . . . 108 VAL MG1 . 11425 1 1272 . 1 1 108 108 VAL HG12 H 1 0.611 0.02 . 2 . . . . 108 VAL MG1 . 11425 1 1273 . 1 1 108 108 VAL HG13 H 1 0.611 0.02 . 2 . . . . 108 VAL MG1 . 11425 1 1274 . 1 1 108 108 VAL HG21 H 1 0.611 0.02 . 2 . . . . 108 VAL MG2 . 11425 1 1275 . 1 1 108 108 VAL HG22 H 1 0.611 0.02 . 2 . . . . 108 VAL MG2 . 11425 1 1276 . 1 1 108 108 VAL HG23 H 1 0.611 0.02 . 2 . . . . 108 VAL MG2 . 11425 1 1277 . 1 1 108 108 VAL C C 13 171.900 0.2 . 1 . . . . 108 VAL C . 11425 1 1278 . 1 1 108 108 VAL CA C 13 59.072 0.2 . 1 . . . . 108 VAL CA . 11425 1 1279 . 1 1 108 108 VAL CB C 13 30.246 0.2 . 1 . . . . 108 VAL CB . 11425 1 1280 . 1 1 108 108 VAL CG1 C 13 18.825 0.2 . 1 . . . . 108 VAL CG1 . 11425 1 1281 . 1 1 108 108 VAL CG2 C 13 17.646 0.2 . 1 . . . . 108 VAL CG2 . 11425 1 1282 . 1 1 108 108 VAL N N 15 121.597 0.2 . 1 . . . . 108 VAL N . 11425 1 1283 . 1 1 109 109 LYS H H 1 8.883 0.02 . 1 . . . . 109 LYS H . 11425 1 1284 . 1 1 109 109 LYS HA H 1 4.439 0.02 . 1 . . . . 109 LYS HA . 11425 1 1285 . 1 1 109 109 LYS HB2 H 1 1.664 0.02 . 2 . . . . 109 LYS HB2 . 11425 1 1286 . 1 1 109 109 LYS HB3 H 1 1.664 0.02 . 2 . . . . 109 LYS HB3 . 11425 1 1287 . 1 1 109 109 LYS HD2 H 1 1.480 0.02 . 2 . . . . 109 LYS HD2 . 11425 1 1288 . 1 1 109 109 LYS HD3 H 1 1.480 0.02 . 2 . . . . 109 LYS HD3 . 11425 1 1289 . 1 1 109 109 LYS HE2 H 1 3.061 0.02 . 2 . . . . 109 LYS HE2 . 11425 1 1290 . 1 1 109 109 LYS HE3 H 1 2.780 0.02 . 2 . . . . 109 LYS HE3 . 11425 1 1291 . 1 1 109 109 LYS HG2 H 1 1.162 0.02 . 2 . . . . 109 LYS HG2 . 11425 1 1292 . 1 1 109 109 LYS HG3 H 1 1.162 0.02 . 2 . . . . 109 LYS HG3 . 11425 1 1293 . 1 1 109 109 LYS CA C 13 51.658 0.2 . 1 . . . . 109 LYS CA . 11425 1 1294 . 1 1 109 109 LYS CB C 13 31.767 0.2 . 1 . . . . 109 LYS CB . 11425 1 1295 . 1 1 109 109 LYS CD C 13 26.114 0.2 . 1 . . . . 109 LYS CD . 11425 1 1296 . 1 1 109 109 LYS CE C 13 39.403 0.2 . 1 . . . . 109 LYS CE . 11425 1 1297 . 1 1 109 109 LYS CG C 13 21.952 0.2 . 1 . . . . 109 LYS CG . 11425 1 1298 . 1 1 109 109 LYS N N 15 126.475 0.2 . 1 . . . . 109 LYS N . 11425 1 1299 . 1 1 110 110 LEU H H 1 8.344 0.02 . 1 . . . . 110 LEU H . 11425 1 1300 . 1 1 110 110 LEU CA C 13 50.030 0.2 . 1 . . . . 110 LEU CA . 11425 1 1301 . 1 1 110 110 LEU CB C 13 38.600 0.2 . 1 . . . . 110 LEU CB . 11425 1 1302 . 1 1 110 110 LEU N N 15 124.629 0.2 . 1 . . . . 110 LEU N . 11425 1 1303 . 1 1 111 111 PRO HA H 1 4.330 0.02 . 1 . . . . 111 PRO HA . 11425 1 1304 . 1 1 111 111 PRO HB2 H 1 2.141 0.02 . 1 . . . . 111 PRO HB2 . 11425 1 1305 . 1 1 111 111 PRO HB3 H 1 1.762 0.02 . 