data_7434 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 7434 _Entry.Title ; Backbone assignment of 3F5 heavy chain antibody fragment in its free form and in complex with PABPN1 ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2009-10-27 _Entry.Accession_date 2009-10-27 _Entry.Last_release_date 2009-11-24 _Entry.Original_release_date 2009-11-24 _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 3.0.9.13 _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 Antonietta Impagliazzo . . . 7434 2 Marcellus Ubbink . . . 7434 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 7434 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 228 7434 '15N chemical shifts' 115 7434 '1H chemical shifts' 116 7434 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 1 . . 2009-11-24 2009-10-27 original author . 7434 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID BMRB 16586 '3F5 VHH' 7434 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 7434 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID . _Citation.Full_citation . _Citation.Title 'Structural insight into the recognition of PABPN1 by the flexible loops of a heavy chain antibody fragment' _Citation.Status 'in preparation' _Citation.Type journal _Citation.Journal_abbrev 'Not known' _Citation.Journal_name_full . _Citation.Journal_volume . _Citation.Journal_issue . _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first . _Citation.Page_last . _Citation.Year . _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Antonietta Impagliazzo . . . 7434 1 2 Armand Tepper . . . 7434 1 3 Theo Verrips . C. . 7434 1 4 Marcellus Ubbink . . . 7434 1 5 Silvere 'van der Maarel' . M. . 7434 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID VHH 7434 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 7434 _Assembly.ID 1 _Assembly.Name 3F5_PABPN1pept_complex _Assembly.BMRB_code . _Assembly.Number_of_components 2 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass 22000 _Assembly.Enzyme_commission_number . _Assembly.Details 'Complex between llama heavy chain antibody and a fragment (Leu119-Gln147)of its antigene polyadenylate binding protein nuclear 1 (PABPN1)' _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 3F5 1 $3F5_VHH A . yes native no no . . . 7434 1 2 PABPN1pept 2 $PABPN1pept B . no native no no . . . 7434 1 stop_ loop_ _Bond.ID _Bond.Type _Bond.Value_order _Bond.Assembly_atom_ID_1 _Bond.Entity_assembly_ID_1 _Bond.Entity_assembly_name_1 _Bond.Entity_ID_1 _Bond.Comp_ID_1 _Bond.Comp_index_ID_1 _Bond.Seq_ID_1 _Bond.Atom_ID_1 _Bond.Assembly_atom_ID_2 _Bond.Entity_assembly_ID_2 _Bond.Entity_assembly_name_2 _Bond.Entity_ID_2 _Bond.Comp_ID_2 _Bond.Comp_index_ID_2 _Bond.Seq_ID_2 _Bond.Atom_ID_2 _Bond.Auth_entity_assembly_ID_1 _Bond.Auth_entity_assembly_name_1 _Bond.Auth_seq_ID_1 _Bond.Auth_comp_ID_1 _Bond.Auth_atom_ID_1 _Bond.Auth_entity_assembly_ID_2 _Bond.Auth_entity_assembly_name_2 _Bond.Auth_seq_ID_2 _Bond.Auth_comp_ID_2 _Bond.Auth_atom_ID_2 _Bond.Entry_ID _Bond.Assembly_ID 1 disulfide single . 1 . 1 CYS 24 24 SG . 1 . 1 CYS 98 98 SG . . . . . . . . . . 7434 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_3F5_VHH _Entity.Sf_category entity _Entity.Sf_framecode 3F5_VHH _Entity.Entry_ID 7434 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name 3F5_VHH _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 ; MAEVQLVESGGGLVQAGGSL RLSCAASGRTFSGYGMGWFR QAPGKEREFVAAISWRGGNT YYADSVKGRFTISRDNAKNT VWLQMNSLKPEDTAVYYCSG FVRTRDDPSRIRNYWGQGTQ VTVSTAAALEHHHHHH ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 136 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'free and disulfide bound' _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 2015-01-28 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 BMRB 16586 . 3F5_VHH . . . . . 100.00 136 100.00 100.00 4.11e-96 . . . . 7434 1 stop_ loop_ _Entity_biological_function.Biological_function _Entity_biological_function.Entry_ID _Entity_biological_function.Entity_ID 'Llama heavy chain antibody selected against PABPN1' 7434 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 . MET . 7434 1 2 . ALA . 7434 1 3 . GLU . 7434 1 4 . VAL . 7434 1 5 . GLN . 7434 1 6 . LEU . 7434 1 7 . VAL . 7434 1 8 . GLU . 7434 1 9 . SER . 7434 1 10 . GLY . 7434 1 11 . GLY . 7434 1 12 . GLY . 7434 1 13 . LEU . 7434 1 14 . VAL . 7434 1 15 . GLN . 7434 1 16 . ALA . 7434 1 17 . GLY . 7434 1 18 . GLY . 7434 1 19 . SER . 7434 1 20 . LEU . 7434 1 21 . ARG . 7434 1 22 . LEU . 7434 1 23 . SER . 7434 1 24 . CYS . 7434 1 25 . ALA . 7434 1 26 . ALA . 7434 1 27 . SER . 7434 1 28 . GLY . 7434 1 29 . ARG . 7434 1 30 . THR . 7434 1 31 . PHE . 7434 1 32 . SER . 7434 1 33 . GLY . 7434 1 34 . TYR . 7434 1 35 . GLY . 7434 1 36 . MET . 7434 1 37 . GLY . 7434 1 38 . TRP . 7434 1 39 . PHE . 7434 1 40 . ARG . 7434 1 41 . GLN . 7434 1 42 . ALA . 7434 1 43 . PRO . 7434 1 44 . GLY . 7434 1 45 . LYS . 7434 1 46 . GLU . 7434 1 47 . ARG . 7434 1 48 . GLU . 7434 1 49 . PHE . 7434 1 50 . VAL . 7434 1 51 . ALA . 7434 1 52 . ALA . 7434 1 53 . ILE . 7434 1 54 . SER . 7434 1 55 . TRP . 7434 1 56 . ARG . 7434 1 57 . GLY . 7434 1 58 . GLY . 7434 1 59 . ASN . 7434 1 60 . THR . 7434 1 61 . TYR . 7434 1 62 . TYR . 7434 1 63 . ALA . 7434 1 64 . ASP . 7434 1 65 . SER . 7434 1 66 . VAL . 7434 1 67 . LYS . 7434 1 68 . GLY . 7434 1 69 . ARG . 7434 1 70 . PHE . 7434 1 71 . THR . 7434 1 72 . ILE . 7434 1 73 . SER . 7434 1 74 . ARG . 7434 1 75 . ASP . 7434 1 76 . ASN . 7434 1 77 . ALA . 7434 1 78 . LYS . 7434 1 79 . ASN . 7434 1 80 . THR . 7434 1 81 . VAL . 7434 1 82 . TRP . 7434 1 83 . LEU . 7434 1 84 . GLN . 7434 1 85 . MET . 7434 1 86 . ASN . 7434 1 87 . SER . 7434 1 88 . LEU . 7434 1 89 . LYS . 7434 1 90 . PRO . 7434 1 91 . GLU . 7434 1 92 . ASP . 7434 1 93 . THR . 7434 1 94 . ALA . 7434 1 95 . VAL . 