data_52379 ####################### # Entry information # ####################### save_entry_information_1 _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information_1 _Entry.ID 52379 _Entry.Title ; HIF-1alpha oxygen-dependent degradation domain ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2024-03-29 _Entry.Accession_date 2024-03-29 _Entry.Last_release_date 2024-03-29 _Entry.Original_release_date 2024-03-29 _Entry.Origination author _Entry.Format_name . _Entry.NMR_STAR_version 3.2.14.0 _Entry.NMR_STAR_dict_location . _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Source_data_format . _Entry.Source_data_format_version . _Entry.Generated_software_name . _Entry.Generated_software_version . _Entry.Generated_software_ID 1 _Entry.Generated_software_label $software_1 _Entry.Generated_date . _Entry.DOI . _Entry.UUID . _Entry.Related_coordinate_file_name . _Entry.Details 'Chemical shift backbone assignment of the oxygen-dependent degradation domain of human HIF-1alpha (residues 394-574).' _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.ORCID _Entry_author.Entry_ID 1 Wenguang He . . . 0009-0004-1628-0534 52379 2 Genevieve Gasmi-Seabrook . M.C. . 0000-0003-1079-4417 52379 3 Mitsuhiko Ikura . . . 0000-0002-9524-1303 52379 4 Jeffrey Lee . E. . . 52379 5 Michael Ohh . . . 0000-0001-7600-4751 52379 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 52379 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 531 52379 '15N chemical shifts' 173 52379 '1H chemical shifts' 155 52379 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 . . 2024-09-09 2024-03-29 update BMRB 'update entry citation' 52379 1 . . 2024-08-20 2024-03-29 original author 'original release' 52379 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID BMRB 52382 'Double-hydroxylated HIF-1alpha oxygen-dependent degradation domain' 52379 stop_ save_ ############### # Citations # ############### save_citations_1 _Citation.Sf_category citations _Citation.Sf_framecode citations_1 _Citation.Entry_ID 52379 _Citation.ID 1 _Citation.Name . _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.PubMed_ID 39231207 _Citation.DOI . _Citation.Full_citation . _Citation.Title ; Time-resolved NMR detection of prolyl-hydroxylation in intrinsically disordered region of HIF-1a ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Proc. Natl. Acad. Sci. U. S. A.' _Citation.Journal_name_full 'Proceedings of the National Academy of Sciences of the United States of America' _Citation.Journal_volume 121 _Citation.Journal_issue 37 _Citation.Journal_ASTM . _Citation.Journal_ISSN 1091-6490 _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 e2408104121 _Citation.Page_last e2408104121 _Citation.Year 2024 _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.ORCID _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Wenguang He . . . . 52379 1 2 Genevieve Gasmi-Seabrook . M.C. . . 52379 1 3 Mitsuhiko Ikura . . . . 52379 1 4 Jeffrey Lee . E. . . 52379 1 5 Michael Ohh . . . . 52379 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly_1 _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly_1 _Assembly.Entry_ID 52379 _Assembly.ID 1 _Assembly.Name 'HIF-1a ODD' _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands 0 _Assembly.Metal_ions 0 _Assembly.Non_standard_bonds no _Assembly.Ambiguous_conformational_states no _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange no _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass 19997.06 _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 'HIF-1alpha ODD' 1 $entity_1 . . yes 'intrinsically disordered' no no . . . 52379 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 52379 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name entity_1 _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 ; PDALTLLAPAAGDTIISLDF GSNDTETDDQQLEEVPLYND VMLPSPNEKLQNINLAMSPL PTAETPKPLRSSADPALNQE VALKLEPNPESLELSFTMPQ IQDQTPSPSDGSTRQSSPEP NSPSEYCFYVDSDMVNEFKL ELVEKLFAEDTEAKNPFSTQ DTDLDLEMLAPYIPMDDDFQ L ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq 'It starts from 394 (P394) and ends at 574 (L574)' _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 181 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state unknown _Entity.Src_method . _Entity.Parent_entity_ID 1 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 19997.06 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . 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 yes UNP Q16665 . HIF1A . . . . . . . . . . . . . . 