1 . . . . 111 PRO HB3 . 11425 1 1306 . 1 1 111 111 PRO HD2 H 1 3.684 0.02 . 2 . . . . 111 PRO HD2 . 11425 1 1307 . 1 1 111 111 PRO HD3 H 1 3.544 0.02 . 2 . . . . 111 PRO HD3 . 11425 1 1308 . 1 1 111 111 PRO HG2 H 1 1.454 0.02 . 2 . . . . 111 PRO HG2 . 11425 1 1309 . 1 1 111 111 PRO HG3 H 1 1.454 0.02 . 2 . . . . 111 PRO HG3 . 11425 1 1310 . 1 1 111 111 PRO C C 13 173.891 0.2 . 1 . . . . 111 PRO C . 11425 1 1311 . 1 1 111 111 PRO CA C 13 60.119 0.2 . 1 . . . . 111 PRO CA . 11425 1 1312 . 1 1 111 111 PRO CB C 13 29.293 0.2 . 1 . . . . 111 PRO CB . 11425 1 1313 . 1 1 111 111 PRO CD C 13 47.741 0.2 . 1 . . . . 111 PRO CD . 11425 1 1314 . 1 1 111 111 PRO CG C 13 24.546 0.2 . 1 . . . . 111 PRO CG . 11425 1 1315 . 1 1 111 111 PRO N N 15 110.908 0.2 . 1 . . . . 111 PRO N . 11425 1 1316 . 1 1 112 112 VAL H H 1 8.160 0.02 . 1 . . . . 112 VAL H . 11425 1 1317 . 1 1 112 112 VAL HA H 1 3.937 0.02 . 1 . . . . 112 VAL HA . 11425 1 1318 . 1 1 112 112 VAL HB H 1 1.933 0.02 . 1 . . . . 112 VAL HB . 11425 1 1319 . 1 1 112 112 VAL HG11 H 1 0.839 0.02 . 2 . . . . 112 VAL MG1 . 11425 1 1320 . 1 1 112 112 VAL HG12 H 1 0.839 0.02 . 2 . . . . 112 VAL MG1 . 11425 1 1321 . 1 1 112 112 VAL HG13 H 1 0.839 0.02 . 2 . . . . 112 VAL MG1 . 11425 1 1322 . 1 1 112 112 VAL HG21 H 1 0.839 0.02 . 2 . . . . 112 VAL MG2 . 11425 1 1323 . 1 1 112 112 VAL HG22 H 1 0.839 0.02 . 2 . . . . 112 VAL MG2 . 11425 1 1324 . 1 1 112 112 VAL HG23 H 1 0.839 0.02 . 2 . . . . 112 VAL MG2 . 11425 1 1325 . 1 1 112 112 VAL C C 13 172.749 0.2 . 1 . . . . 112 VAL C . 11425 1 1326 . 1 1 112 112 VAL CA C 13 59.878 0.2 . 1 . . . . 112 VAL CA . 11425 1 1327 . 1 1 112 112 VAL CB C 13 29.899 0.2 . 1 . . . . 112 VAL CB . 11425 1 1328 . 1 1 112 112 VAL CG1 C 13 18.464 0.2 . 1 . . . . 112 VAL CG1 . 11425 1 1329 . 1 1 112 112 VAL CG2 C 13 17.842 0.2 . 1 . . . . 112 VAL CG2 . 11425 1 1330 . 1 1 112 112 VAL N N 15 120.865 0.2 . 1 . . . . 112 VAL N . 11425 1 1331 . 1 1 113 113 GLN H H 1 7.907 0.02 . 1 . . . . 113 GLN H . 11425 1 1332 . 1 1 113 113 GLN HA H 1 4.057 0.02 . 1 . . . . 113 GLN HA . 11425 1 1333 . 1 1 113 113 GLN HB2 H 1 1.952 0.02 . 2 . . . . 113 GLN HB2 . 11425 1 1334 . 1 1 113 113 GLN HB3 H 1 1.806 0.02 . 2 . . . . 113 GLN HB3 . 11425 1 1335 . 1 1 113 113 GLN C C 13 177.589 0.2 . 1 . . . . 113 GLN C . 11425 1 1336 . 1 1 113 113 GLN CA C 13 54.441 0.2 . 1 . . . . 113 GLN CA . 11425 1 1337 . 1 1 113 113 GLN CB C 13 27.954 0.2 . 1 . . . . 113 GLN CB . 11425 1 1338 . 1 1 113 113 GLN N N 15 129.000 0.2 . 1 . . . . 113 GLN N . 11425 1 stop_ save_