7434 1 96 . TYR . 7434 1 97 . TYR . 7434 1 98 . CYS . 7434 1 99 . SER . 7434 1 100 . GLY . 7434 1 101 . PHE . 7434 1 102 . VAL . 7434 1 103 . ARG . 7434 1 104 . THR . 7434 1 105 . ARG . 7434 1 106 . ASP . 7434 1 107 . ASP . 7434 1 108 . PRO . 7434 1 109 . SER . 7434 1 110 . ARG . 7434 1 111 . ILE . 7434 1 112 . ARG . 7434 1 113 . ASN . 7434 1 114 . TYR . 7434 1 115 . TRP . 7434 1 116 . GLY . 7434 1 117 . GLN . 7434 1 118 . GLY . 7434 1 119 . THR . 7434 1 120 . GLN . 7434 1 121 . VAL . 7434 1 122 . THR . 7434 1 123 . VAL . 7434 1 124 . SER . 7434 1 125 . THR . 7434 1 126 . ALA . 7434 1 127 . ALA . 7434 1 128 . ALA . 7434 1 129 . LEU . 7434 1 130 . GLU . 7434 1 131 . HIS . 7434 1 132 . HIS . 7434 1 133 . HIS . 7434 1 134 . HIS . 7434 1 135 . HIS . 7434 1 136 . HIS . 7434 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 . MET 1 1 7434 1 . ALA 2 2 7434 1 . GLU 3 3 7434 1 . VAL 4 4 7434 1 . GLN 5 5 7434 1 . LEU 6 6 7434 1 . VAL 7 7 7434 1 . GLU 8 8 7434 1 . SER 9 9 7434 1 . GLY 10 10 7434 1 . GLY 11 11 7434 1 . GLY 12 12 7434 1 . LEU 13 13 7434 1 . VAL 14 14 7434 1 . GLN 15 15 7434 1 . ALA 16 16 7434 1 . GLY 17 17 7434 1 . GLY 18 18 7434 1 . SER 19 19 7434 1 . LEU 20 20 7434 1 . ARG 21 21 7434 1 . LEU 22 22 7434 1 . SER 23 23 7434 1 . CYS 24 24 7434 1 . ALA 25 25 7434 1 . ALA 26 26 7434 1 . SER 27 27 7434 1 . GLY 28 28 7434 1 . ARG 29 29 7434 1 . THR 30 30 7434 1 . PHE 31 31 7434 1 . SER 32 32 7434 1 . GLY 33 33 7434 1 . TYR 34 34 7434 1 . GLY 35 35 7434 1 . MET 36 36 7434 1 . GLY 37 37 7434 1 . TRP 38 38 7434 1 . PHE 39 39 7434 1 . ARG 40 40 7434 1 . GLN 41 41 7434 1 . ALA 42 42 7434 1 . PRO 43 43 7434 1 . GLY 44 44 7434 1 . LYS 45 45 7434 1 . GLU 46 46 7434 1 . ARG 47 47 7434 1 . GLU 48 48 7434 1 . PHE 49 49 7434 1 . VAL 50 50 7434 1 . ALA 51 51 7434 1 . ALA 52 52 7434 1 . ILE 53 53 7434 1 . SER 54 54 7434 1 . TRP 55 55 7434 1 . ARG 56 56 7434 1 . GLY 57 57 7434 1 . GLY 58 58 7434 1 . ASN 59 59 7434 1 . THR 60 60 7434 1 . TYR 61 61 7434 1 . TYR 62 62 7434 1 . ALA 63 63 7434 1 . ASP 64 64 7434 1 . SER 65 65 7434 1 . VAL 66 66 7434 1 . LYS 67 67 7434 1 . GLY 68 68 7434 1 . ARG 69 69 7434 1 . PHE 70 70 7434 1 . THR 71 71 7434 1 . ILE 72 72 7434 1 . SER 73 73 7434 1 . ARG 74 74 7434 1 . ASP 75 75 7434 1 . ASN 76 76 7434 1 . ALA 77 77 7434 1 . LYS 78 78 7434 1 . ASN 79 79 7434 1 . THR 80 80 7434 1 . VAL 81 81 7434 1 . TRP 82 82 7434 1 . LEU 83 83 7434 1 . GLN 84 84 7434 1 . MET 85 85 7434 1 . ASN 86 86 7434 1 . SER 87 87 7434 1 . LEU 88 88 7434 1 . LYS 89 89 7434 1 . PRO 90 90 7434 1 . GLU 91 91 7434 1 . ASP 92 92 7434 1 . THR 93 93 7434 1 . ALA 94 94 7434 1 . VAL 95 95 7434 1 . TYR 96 96 7434 1 . TYR 97 97 7434 1 . CYS 98 98 7434 1 . SER 99 99 7434 1 . GLY 100 100 7434 1 . PHE 101 101 7434 1 . VAL 102 102 7434 1 . ARG 103 103 7434 1 . THR 104 104 7434 1 . ARG 105 105 7434 1 . ASP 106 106 7434 1 . ASP 107 107 7434 1 . PRO 108 108 7434 1 . SER 109 109 7434 1 . ARG 110 110 7434 1 . ILE 111 111 7434 1 . ARG 112 112 7434 1 . ASN 113 113 7434 1 . TYR 114 114 7434 1 . TRP 115 115 7434 1 . GLY 116 116 7434 1 . GLN 117 117 7434 1 . GLY 118 118 7434 1 . THR 119 119 7434 1 . GLN 120 120 7434 1 . VAL 121 121 7434 1 . THR 122 122 7434 1 . VAL 123 123 7434 1 . SER 124 124 7434 1 . THR 125 125 7434 1 . ALA 126 126 7434 1 . ALA 127 127 7434 1 . ALA 128 128 7434 1 . LEU 129 129 7434 1 . GLU 130 130 7434 1 . HIS 131 131 7434 1 . HIS 132 132 7434 1 . HIS 133 133 7434 1 . HIS 134 134 7434 1 . HIS 135 135 7434 1 . HIS 136 136 7434 1 stop_ save_ save_PABPN1pept _Entity.Sf_category entity _Entity.Sf_framecode PABPN1pept _Entity.Entry_ID 7434 _Entity.ID 2 _Entity.BMRB_code . _Entity.Name PABPN1pept _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 ; AIEDPELEAIKARVREMEEE AEKLKELQNEVK ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 32 _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 . 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 . ALA . 7434 2 2 . ILE . 7434 2 3 . GLU . 7434 2 4 . ASP . 7434 2 5 . PRO . 7434 2 6 . GLU . 7434 2 7 . LEU . 7434 2 8 . GLU . 7434 2 9 . ALA . 7434 2 10 . ILE . 7434 2 11 . LYS . 7434 2 12 . ALA . 7434 2 13 . ARG . 7434 2 14 . VAL . 7434 2 15 . ARG . 7434 2 16 . GLU . 7434 2 17 . MET . 7434 2 18 . GLU . 7434 2 19 . GLU . 7434 2 20 . GLU . 7434 2 21 . ALA . 7434 2 22 . GLU . 7434 2 23 . LYS . 7434 2 24 . LEU . 7434 2 25 . LYS . 7434 2 26 . GLU . 7434 2 27 . LEU . 7434 2 28 . GLN . 7434 2 29 . ASN . 7434 2 30 . GLU . 7434 2 31 . VAL . 7434 2 32 . LYS . 7434 2 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . ALA 1 1 7434 2 . ILE 2 2 7434 2 . GLU 3 3 7434 2 . ASP 4 4 7434 2 . PRO 5 5 7434 2 . GLU 6 6 7434 2 . LEU 7 7 7434 2 . GLU 8 8 7434 2 . ALA 9 9 7434 2 . ILE 10 10 7434 2 . LYS 11 11 7434 2 . ALA 12 12 7434 2 . ARG 13 13 7434 2 . VAL 14 14 7434 2 . ARG 15 15 7434 2 . GLU 16 16 7434 2 . MET 17 17 7434 2 . GLU 18 18 7434 2 . GLU 19 19 7434 2 . GLU 20 20 7434 2 . ALA 21 21 7434 2 . GLU 22 22 7434 2 . LYS 23 23 7434 2 . LEU 24 24 7434 2 . LYS 25 25 7434 2 . GLU 26 26 7434 2 . LEU 27 27 7434 2 . GLN 28 28 7434 2 . ASN 29 29 7434 2 . GLU 30 30 7434 2 . VAL 31 31 7434 2 . LYS 32 32 7434 2 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 7434 _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 $3F5_VHH . 9844 organism . 'Lama glama' 'Lama glama' . . Eukaryota Metazoa Lama glama . . . . . . . . . . . . . . . . . . . . . 7434 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 7434 _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 $3F5_VHH . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . . . . . . . . . . . . . . pet28 . . . . . . 7434 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 7434 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details '3F5+PABPN1 pet' _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 '3F5 VHH' '[U-98% 15N]' . . 1 $3F5_VHH . . 1.6 . . mM . . . . 7434 1 2 'PABPN1 pept' '[U-98% 15N]' . . 2 $PABPN1pept . . 1.6 . . mM . . . . 7434 1 3 H2O 'natural abundance' . . . . . . 90 . . % . . . . 7434 1 4 D2O 'natural abundance' . . . . . . 10 . . % . . . . 7434 1 5 NaCl 'natural abundance' . . . . . . 150 . . mM . . . . 7434 1 stop_ save_ save_sample_2 _Sample.Sf_category sample _Sample.Sf_framecode sample_2 _Sample.Entry_ID 7434 _Sample.ID 2 _Sample.Type solution _Sample.Sub_type . _Sample.Details '3F5+PABPN1 pet' _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 '3F5 VHH' '[U-98% 13C; U-98% 15N]' . . 1 $3F5_VHH . . 1.6 . . mM . . . . 7434 2 2 'PABPN1 pept' '[U-98% 13C; U-98% 15N]' . . 2 $PABPN1pept . . 1.6 . . mM . . . . 7434 2 3 H2O 'natural abundance' . . . . . . 90 . . % . . . . 7434 2 4 D2O 'natural abundance' . . . . . . 10 . . % . . . . 7434 2 5 NaCl 'natural abundance' . . . . . . 150 . . mM . . . . 7434 2 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 7434 _Sample_condition_list.ID 1 _Sample_condition_list.Details '3F5 bound to PABPN1 pept' loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 0.15 . M 7434 1 pH 6.5 . pH 7434 1 pressure 1 . atm 7434 1 temperature 313 . K 7434 1 stop_ save_ ############################ # Computer software used # ############################ save_ANSIG _Software.Sf_category software _Software.Sf_framecode ANSIG _Software.Entry_ID 7434 _Software.ID 1 _Software.Name ANSIG _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Kraulis . . 7434 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 7434 1 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 7434 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model DMX _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 7434 _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 DMX . 600 . . . 7434 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 7434 _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 . . . . . . . . . . . . . . . . 7434 1 2 '3D HNCA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 7434 1 3 '3D HNCACB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 7434 1 4 '3D HN(CO)CA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 7434 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 7434 _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 0.00 na indirect 0.251449530 . . . . . . . . . 7434 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . . . . . 7434 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.101329118 . . . . . . . . . 7434 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 7434 _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 . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' . . . 7434 1 2 '3D HNCA' . . . 7434 1 3 '3D HNCACB' . . . 7434 1 4 '3D HN(CO)CA' . . . 7434 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 3 3 GLU CA C 13 57.22 0.07 . 1 . . . . 3 GLU CA . 7434 1 2 . 1 1 3 3 GLU CB C 13 30.22 0.07 . 1 . . . . 3 GLU CB . 7434 1 3 . 1 1 4 4 VAL H H 1 8.003 0.005 . 1 . . . . 4 VAL H . 7434 1 4 . 1 1 4 4 VAL CA C 13 62.13 0.07 . 1 . . . . 4 VAL CA . 7434 1 5 . 1 1 4 4 VAL CB C 13 32.65 0.07 . 1 . . . . 4 VAL CB . 7434 1 6 . 1 1 4 4 VAL N N 15 129.1 0.05 . 1 . . . . 4 VAL N . 7434 1 7 . 1 1 5 5 GLN H H 1 8.401 0.005 . 1 . . . . 5 GLN H . 7434 1 8 . 1 1 5 5 GLN CA C 13 54.65 0.07 . 1 . . . . 5 GLN CA . 7434 1 9 . 1 1 5 5 GLN CB C 13 29.44 0.07 . 1 . . . . 5 GLN CB . 7434 1 10 . 1 1 5 5 GLN N N 15 125.47 0.05 . 1 . . . . 5 GLN N . 7434 1 11 . 1 1 6 6 LEU H H 1 8.508 0.005 . 1 . . . . 6 LEU H . 7434 1 12 . 1 1 6 6 LEU CA C 13 53.27 0.07 . 1 . . . . 6 LEU CA . 7434 1 13 . 1 1 6 6 LEU CB C 13 43.03 0.07 . 1 . . . . 6 LEU CB . 7434 1 14 . 1 1 6 6 LEU N N 15 124.89 0.05 . 1 . . . . 6 LEU N . 7434 1 15 . 1 1 7 7 VAL H H 1 8.391 0.005 . 1 . . . . 7 VAL H . 7434 1 16 . 1 1 7 7 VAL CA C 13 62.31 0.07 . 1 . . . . 7 VAL CA . 7434 1 17 . 1 1 7 7 VAL CB C 13 34.77 0.07 . 1 . . . . 7 VAL CB . 7434 1 18 . 1 1 7 7 VAL N N 15 120.92 0.05 . 1 . . . . 7 VAL N . 7434 1 19 . 1 1 8 8 GLU H H 1 9.498 0.005 . 1 . . . . 8 GLU H . 7434 1 20 . 1 1 8 8 GLU CA C 13 56.04 0.07 . 1 . . . . 8 GLU CA . 7434 1 21 . 1 1 8 8 GLU CB C 13 31.38 0.07 . 1 . . . . 8 GLU CB . 7434 1 22 . 1 1 8 8 GLU N N 15 130.12 0.05 . 1 . . . . 8 GLU N . 7434 1 23 . 1 1 9 9 SER H H 1 9.202 0.005 . 1 . . . . 9 SER H . 7434 1 24 . 1 1 9 9 SER CA C 13 57.91 0.07 . 1 . . . . 9 SER CA . 7434 1 25 . 1 1 9 9 SER CB C 13 65.53 0.07 . 1 . . . . 9 SER CB . 7434 1 26 . 1 1 9 9 SER N N 15 114.81 0.05 . 1 . . . . 9 SER N . 7434 1 27 . 1 1 10 10 GLY H H 1 8.455 0.005 . 1 . . . . 10 GLY H . 7434 1 28 . 1 1 10 10 GLY CA C 13 44.56 0.07 . 1 . . . . 10 GLY CA . 7434 1 29 . 1 1 10 10 GLY N N 15 108.09 0.05 . 1 . . . . 10 GLY N . 7434 1 30 . 1 1 11 11 GLY H H 1 7.817 0.005 . 1 . . . . 11 GLY H . 7434 1 31 . 1 1 11 11 GLY CA C 13 45.01 0.07 . 1 . . . . 11 GLY CA . 7434 1 32 . 1 1 11 11 GLY N N 15 105.66 0.05 . 1 . . . . 11 GLY N . 7434 1 33 . 1 1 12 12 GLY H H 1 7.582 0.005 . 1 . . . . 12 GLY H . 7434 1 34 . 1 1 12 12 GLY CA C 13 44.69 0.07 . 1 . . . . 12 GLY CA . 7434 1 35 . 1 1 12 12 GLY N N 15 107.17 0.05 . 1 . . . . 12 GLY N . 7434 1 36 . 1 1 13 13 LEU H H 1 8.035 0.005 . 1 . . . . 13 LEU H . 7434 1 37 . 1 1 13 13 LEU CA C 13 54.07 0.07 . 1 . . . . 13 LEU CA . 7434 1 38 . 1 1 13 13 LEU CB C 13 46.27 0.07 . 1 . . . . 13 LEU CB . 7434 1 39 . 1 1 13 13 LEU N N 15 122.84 0.05 . 1 . . . . 13 LEU N . 7434 1 40 . 1 1 14 14 VAL H H 1 8.928 0.005 . 1 . . . . 14 VAL H . 7434 1 41 . 1 1 14 14 VAL CA C 13 59.43 0.07 . 1 . . . . 14 VAL CA . 7434 1 42 . 1 1 14 14 VAL CB C 13 35.38 0.07 . 1 . . . . 14 VAL CB . 7434 1 43 . 1 1 14 14 VAL N N 15 124.42 0.05 . 1 . . . . 14 VAL N . 7434 1 44 . 1 1 15 15 GLN H H 1 8.205 0.005 . 1 . . . . 15 GLN H . 7434 1 45 . 1 1 15 15 GLN CA C 13 54.96 0.07 . 1 . . . . 15 GLN CA . 7434 1 46 . 1 1 15 15 GLN CB C 13 29.61 0.07 . 1 . . . . 15 GLN CB . 7434 1 47 . 1 1 15 15 GLN N N 15 123.4 0.05 . 1 . . . . 15 GLN N . 7434 1 48 . 1 1 16 16 ALA H H 1 8.084 0.005 . 1 . . . . 16 ALA H . 7434 1 49 . 1 1 16 16 ALA CA C 13 53.68 0.07 . 1 . . . . 16 ALA CA . 7434 1 50 . 1 1 16 16 ALA CB C 13 17.66 0.07 . 1 . . . . 16 ALA CB . 7434 1 51 . 1 1 16 16 ALA N N 15 124.23 0.05 . 1 . . . . 16 ALA N . 7434 1 52 . 1 1 17 17 GLY H H 1 9.583 0.005 . 1 . . . . 17 GLY H . 7434 1 53 . 1 1 17 17 GLY CA C 13 44.71 0.07 . 1 . . . . 17 GLY CA . 7434 1 54 . 1 1 17 17 GLY N N 15 113.11 0.05 . 1 . . . . 17 GLY N . 7434 1 55 . 1 1 18 18 GLY H H 1 8.419 0.005 . 1 . . . . 18 GLY H . 7434 1 56 . 1 1 18 18 GLY CA C 13 44.33 0.07 . 1 . . . . 18 GLY CA . 7434 1 57 . 1 1 18 18 GLY N N 15 109.37 0.05 . 1 . . . . 18 GLY N . 7434 1 58 . 1 1 19 19 SER H H 1 7.811 0.005 . 1 . . . . 19 SER H . 7434 1 59 . 1 1 19 19 SER CA C 13 56.3 0.07 . 1 . . . . 19 SER CA . 7434 1 60 . 1 1 19 19 SER CB C 13 67.21 0.07 . 1 . . . . 19 SER CB . 7434 1 61 . 1 1 19 19 SER N N 15 109.83 0.05 . 1 . . . . 19 SER N . 7434 1 62 . 1 1 20 20 LEU H H 1 8.435 0.005 . 1 . . . . 20 LEU H . 7434 1 63 . 1 1 20 20 LEU CA C 13 54.47 0.07 . 1 . . . . 20 LEU CA . 7434 1 64 . 1 1 20 20 LEU CB C 13 47.45 0.07 . 1 . . . . 20 LEU CB . 7434 1 65 . 1 1 20 20 LEU N N 15 121.84 0.05 . 1 . . . . 20 LEU N . 7434 1 66 . 1 1 21 21 ARG H H 1 8.095 0.005 . 1 . . . . 21 ARG H . 7434 1 67 . 1 1 21 21 ARG CA C 13 54.36 0.07 . 1 . . . . 21 ARG CA . 7434 1 68 . 1 1 21 21 ARG CB C 13 32.52 0.07 . 1 . . . . 21 ARG CB . 7434 1 69 . 1 1 21 21 ARG N N 15 123.25 0.05 . 1 . . . . 21 ARG N . 7434 1 70 . 1 1 22 22 LEU H H 1 8.661 0.005 . 1 . . . . 22 LEU H . 7434 1 71 . 1 1 22 22 LEU CA C 13 52.9 0.07 . 1 . . . . 22 LEU CA . 7434 1 72 . 1 1 22 22 LEU CB C 13 44.13 0.07 . 1 . . . . 22 LEU CB . 7434 1 73 . 1 1 22 22 LEU N N 15 126.78 0.05 . 1 . . . . 22 LEU N . 7434 1 74 . 1 1 23 23 SER H H 1 8.807 0.005 . 1 . . . . 23 SER H . 7434 1 75 . 1 1 23 23 SER CA C 13 56.52 0.07 . 1 . . . . 23 SER CA . 7434 1 76 . 1 1 23 23 SER CB C 13 66.66 0.07 . 1 . . . . 23 SER CB . 7434 1 77 . 1 1 23 23 SER N N 15 113.91 0.05 . 1 . . . . 23 SER N . 7434 1 78 . 1 1 24 24 CYS H H 1 8.963 0.005 . 1 . . . . 24 CYS H . 7434 1 79 . 1 1 24 24 CYS CA C 13 53.36 0.07 . 1 . . . . 24 CYS CA . 7434 1 80 . 1 1 24 24 CYS CB C 13 41.93 0.07 . 1 . . . . 24 CYS CB . 7434 1 81 . 1 1 24 24 CYS N N 15 122.37 0.05 . 1 . . . . 24 CYS N . 7434 1 82 . 1 1 25 25 ALA H H 1 8.255 0.005 . 1 . . . . 25 ALA H . 7434 1 83 . 1 1 25 25 ALA CA C 13 49.79 0.07 . 1 . . . . 25 ALA CA . 7434 1 84 . 1 1 25 25 ALA CB C 13 21.74 0.07 . 1 . . . . 25 ALA CB . 7434 1 85 . 1 1 25 25 ALA N N 15 128.22 0.05 . 1 . . . . 25 ALA N . 7434 1 86 . 1 1 26 26 ALA H H 1 8.116 0.005 . 1 . . . . 26 ALA H . 7434 1 87 . 1 1 26 26 ALA CA C 13 50 0.07 . 1 . . . . 26 ALA CA . 7434 1 88 . 1 1 26 26 ALA CB C 13 19.21 0.07 . 1 . . . . 26 ALA CB . 7434 1 89 . 1 1 26 26 ALA N N 15 124.26 0.05 . 1 . . . . 26 ALA N . 7434 1 90 . 1 1 27 27 SER H H 1 8.527 0.005 . 1 . . . . 27 SER H . 7434 1 91 . 1 1 27 27 SER CA C 13 58.1 0.07 . 1 . . . . 27 SER CA . 7434 1 92 . 1 1 27 27 SER CB C 13 64.14 0.07 . 1 . . . . 27 SER CB . 7434 1 93 . 1 1 27 27 SER N N 15 118.63 0.05 . 1 . . . . 27 SER N . 7434 1 94 . 1 1 28 28 GLY H H 1 8.423 0.005 . 1 . . . . 28 GLY H . 7434 1 95 . 1 1 28 28 GLY CA C 13 44.93 0.07 . 1 . . . . 28 GLY CA . 7434 1 96 . 1 1 28 28 GLY N N 15 109.52 0.05 . 1 . . . . 28 GLY N . 7434 1 97 . 1 1 29 29 ARG H H 1 8.049 0.005 . 1 . . . . 29 ARG H . 7434 1 98 . 1 1 29 29 ARG CA C 13 56.4 0.07 . 1 . . . . 29 ARG CA . 7434 1 99 . 1 1 29 29 ARG CB C 13 31.21 0.07 . 1 . . . . 29 ARG CB . 7434 1 100 . 1 1 29 29 ARG N N 15 119.06 0.05 . 1 . . . . 29 ARG N . 7434 1 101 . 1 1 30 30 THR H H 1 7.993 0.005 . 1 . . . . 30 THR H . 7434 1 102 . 1 1 30 30 THR CA C 13 62.04 0.07 . 1 . . . . 30 THR CA . 7434 1 103 . 1 1 30 30 THR CB C 13 70.32 0.07 . 1 . . . . 30 THR CB . 7434 1 104 . 1 1 30 30 THR N N 15 114 0.05 . 1 . . . . 30 THR N . 7434 1 105 . 1 1 31 31 PHE H H 1 8.704 0.005 . 1 . . . . 31 PHE H . 7434 1 106 . 1 1 31 31 PHE CA C 13 58.44 0.07 . 1 . . . . 31 PHE CA . 7434 1 107 . 1 1 31 31 PHE CB C 13 39.19 0.07 . 1 . . . . 31 PHE CB . 7434 1 108 . 1 1 31 31 PHE N N 15 126.8 0.05 . 1 . . . . 31 PHE N . 7434 1 109 . 1 1 32 32 SER H H 1 8.021 0.005 . 1 . . . . 32 SER H . 7434 1 110 . 1 1 32 32 SER CA C 13 56.46 0.07 . 1 . . . . 32 SER CA . 7434 1 111 . 1 1 32 32 SER CB C 13 63.51 0.07 . 1 . . . . 32 SER CB . 7434 1 112 . 1 1 32 32 SER N N 15 121.17 0.05 . 1 . . . . 32 SER N . 7434 1 113 . 1 1 33 33 GLY CA C 13 44.81 0.07 . 1 . . . . 33 GLY CA . 7434 1 114 . 1 1 34 34 TYR H H 1 8.114 0.005 . 1 . . . . 34 TYR H . 7434 1 115 . 1 1 34 34 TYR CA C 13 59.27 0.07 . 1 . . . . 34 TYR CA . 7434 1 116 . 1 1 34 34 TYR CB C 13 39.37 0.07 . 1 . . . . 34 TYR CB . 7434 1 117 . 1 1 34 34 TYR N N 15 115.66 0.05 . 1 . . . . 34 TYR N . 7434 1 118 . 1 1 35 35 GLY CA C 13 45.66 0.07 . 1 . . . . 35 GLY CA . 7434 1 119 . 1 1 36 36 MET H H 1 8.327 0.005 . 1 . . . . 36 MET H . 7434 1 120 . 1 1 36 36 MET CA C 13 54.34 0.07 . 1 . . . . 36 MET CA . 7434 1 121 . 1 1 36 36 MET CB C 13 39.02 0.07 . 1 . . . . 36 MET CB . 7434 1 122 . 1 1 36 36 MET N N 15 115.98 0.05 . 1 . . . . 36 MET N . 7434 1 123 . 1 1 37 37 GLY H H 1 9.261 0.005 . 1 . . . . 37 GLY H . 7434 1 124 . 1 1 37 37 GLY CA C 13 45.56 0.07 . 1 . . . . 37 GLY CA . 7434 1 125 . 1 1 37 37 GLY N N 15 106.05 0.07 . 1 . . . . 37 GLY N . 7434 1 126 . 1 1 38 38 TRP H H 1 9.544 0.005 . 1 . . . . 38 TRP H . 7434 1 127 . 1 1 38 38 TRP CA C 13 55.32 0.07 . 1 . . . . 38 TRP CA . 7434 1 128 . 1 1 38 38 TRP CB C 13 32.95 0.07 . 1 . . . . 38 TRP CB . 7434 1 129 . 1 1 38 38 TRP N N 15 116.67 0.05 . 1 . . . . 38 TRP N . 7434 1 130 . 1 1 39 39 PHE H H 1 9.909 0.005 . 1 . . . . 39 PHE H . 7434 1 131 . 1 1 39 39 PHE CA C 13 55.77 0.07 . 1 . . . . 39 PHE CA . 7434 1 132 . 1 1 39 39 PHE CB C 13 43.99 0.07 . 1 . . . . 39 PHE CB . 7434 1 133 . 1 1 39 39 PHE N N 15 122 0.05 . 1 . . . . 39 PHE N . 7434 1 134 . 1 1 40 40 ARG H H 1 9.962 0.005 . 1 . . . . 40 ARG H . 7434 1 135 . 1 1 40 40 ARG CA C 13 53.89 0.07 . 1 . . . . 40 ARG CA . 7434 1 136 . 1 1 40 40 ARG CB C 13 31.92 0.07 . 1 . . . . 40 ARG CB . 7434 1 137 . 1 1 40 40 ARG N N 15 117.69 0.05 . 1 . . . . 40 ARG N . 7434 1 138 . 1 1 41 41 GLN H H 1 9.352 0.005 . 1 . . . . 41 GLN H . 7434 1 139 . 1 1 41 41 GLN CA C 13 55.1 0.07 . 1 . . . . 41 GLN CA . 7434 1 140 . 1 1 41 41 GLN CB C 13 32.21 0.07 . 1 . . . . 41 GLN CB . 7434 1 141 . 1 1 41 41 GLN N N 15 122.13 0.05 . 1 . . . . 41 GLN N . 7434 1 142 . 1 1 42 42 ALA H H 1 9.522 0.005 . 1 . . . . 42 ALA H . 7434 1 143 . 1 1 42 42 ALA CA C 13 49.7 0.07 . 1 . . . . 42 ALA CA . 7434 1 144 . 1 1 42 42 ALA CB C 13 18.18 0.07 . 1 . . . . 42 ALA CB . 7434 1 145 . 1 1 43 43 PRO CA C 13 64.11 0.07 . 1 . . . . 43 PRO CA . 7434 1 146 . 1 1 43 43 PRO CB C 13 31.32 0.07 . 1 . . . . 43 PRO CB . 7434 1 147 . 1 1 44 44 GLY H H 1 8.655 0.005 . 1 . . . . 44 GLY H . 7434 1 148 . 1 1 44 44 GLY CA C 13 45.61 0.07 . 1 . . . . 44 GLY CA . 7434 1 149 . 1 1 44 44 GLY N N 15 112.59 0.05 . 1 . . . . 44 GLY N . 7434 1 150 . 1 1 45 45 LYS H H 1 7.885 0.005 . 1 . . . . 45 LYS H . 7434 1 151 . 1 1 45 45 LYS CA C 13 54.23 0.07 . 1 . . . . 45 LYS CA . 7434 1 152 . 1 1 45 45 LYS CB C 13 35.22 0.07 . 1 . . . . 45 LYS CB . 7434 1 153 . 1 1 45 45 LYS N N 15 119.88 0.05 . 1 . . . . 45 LYS N . 7434 1 154 . 1 1 46 46 GLU H H 1 8.361 0.005 . 1 . . . . 46 GLU H . 7434 1 155 . 1 1 46 46 GLU CA C 13 55.3 0.07 . 1 . . . . 46 GLU CA . 7434 1 156 . 1 1 46 46 GLU CB C 13 29.86 0.07 . 1 . . . . 46 GLU CB . 7434 1 157 . 1 1 46 46 GLU N N 15 118.52 0.05 . 1 . . . . 46 GLU N . 7434 1 158 . 1 1 47 47 ARG H H 1 8.706 0.005 . 1 . . . . 47 ARG H . 7434 1 159 . 1 1 47 47 ARG CA C 13 57.19 0.07 . 1 . . . . 47 ARG CA . 7434 1 160 . 1 1 47 47 ARG CB C 13 29.96 0.07 . 1 . . . . 47 ARG CB . 7434 1 161 . 1 1 47 47 ARG N N 15 122.9 0.05 . 1 . . . . 47 ARG N . 7434 1 162 . 1 1 48 48 GLU H H 1 9.611 0.005 . 1 . . . . 48 GLU H . 7434 1 163 . 1 1 48 48 GLU CA C 13 54.01 0.07 . 1 . . . . 48 GLU CA . 7434 1 164 . 1 1 48 48 GLU CB C 13 33.45 0.07 . 1 . . . . 48 GLU CB . 7434 1 165 . 1 1 48 48 GLU N N 15 125.51 0.05 . 1 . . . . 48 GLU N . 7434 1 166 . 1 1 49 49 PHE H H 1 9.157 0.005 . 1 . . . . 49 PHE H . 7434 1 167 . 1 1 49 49 PHE CA C 13 53.34 0.07 . 1 . . . . 49 PHE CA . 7434 1 168 . 1 1 49 49 PHE CB C 13 39.45 0.07 . 1 . . . . 49 PHE CB . 7434 1 169 . 1 1 49 49 PHE N N 15 125.11 0.05 . 1 . . . . 49 PHE N . 7434 1 170 . 1 1 50 50 VAL H H 1 7.181 0.005 . 1 . . . . 50 VAL H . 7434 1 171 . 1 1 50 50 VAL CA C 13 63.86 0.07 . 1 . . . . 50 VAL CA . 7434 1 172 . 1 1 50 50 VAL CB C 13 32.21 0.07 . 1 . . . . 50 VAL CB . 7434 1 173 . 1 1 50 50 VAL N N 15 124.6 0.05 . 1 . . . . 50 VAL N . 7434 1 174 . 1 1 51 51 ALA H H 1 6.931 0.005 . 1 . . . . 51 ALA H . 7434 1 175 . 1 1 51 51 ALA CA C 13 51.52 0.07 . 1 . . . . 51 ALA CA . 7434 1 176 . 1 1 51 51 ALA CB C 13 23.4 0.07 . 1 . . . . 51 ALA CB . 7434 1 177 . 1 1 51 51 ALA N N 15 115.37 0.05 . 1 . . . . 51 ALA N . 7434 1 178 . 1 1 52 52 ALA H H 1 9.249 0.005 . 1 . . . . 52 ALA H . 7434 1 179 . 1 1 52 52 ALA CA C 13 51.49 0.07 . 1 . . . . 52 ALA CA . 7434 1 180 . 1 1 52 52 ALA CB C 13 23.65 0.07 . 1 . . . . 52 ALA CB . 7434 1 181 . 1 1 52 52 ALA N N 15 119.85 0.05 . 1 . . . . 52 ALA N . 7434 1 182 . 1 1 53 53 ILE H H 1 8.878 0.005 . 1 . . . . 53 ILE H . 7434 1 183 . 1 1 53 53 ILE CA C 13 57.69 0.07 . 1 . . . . 53 ILE CA . 7434 1 184 . 1 1 53 53 ILE CB C 13 42.85 0.07 . 1 . . . . 53 ILE CB . 7434 1 185 . 1 1 53 53 ILE N N 15 117.42 0.05 . 1 . . . . 53 ILE N . 7434 1 186 . 1 1 54 54 SER H H 1 9.076 0.005 . 1 . . . . 54 SER H . 7434 1 187 . 1 1 54 54 SER CA C 13 58.09 0.07 . 1 . . . . 54 SER CA . 7434 1 188 . 1 1 54 54 SER CB C 13 64.66 0.07 . 1 . . . . 54 SER CB . 7434 1 189 . 1 1 54 54 SER N N 15 121.56 0.05 . 1 . . . . 54 SER N . 7434 1 190 . 1 1 55 55 TRP H H 1 9.003 0.005 . 1 . . . . 55 TRP H . 7434 1 191 . 1 1 55 55 TRP CA C 13 61.04 0.07 . 1 . . . . 55 TRP CA . 7434 1 192 . 1 1 55 55 TRP CB C 13 31.43 0.07 . 1 . . . . 55 TRP CB . 7434 1 193 . 1 1 55 55 TRP N N 15 126.17 0.05 . 1 . . . . 55 TRP N . 7434 1 194 . 1 1 56 56 ARG H H 1 10.207 0.005 . 1 . . . . 56 ARG H . 7434 1 195 . 1 1 56 56 ARG CA C 13 59.4 0.07 . 1 . . . . 56 ARG CA . 7434 1 196 . 1 1 56 56 ARG CB C 13 28.84 0.07 . 1 . . . . 56 ARG CB . 7434 1 197 . 1 1 56 56 ARG N N 15 122.24 0.05 . 1 . . . . 56 ARG N . 7434 1 198 . 1 1 57 57 GLY H H 1 9.233 0.005 . 1 . . . . 57 GLY H . 7434 1 199 . 1 1 57 57 GLY CA C 13 46.04 0.07 . 1 . . . . 57 GLY CA . 7434 1 200 . 1 1 57 57 GLY N N 15 106.66 0.05 . 1 . . . . 57 GLY N . 7434 1 201 . 1 1 58 58 GLY H H 1 7.377 0.005 . 1 . . . . 58 GLY H . 7434 1 202 . 1 1 58 58 GLY CA C 13 45.89 0.07 . 1 . . . . 58 GLY CA . 7434 1 203 . 1 1 58 58 GLY N N 15 109.18 0.05 . 1 . . . . 58 GLY N . 7434 1 204 . 1 1 59 59 ASN H H 1 7.748 0.005 . 1 . . . . 59 ASN H . 7434 1 205 . 1 1 59 59 ASN CA C 13 53.19 0.07 . 1 . . . . 59 ASN CA . 7434 1 206 . 1 1 59 59 ASN CB C 13 40.11 0.07 . 1 . . . . 59 ASN CB . 7434 1 207 . 1 1 59 59 ASN N N 15 116.47 0.05 . 1 . . . . 59 ASN N . 7434 1 208 . 1 1 60 60 THR H H 1 8.195 0.005 . 1 . . . . 60 THR H . 7434 1 209 . 1 1 60 60 THR CA C 13 60.76 0.07 . 1 . . . . 60 THR CA . 7434 1 210 . 1 1 60 60 THR CB C 13 72.49 0.07 . 1 . . . . 60 THR CB . 7434 1 211 . 1 1 60 60 THR N N 15 108.48 0.05 . 1 . . . . 60 THR N . 7434 1 212 . 1 1 61 61 TYR H H 1 7.983 0.005 . 1 . . . . 61 TYR H . 7434 1 213 . 1 1 61 61 TYR CA C 13 56.14 0.07 . 1 . . . . 61 TYR CA . 7434 1 214 . 1 1 61 61 TYR CB C 13 42.47 0.07 . 1 . . . . 61 TYR CB . 7434 1 215 . 1 1 61 61 TYR N N 15 120.24 0.05 . 1 . . . . 61 TYR N . 7434 1 216 . 1 1 62 62 TYR H H 1 8.584 0.005 . 1 . . . . 62 TYR H . 7434 1 217 . 1 1 62 62 TYR CA C 13 57.09 0.07 . 1 . . . . 62 TYR CA . 7434 1 218 . 1 1 62 62 TYR CB C 13 42.49 0.07 . 1 . . . . 62 TYR CB . 7434 1 219 . 1 1 62 62 TYR N N 15 124.15 0.05 . 1 . . . . 62 TYR N . 7434 1 220 . 1 1 63 63 ALA H H 1 7.819 0.005 . 1 . . . . 63 ALA H . 7434 1 221 . 1 1 63 63 ALA CA C 13 51.89 0.07 . 1 . . . . 63 ALA CA . 7434 1 222 . 1 1 63 63 ALA CB C 13 19.57 0.07 . 1 . . . . 63 ALA CB . 7434 1 223 . 1 1 63 63 ALA N N 15 122.97 0.05 . 1 . . . . 63 ALA N . 7434 1 224 . 1 1 64 64 ASP H H 1 8.916 0.005 . 1 . . . . 64 ASP H . 7434 1 225 . 1 1 64 64 ASP CA C 13 57.77 0.07 . 1 . . . . 64 ASP CA . 7434 1 226 . 1 1 64 64 ASP CB C 13 40.22 0.07 . 1 . . . . 64 ASP CB . 7434 1 227 . 1 1 64 64 ASP N N 15 122.78 0.05 . 1 . . . . 64 ASP N . 7434 1 228 . 1 1 65 65 SER H H 1 8.096 0.005 . 1 . . . . 65 SER H . 7434 1 229 . 1 1 65 65 SER CA C 13 59.79 0.07 . 1 . . . . 65 SER CA . 7434 1 230 . 1 1 65 65 SER CB C 13 62.64 0.07 . 1 . . . . 65 SER CB . 7434 1 231 . 1 1 65 65 SER N N 15 110.59 0.05 . 1 . . . . 65 SER N . 7434 1 232 . 1 1 66 66 VAL H H 1 7.079 0.005 . 1 . . . . 66 VAL H . 7434 1 233 . 1 1 66 66 VAL CA C 13 60.28 0.07 . 1 . . . . 66 VAL CA . 7434 1 234 . 1 1 66 66 VAL CB C 13 31.56 0.07 . 1 . . . . 66 VAL CB . 7434 1 235 . 1 1 66 66 VAL N N 15 111.3 0.05 . 1 . . . . 66 VAL N . 7434 1 236 . 1 1 67 67 LYS H H 1 7.188 0.005 . 1 . . . . 67 LYS H . 7434 1 237 . 1 1 67 67 LYS CA C 13 51.22 0.07 . 1 . . . . 67 LYS CA . 7434 1 238 . 1 1 67 67 LYS CB C 13 32.27 0.05 . 1 . . . . 67 LYS CB . 7434 1 239 . 1 1 67 67 LYS N N 15 125.17 0.005 . 1 . . . . 67 LYS N . 7434 1 240 . 1 1 68 68 GLY H H 1 9.055 0.07 . 1 . . . . 68 GLY H . 7434 1 241 . 1 1 68 68 GLY CA C 13 45.23 0.07 . 1 . . . . 68 GLY CA . 7434 1 242 . 1 1 68 68 GLY N N 15 115.62 0.05 . 1 . . . . 68 GLY N . 7434 1 243 . 1 1 69 69 ARG H H 1 7.626 0.005 . 1 . . . . 69 ARG H . 7434 1 244 . 1 1 69 69 ARG CA C 13 57.27 0.07 . 1 . . . . 69 ARG CA . 7434 1 245 . 1 1 69 69 ARG CB C 13 30.99 0.07 . 1 . . . . 69 ARG CB . 7434 1 246 . 1 1 69 69 ARG N N 15 117.3 0.05 . 1 . . . . 69 ARG N . 7434 1 247 . 1 1 70 70 PHE H H 1 7.512 0.005 . 1 . . . . 70 PHE H . 7434 1 248 . 1 1 70 70 PHE CA C 13 52.19 0.07 . 1 . . . . 70 PHE CA . 7434 1 249 . 1 1 70 70 PHE CB C 13 39.12 0.07 . 1 . . . . 70 PHE CB . 7434 1 250 . 1 1 70 70 PHE N N 15 118.98 0.05 . 1 . . . . 70 PHE N . 7434 1 251 . 1 1 71 71 THR H H 1 8.913 0.005 . 1 . . . . 71 THR H . 7434 1 252 . 1 1 71 71 THR CA C 13 60.92 0.07 . 1 . . . . 71 THR CA . 7434 1 253 . 1 1 71 71 THR CB C 13 71.97 0.07 . 1 . . . . 71 THR CB . 7434 1 254 . 1 1 71 71 THR N N 15 112.68 0.05 . 1 . . . . 71 THR N . 7434 1 255 . 1 1 72 72 ILE H H 1 9.258 0.005 . 1 . . . . 72 ILE H . 7434 1 256 . 1 1 72 72 ILE CA C 13 57.9 0.07 . 1 . . . . 72 ILE CA . 7434 1 257 . 1 1 72 72 ILE CB C 13 42.35 0.07 . 1 . . . . 72 ILE CB . 7434 1 258 . 1 1 72 72 ILE N N 15 130.83 0.05 . 1 . . . . 72 ILE N . 7434 1 259 . 1 1 73 73 SER H H 1 8.593 0.005 . 1 . . . . 73 SER H . 7434 1 260 . 1 1 73 73 SER CA C 13 57.54 0.07 . 1 . . . . 73 SER CA . 7434 1 261 . 1 1 73 73 SER CB C 13 65.84 0.07 . 1 . . . . 73 SER CB . 7434 1 262 . 1 1 73 73 SER N N 15 118.99 0.05 . 1 . . . . 73 SER N . 7434 1 263 . 1 1 74 74 ARG H H 1 9.534 0.005 . 1 . . . . 74 ARG H . 7434 1 264 . 1 1 74 74 ARG CA C 13 54.13 0.07 . 1 . . . . 74 ARG CA . 7434 1 265 . 1 1 74 74 ARG CB C 13 33.11 0.07 . 1 . . . . 74 ARG CB . 7434 1 266 . 1 1 74 74 ARG N N 15 116.04 0.05 . 1 . . . . 74 ARG N . 7434 1 267 . 1 1 75 75 ASP H H 1 8.715 0.005 . 1 . . . . 75 ASP H . 7434 1 268 . 1 1 75 75 ASP CA C 13 52.56 0.07 . 1 . . . . 75 ASP CA . 7434 1 269 . 1 1 75 75 ASP CB C 13 43.63 0.07 . 1 . . . . 75 ASP CB . 7434 1 270 . 1 1 75 75 ASP N N 15 122.7 0.05 . 1 . . . . 75 ASP N . 7434 1 271 . 1 1 76 76 ASN H H 1 8.75 0.005 . 1 . . . . 76 ASN H . 7434 1 272 . 1 1 76 76 ASN CA C 13 56.04 0.07 . 1 . . . . 76 ASN CA . 7434 1 273 . 1 1 76 76 ASN CB C 13 37.7 0.07 . 1 . . . . 76 ASN CB . 7434 1 274 . 1 1 76 76 ASN N N 15 122.89 0.05 . 1 . . . . 76 ASN N . 7434 1 275 . 1 1 77 77 ALA H H 1 8.533 0.005 . 1 . . . . 77 ALA H . 7434 1 276 . 1 1 77 77 ALA CA C 13 54.22 0.07 . 1 . . . . 77 ALA CA . 7434 1 277 . 1 1 77 77 ALA CB C 13 18.51 0.07 . 1 . . . . 77 ALA CB . 7434 1 278 . 1 1 77 77 ALA N N 15 122.22 0.05 . 1 . . . . 77 ALA N . 7434 1 279 . 1 1 78 78 LYS H H 1 7.632 0.005 . 1 . . . . 78 LYS H . 7434 1 280 . 1 1 78 78 LYS CA C 13 55.15 0.07 . 1 . . . . 78 LYS CA . 7434 1 281 . 1 1 78 78 LYS CB C 13 33.16 0.07 . 1 . . . . 78 LYS CB . 7434 1 282 . 1 1 78 78 LYS N N 15 114.17 0.05 . 1 . . . . 78 LYS N . 7434 1 283 . 1 1 79 79 ASN H H 1 8.343 0.005 . 1 . . . . 79 ASN H . 7434 1 284 . 1 1 79 79 ASN CA C 13 54.27 0.07 . 1 . . . . 79 ASN CA . 7434 1 285 . 1 1 79 79 ASN CB C 13 38.54 0.07 . 1 . . . . 79 ASN CB . 7434 1 286 . 1 1 79 79 ASN N N 15 121.62 0.05 . 1 . . . . 79 ASN N . 7434 1 287 . 1 1 80 80 THR H H 1 7.421 0.005 . 1 . . . . 80 THR H . 7434 1 288 . 1 1 80 80 THR CA C 13 61.61 0.07 . 1 . . . . 80 THR CA . 7434 1 289 . 1 1 80 80 THR CB C 13 73.45 0.07 . 1 . . . . 80 THR CB . 7434 1 290 . 1 1 80 80 THR N N 15 108.82 0.05 . 1 . . . . 80 THR N . 7434 1 291 . 1 1 81 81 VAL H H 1 8.934 0.005 . 1 . . . . 81 VAL H . 7434 1 292 . 1 1 81 81 VAL CA C 13 58.55 0.07 . 1 . . . . 81 VAL CA . 7434 1 293 . 1 1 81 81 VAL CB C 13 35.66 0.07 . 1 . . . . 81 VAL CB . 7434 1 294 . 1 1 81 81 VAL N N 15 123.62 0.05 . 1 . . . . 81 VAL N . 7434 1 295 . 1 1 82 82 TRP H H 1 9.095 0.005 . 1 . . . . 82 TRP H . 7434 1 296 . 1 1 82 82 TRP CA C 13 57.18 0.07 . 1 . . . . 82 TRP CA . 7434 1 297 . 1 1 82 82 TRP CB C 13 32.37 0.07 . 1 . . . . 82 TRP CB . 7434 1 298 . 1 1 82 82 TRP N N 15 124.95 0.05 . 1 . . . . 82 TRP N . 7434 1 299 . 1 1 83 83 LEU H H 1 8.791 0.005 . 1 . . . . 83 LEU H . 7434 1 300 . 1 1 83 83 LEU CA C 13 52.76 0.07 . 1 . . . . 83 LEU CA . 7434 1 301 . 1 1 83 83 LEU CB C 13 43.16 0.07 . 1 . . . . 83 LEU CB . 7434 1 302 . 1 1 83 83 LEU N N 15 122.26 0.05 . 1 . . . . 83 LEU N . 7434 1 303 . 1 1 84 84 GLN H H 1 9.119 0.005 . 1 . . . . 84 GLN H . 7434 1 304 . 1 1 84 84 GLN CA C 13 54.69 0.07 . 1 . . . . 84 GLN CA . 7434 1 305 . 1 1 84 84 GLN CB C 13 28.83 0.07 . 1 . . . . 84 GLN CB . 7434 1 306 . 1 1 84 84 GLN N N 15 128.59 0.05 . 1 . . . . 84 GLN N . 7434 1 307 . 1 1 85 85 MET H H 1 8.799 0.005 . 1 . . . . 85 MET H . 7434 1 308 . 1 1 85 85 MET CA C 13 54.59 0.07 . 1 . . . . 85 MET CA . 7434 1 309 . 1 1 85 85 MET CB C 13 34.62 0.07 . 1 . . . . 85 MET CB . 7434 1 310 . 1 1 85 85 MET N N 15 127.58 0.05 . 1 . . . . 85 MET N . 7434 1 311 . 1 1 86 86 ASN H H 1 7.449 0.005 . 1 . . . . 86 ASN H . 7434 1 312 . 1 1 86 86 ASN CA C 13 51.09 0.07 . 1 . . . . 86 ASN CA . 7434 1 313 . 1 1 86 86 ASN CB C 13 40.85 0.07 . 1 . . . . 86 ASN CB . 7434 1 314 . 1 1 86 86 ASN N N 15 119.56 0.05 . 1 . . . . 86 ASN N . 7434 1 315 . 1 1 87 87 SER H H 1 8.544 0.005 . 1 . . . . 87 SER H . 7434 1 316 . 1 1 87 87 SER CA C 13 57.47 0.07 . 1 . . . . 87 SER CA . 7434 1 317 . 1 1 87 87 SER CB C 13 61.79 0.07 . 1 . . . . 87 SER CB . 7434 1 318 . 1 1 87 87 SER N N 15 111.05 0.05 . 1 . . . . 87 SER N . 7434 1 319 . 1 1 88 88 LEU H H 1 8.017 0.005 . 1 . . . . 88 LEU H . 7434 1 320 . 1 1 88 88 LEU CA C 13 56.41 0.07 . 1 . . . . 88 LEU CA . 7434 1 321 . 1 1 88 88 LEU CB C 13 42.61 0.07 . 1 . . . . 88 LEU CB . 7434 1 322 . 1 1 88 88 LEU N N 15 118.81 0.05 . 1 . . . . 88 LEU N . 7434 1 323 . 1 1 89 89 LYS H H 1 9.621 0.005 . 1 . . . . 89 LYS H . 7434 1 324 . 1 1 89 89 LYS CA C 13 53.17 0.07 . 1 . . . . 89 LYS CA . 7434 1 325 . 1 1 89 89 LYS CB C 13 33.97 0.07 . 1 . . . . 89 LYS CB . 7434 1 326 . 1 1 89 89 LYS N N 15 122.47 0.05 . 1 . . . . 89 LYS N . 7434 1 327 . 1 1 90 90 PRO CA C 13 66.15 0.07 . 1 . . . . 90 PRO CA . 7434 1 328 . 1 1 90 90 PRO CB C 13 31.53 0.07 . 1 . . . . 90 PRO CB . 7434 1 329 . 1 1 91 91 GLU H H 1 9.297 0.005 . 1 . . . . 91 GLU H . 7434 1 330 . 1 1 91 91 GLU CA C 13 58.61 0.07 . 1 . . . . 91 GLU CA . 7434 1 331 . 1 1 91 91 GLU CB C 13 28.06 0.07 . 1 . . . . 91 GLU CB . 7434 1 332 . 1 1 91 91 GLU N N 15 115.28 0.05 . 1 . . . . 91 GLU N . 7434 1 333 . 1 1 92 92 ASP H H 1 8.652 0.005 . 1 . . . . 92 ASP H . 7434 1 334 . 1 1 92 92 ASP CA C 13 54.96 0.07 . 1 . . . . 92 ASP CA . 7434 1 335 . 1 1 92 92 ASP CB C 13 41.95 0.07 . 1 . . . . 92 ASP CB . 7434 1 336 . 1 1 92 92 ASP N N 15 118.28 0.05 . 1 . . . . 92 ASP N . 7434 1 337 . 1 1 93 93 THR H H 1 7.851 0.005 . 1 . . . . 93 THR H . 7434 1 338 . 1 1 93 93 THR CA C 13 64.9 0.07 . 1 . . . . 93 THR CA . 7434 1 339 . 1 1 93 93 THR CB C 13 69.84 0.07 . 1 . . . . 93 THR CB . 7434 1 340 . 1 1 93 93 THR N N 15 120.62 0.05 . 1 . . . . 93 THR N . 7434 1 341 . 1 1 94 94 ALA H H 1 9.114 0.005 . 1 . . . . 94 ALA H . 7434 1 342 . 1 1 94 94 ALA CA C 13 52.53 0.07 . 1 . . . . 94 ALA CA . 7434 1 343 . 1 1 94 94 ALA CB C 13 21.4 0.07 . 1 . . . . 94 ALA CB . 7434 1 344 . 1 1 94 94 ALA N N 15 128.37 0.05 . 1 . . . . 94 ALA N . 7434 1 345 . 1 1 95 95 VAL H H 1 7.585 0.005 . 1 . . . . 95 VAL H . 7434 1 346 . 1 1 95 95 VAL CA C 13 62.92 0.07 . 1 . . . . 95 VAL CA . 7434 1 347 . 1 1 95 95 VAL CB C 13 31.7 0.07 . 1 . . . . 95 VAL CB . 7434 1 348 . 1 1 95 95 VAL N N 15 118.17 0.05 . 1 . . . . 95 VAL N . 7434 1 349 . 1 1 96 96 TYR H H 1 9.253 0.005 . 1 . . . . 96 TYR H . 7434 1 350 . 1 1 96 96 TYR CA C 13 57.92 0.07 . 1 . . . . 96 TYR CA . 7434 1 351 . 1 1 96 96 TYR CB C 13 40.03 0.07 . 1 . . . . 96 TYR CB . 7434 1 352 . 1 1 96 96 TYR N N 15 128.01 0.05 . 1 . . . . 96 TYR N . 7434 1 353 . 1 1 97 97 TYR H H 1 9.662 0.005 . 1 . . . . 97 TYR H . 7434 1 354 . 1 1 97 97 TYR CA C 13 56.72 0.07 . 1 . . . . 97 TYR CA . 7434 1 355 . 1 1 97 97 TYR CB C 13 42.78 0.07 . 1 . . . . 97 TYR CB . 7434 1 356 . 1 1 97 97 TYR N N 15 120.16 0.05 . 1 . . . . 97 TYR N . 7434 1 357 . 1 1 98 98 CYS CA C 13 53.24 0.07 . 1 . . . . 98 CYS CA . 7434 1 358 . 1 1 98 98 CYS CB C 13 41.96 0.07 . 1 . . . . 98 CYS CB . 7434 1 359 . 1 1 99 99 SER H H 1 8.58 0.005 . 1 . . . . 99 SER H . 7434 1 360 . 1 1 99 99 SER CA C 13 54.75 0.07 . 1 . . . . 99 SER CA . 7434 1 361 . 1 1 99 99 SER CB C 13 67.06 0.07 . 1 . . . . 99 SER CB . 7434 1 362 . 1 1 99 99 SER N N 15 116.92 0.05 . 1 . . . . 99 SER N . 7434 1 363 . 1 1 100 100 GLY H H 1 7.773 0.005 . 1 . . . . 100 GLY H . 7434 1 364 . 1 1 100 100 GLY CA C 13 43.99 0.07 . 1 . . . . 100 GLY CA . 7434 1 365 . 1 1 100 100 GLY N N 15 111.91 0.05 . 1 . . . . 100 GLY N . 7434 1 366 . 1 1 101 101 PHE H H 1 8.367 0.005 . 1 . . . . 101 PHE H . 7434 1 367 . 1 1 101 101 PHE CA C 13 56.56 0.07 . 1 . . . . 101 PHE CA . 7434 1 368 . 1 1 101 101 PHE CB C 13 39.49 0.07 . 1 . . . . 101 PHE CB . 7434 1 369 . 1 1 101 101 PHE N N 15 122.76 0.05 . 1 . . . . 101 PHE N . 7434 1 370 . 1 1 102 102 VAL H H 1 8.872 0.005 . 1 . . . . 102 VAL H . 7434 1 371 . 1 1 102 102 VAL CA C 13 60.03 0.07 . 1 . . . . 102 VAL CA . 7434 1 372 . 1 1 102 102 VAL CB C 13 35.62 0.07 . 1 . . . . 102 VAL CB . 7434 1 373 . 1 1 102 102 VAL N N 15 121.26 0.05 . 1 . . . . 102 VAL N . 7434 1 374 . 1 1 103 103 ARG H H 1 8.582 0.005 . 1 . . . . 103 ARG H . 7434 1 375 . 1 1 103 103 ARG CA C 13 55.93 0.07 . 1 . . . . 103 ARG CA . 7434 1 376 . 1 1 103 103 ARG CB C 13 30.91 0.07 . 1 . . . . 103 ARG CB . 7434 1 377 . 1 1 103 103 ARG N N 15 123.17 0.05 . 1 . . . . 103 ARG N . 7434 1 378 . 1 1 104 104 THR H H 1 7.912 0.005 . 1 . . . . 104 THR H . 7434 1 379 . 1 1 104 104 THR CA C 13 61.56 0.07 . 1 . . . . 104 THR CA . 7434 1 380 . 1 1 104 104 THR CB C 13 70.22 0.07 . 1 . . . . 104 THR CB . 7434 1 381 . 1 1 104 104 THR N N 15 112.86 0.05 . 1 . . . . 104 THR N . 7434 1 382 . 1 1 105 105 ARG H H 1 8.672 0.005 . 1 . . . . 105 ARG H . 7434 1 383 . 1 1 105 105 ARG CA C 13 58.29 0.07 . 1 . . . . 105 ARG CA . 7434 1 384 . 1 1 105 105 ARG CB C 13 29.9 0.07 . 1 . . . . 105 ARG CB . 7434 1 385 . 1 1 105 105 ARG N N 15 122.86 0.05 . 1 . . . . 105 ARG N . 7434 1 386 . 1 1 106 106 ASP H H 1 8.257 0.005 . 1 . . . . 106 ASP H . 7434 1 387 . 1 1 106 106 ASP CA C 13 54.63 0.07 . 1 . . . . 106 ASP CA . 7434 1 388 . 1 1 106 106 ASP CB C 13 40.61 0.07 . 1 . . . . 106 ASP CB . 7434 1 389 . 1 1 106 106 ASP N N 15 115.09 0.05 . 1 . . . . 106 ASP N . 7434 1 390 . 1 1 107 107 ASP H H 1 7.16 0.005 . 1 . . . . 107 ASP H . 7434 1 391 . 1 1 107 107 ASP CA C 13 51.24 0.07 . 1 . . . . 107 ASP CA . 7434 1 392 . 1 1 107 107 ASP CB C 13 41.64 0.07 . 1 . . . . 107 ASP CB . 7434 1 393 . 1 1 107 107 ASP N N 15 116.33 0.05 . 1 . . . . 107 ASP N . 7434 1 394 . 1 1 108 108 PRO CA C 13 64.14 0.07 . 1 . . . . 108 PRO CA . 7434 1 395 . 1 1 109 109 SER H H 1 8.377 0.005 . 1 . . . . 109 SER H . 7434 1 396 . 1 1 109 109 SER CA C 13 63.9 0.07 . 1 . . . . 109 SER CA . 7434 1 397 . 1 1 109 109 SER N N 15 113.86 0.05 . 1 . . . . 109 SER N . 7434 1 398 . 1 1 110 110 ARG CA C 13 54.17 0.07 . 1 . . . . 110 ARG CA . 7434 1 399 . 1 1 111 111 ILE H H 1 8.466 0.005 . 1 . . . . 111 ILE H . 7434 1 400 . 1 1 111 111 ILE CA C 13 60.16 0.07 . 1 . . . . 111 ILE CA . 7434 1 401 . 1 1 111 111 ILE N N 15 120.66 0.05 . 1 . . . . 111 ILE N . 7434 1 402 . 1 1 112 112 ARG H H 1 8.877 0.005 . 1 . . . . 112 ARG H . 7434 1 403 . 1 1 112 112 ARG CA C 13 53.77 0.07 . 1 . . . . 112 ARG CA . 7434 1 404 . 1 1 112 112 ARG CB C 13 32.57 0.07 . 1 . . . . 112 ARG CB . 7434 1 405 . 1 1 112 112 ARG N N 15 124.42 0.05 . 1 . . . . 112 ARG N . 7434 1 406 . 1 1 113 113 ASN H H 1 8.283 0.005 . 1 . . . . 113 ASN H . 7434 1 407 . 1 1 113 113 ASN CA C 13 52.46 0.07 . 1 . . . . 113 ASN CA . 7434 1 408 . 1 1 113 113 ASN CB C 13 40.32 0.07 . 1 . . . . 113 ASN CB . 7434 1 409 . 1 1 113 113 ASN N N 15 117.72 0.05 . 1 . . . . 113 ASN N . 7434 1 410 . 1 1 114 114 TYR H H 1 7.752 0.005 . 1 . . . . 114 TYR H . 7434 1 411 . 1 1 114 114 TYR CA C 13 56.17 0.07 . 1 . . . . 114 TYR CA . 7434 1 412 . 1 1 114 114 TYR CB C 13 40.91 0.07 . 1 . . . . 114 TYR CB . 7434 1 413 . 1 1 114 114 TYR N N 15 118.85 0.05 . 1 . . . . 114 TYR N . 7434 1 414 . 1 1 115 115 TRP H H 1 9.183 0.005 . 1 . . . . 115 TRP H . 7434 1 415 . 1 1 115 115 TRP CA C 13 57.06 0.07 . 1 . . . . 115 TRP CA . 7434 1 416 . 1 1 115 115 TRP CB C 13 33.66 0.05 . 1 . . . . 115 TRP CB . 7434 1 417 . 1 1 115 115 TRP N N 15 123.09 0.005 . 1 . . . . 115 TRP N . 7434 1 418 . 1 1 116 116 GLY H H 1 8.74 0.07 . 1 . . . . 116 GLY H . 7434 1 419 . 1 1 116 116 GLY CA C 13 44.58 0.07 . 1 . . . . 116 GLY CA . 7434 1 420 . 1 1 116 116 GLY N N 15 110.06 0.05 . 1 . . . . 116 GLY N . 7434 1 421 . 1 1 117 117 GLN H H 1 8.899 0.005 . 1 . . . . 117 GLN H . 7434 1 422 . 1 1 117 117 GLN CA C 13 56.88 0.07 . 1 . . . . 117 GLN CA . 7434 1 423 . 1 1 117 117 GLN CB C 13 29.95 0.05 . 1 . . . . 117 GLN CB . 7434 1 424 . 1 1 117 117 GLN N N 15 117.58 0.005 . 1 . . . . 117 GLN N . 7434 1 425 . 1 1 118 118 GLY H H 1 9.11 0.07 . 1 . . . . 118 GLY H . 7434 1 426 . 1 1 118 118 GLY CA C 13 44.36 0.07 . 1 . . . . 118 GLY CA . 7434 1 427 . 1 1 118 118 GLY N N 15 111.5 0.05 . 1 . . . . 118 GLY N . 7434 1 428 . 1 1 119 119 THR H H 1 8.733 0.005 . 1 . . . . 119 THR H . 7434 1 429 . 1 1 119 119 THR CA C 13 60.16 0.07 . 1 . . . . 119 THR CA . 7434 1 430 . 1 1 119 119 THR CB C 13 70.84 0.07 . 1 . . . . 119 THR CB . 7434 1 431 . 1 1 119 119 THR N N 15 117.94 0.05 . 1 . . . . 119 THR N . 7434 1 432 . 1 1 120 120 GLN H H 1 8.69 0.005 . 1 . . . . 120 GLN H . 7434 1 433 . 1 1 120 120 GLN CA C 13 56.8 0.07 . 1 . . . . 120 GLN CA . 7434 1 434 . 1 1 120 120 GLN CB C 13 29.2 0.07 . 1 . . . . 120 GLN CB . 7434 1 435 . 1 1 120 120 GLN N N 15 130.78 0.05 . 1 . . . . 120 GLN N . 7434 1 436 . 1 1 121 121 VAL H H 1 8.789 0.005 . 1 . . . . 121 VAL H . 7434 1 437 . 1 1 121 121 VAL CA C 13 62.03 0.07 . 1 . . . . 121 VAL CA . 7434 1 438 . 1 1 121 121 VAL CB C 13 33.96 0.07 . 1 . . . . 121 VAL CB . 7434 1 439 . 1 1 121 121 VAL N N 15 128.65 0.05 . 1 . . . . 121 VAL N . 7434 1 440 . 1 1 122 122 THR H H 1 8.513 0.005 . 1 . . . . 122 THR H . 7434 1 441 . 1 1 122 122 THR CA C 13 61.87 0.07 . 1 . . . . 122 THR CA . 7434 1 442 . 1 1 122 122 THR CB C 13 70.42 0.07 . 1 . . . . 122 THR CB . 7434 1 443 . 1 1 122 122 THR N N 15 125.09 0.05 . 1 . . . . 122 THR N . 7434 1 444 . 1 1 123 123 VAL H H 1 8.39 0.005 . 1 . . . . 123 VAL H . 7434 1 445 . 1 1 123 123 VAL CA C 13 59.82 0.07 . 1 . . . . 123 VAL CA . 7434 1 446 . 1 1 123 123 VAL CB C 13 31.65 0.07 . 1 . . . . 123 VAL CB . 7434 1 447 . 1 1 123 123 VAL N N 15 127.92 0.05 . 1 . . . . 123 VAL N . 7434 1 448 . 1 1 124 124 SER H H 1 8.644 0.005 . 1 . . . . 124 SER H . 7434 1 449 . 1 1 124 124 SER CA C 13 56.73 0.07 . 1 . . . . 124 SER CA . 7434 1 450 . 1 1 124 124 SER CB C 13 65.02 0.07 . 1 . . . . 124 SER CB . 7434 1 451 . 1 1 124 124 SER N N 15 121.59 0.05 . 1 . . . . 124 SER N . 7434 1 452 . 1 1 125 125 THR H H 1 8.342 0.005 . 1 . . . . 125 THR H . 7434 1 453 . 1 1 125 125 THR CA C 13 61.89 0.07 . 1 . . . . 125 THR CA . 7434 1 454 . 1 1 125 125 THR CB C 13 69.46 0.07 . 1 . . . . 125 THR CB . 7434 1 455 . 1 1 125 125 THR N N 15 115.09 0.05 . 1 . . . . 125 THR N . 7434 1 456 . 1 1 126 126 ALA H H 1 8.322 0.005 . 1 . . . . 126 ALA H . 7434 1 457 . 1 1 126 126 ALA CA C 13 52.21 0.07 . 1 . . . . 126 ALA CA . 7434 1 458 . 1 1 126 126 ALA CB C 13 19.3 0.07 . 1 . . . . 126 ALA CB . 7434 1 459 . 1 1 126 126 ALA N N 15 126.24 0.05 . 1 . . . . 126 ALA N . 7434 1 stop_ save_