52379 1 stop_ loop_ _Entity_biological_function.Biological_function _Entity_biological_function.Entry_ID _Entity_biological_function.Entity_ID ; A master transcriptional regulator of the adaptive response to hypoxia with protein stability mediated by prolyl hydroxylation in the oxygen-dependent manner. ; 52379 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 . PRO . 52379 1 2 . ASP . 52379 1 3 . ALA . 52379 1 4 . LEU . 52379 1 5 . THR . 52379 1 6 . LEU . 52379 1 7 . LEU . 52379 1 8 . ALA . 52379 1 9 . PRO . 52379 1 10 . ALA . 52379 1 11 . ALA . 52379 1 12 . GLY . 52379 1 13 . ASP . 52379 1 14 . THR . 52379 1 15 . ILE . 52379 1 16 . ILE . 52379 1 17 . SER . 52379 1 18 . LEU . 52379 1 19 . ASP . 52379 1 20 . PHE . 52379 1 21 . GLY . 52379 1 22 . SER . 52379 1 23 . ASN . 52379 1 24 . ASP . 52379 1 25 . THR . 52379 1 26 . GLU . 52379 1 27 . THR . 52379 1 28 . ASP . 52379 1 29 . ASP . 52379 1 30 . GLN . 52379 1 31 . GLN . 52379 1 32 . LEU . 52379 1 33 . GLU . 52379 1 34 . GLU . 52379 1 35 . VAL . 52379 1 36 . PRO . 52379 1 37 . LEU . 52379 1 38 . TYR . 52379 1 39 . ASN . 52379 1 40 . ASP . 52379 1 41 . VAL . 52379 1 42 . MET . 52379 1 43 . LEU . 52379 1 44 . PRO . 52379 1 45 . SER . 52379 1 46 . PRO . 52379 1 47 . ASN . 52379 1 48 . GLU . 52379 1 49 . LYS . 52379 1 50 . LEU . 52379 1 51 . GLN . 52379 1 52 . ASN . 52379 1 53 . ILE . 52379 1 54 . ASN . 52379 1 55 . LEU . 52379 1 56 . ALA . 52379 1 57 . MET . 52379 1 58 . SER . 52379 1 59 . PRO . 52379 1 60 . LEU . 52379 1 61 . PRO . 52379 1 62 . THR . 52379 1 63 . ALA . 52379 1 64 . GLU . 52379 1 65 . THR . 52379 1 66 . PRO . 52379 1 67 . LYS . 52379 1 68 . PRO . 52379 1 69 . LEU . 52379 1 70 . ARG . 52379 1 71 . SER . 52379 1 72 . SER . 52379 1 73 . ALA . 52379 1 74 . ASP . 52379 1 75 . PRO . 52379 1 76 . ALA . 52379 1 77 . LEU . 52379 1 78 . ASN . 52379 1 79 . GLN . 52379 1 80 . GLU . 52379 1 81 . VAL . 52379 1 82 . ALA . 52379 1 83 . LEU . 52379 1 84 . LYS . 52379 1 85 . LEU . 52379 1 86 . GLU . 52379 1 87 . PRO . 52379 1 88 . ASN . 52379 1 89 . PRO . 52379 1 90 . GLU . 52379 1 91 . SER . 52379 1 92 . LEU . 52379 1 93 . GLU . 52379 1 94 . LEU . 52379 1 95 . SER . 52379 1 96 . PHE . 52379 1 97 . THR . 52379 1 98 . MET . 52379 1 99 . PRO . 52379 1 100 . GLN . 52379 1 101 . ILE . 52379 1 102 . GLN . 52379 1 103 . ASP . 52379 1 104 . GLN . 52379 1 105 . THR . 52379 1 106 . PRO . 52379 1 107 . SER . 52379 1 108 . PRO . 52379 1 109 . SER . 52379 1 110 . ASP . 52379 1 111 . GLY . 52379 1 112 . SER . 52379 1 113 . THR . 52379 1 114 . ARG . 52379 1 115 . GLN . 52379 1 116 . SER . 52379 1 117 . SER . 52379 1 118 . PRO . 52379 1 119 . GLU . 52379 1 120 . PRO . 52379 1 121 . ASN . 52379 1 122 . SER . 52379 1 123 . PRO . 52379 1 124 . SER . 52379 1 125 . GLU . 52379 1 126 . TYR . 52379 1 127 . CYS . 52379 1 128 . PHE . 52379 1 129 . TYR . 52379 1 130 . VAL . 52379 1 131 . ASP . 52379 1 132 . SER . 52379 1 133 . ASP . 52379 1 134 . MET . 52379 1 135 . VAL . 52379 1 136 . ASN . 52379 1 137 . GLU . 52379 1 138 . PHE . 52379 1 139 . LYS . 52379 1 140 . LEU . 52379 1 141 . GLU . 52379 1 142 . LEU . 52379 1 143 . VAL . 52379 1 144 . GLU . 52379 1 145 . LYS . 52379 1 146 . LEU . 52379 1 147 . PHE . 52379 1 148 . ALA . 52379 1 149 . GLU . 52379 1 150 . ASP . 52379 1 151 . THR . 52379 1 152 . GLU . 52379 1 153 . ALA . 52379 1 154 . LYS . 52379 1 155 . ASN . 52379 1 156 . PRO . 52379 1 157 . PHE . 52379 1 158 . SER . 52379 1 159 . THR . 52379 1 160 . GLN . 52379 1 161 . ASP . 52379 1 162 . THR . 52379 1 163 . ASP . 52379 1 164 . LEU . 52379 1 165 . ASP . 52379 1 166 . LEU . 52379 1 167 . GLU . 52379 1 168 . MET . 52379 1 169 . LEU . 52379 1 170 . ALA . 52379 1 171 . PRO . 52379 1 172 . TYR . 52379 1 173 . ILE . 52379 1 174 . PRO . 52379 1 175 . MET . 52379 1 176 . ASP . 52379 1 177 . ASP . 52379 1 178 . ASP . 52379 1 179 . PHE . 52379 1 180 . GLN . 52379 1 181 . LEU . 52379 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 . PRO 1 1 52379 1 . ASP 2 2 52379 1 . ALA 3 3 52379 1 . LEU 4 4 52379 1 . THR 5 5 52379 1 . LEU 6 6 52379 1 . LEU 7 7 52379 1 . ALA 8 8 52379 1 . PRO 9 9 52379 1 . ALA 10 10 52379 1 . ALA 11 11 52379 1 . GLY 12 12 52379 1 . ASP 13 13 52379 1 . THR 14 14 52379 1 . ILE 15 15 52379 1 . ILE 16 16 52379 1 . SER 17 17 52379 1 . LEU 18 18 52379 1 . ASP 19 19 52379 1 . PHE 20 20 52379 1 . GLY 21 21 52379 1 . SER 22 22 52379 1 . ASN 23 23 52379 1 . ASP 24 24 52379 1 . THR 25 25 52379 1 . GLU 26 26 52379 1 . THR 27 27 52379 1 . ASP 28 28 52379 1 . ASP 29 29 52379 1 . GLN 30 30 52379 1 . GLN 31 31 52379 1 . LEU 32 32 52379 1 . GLU 33 33 52379 1 . GLU 34 34 52379 1 . VAL 35 35 52379 1 . PRO 36 36 52379 1 . LEU 37 37 52379 1 . TYR 38 38 52379 1 . ASN 39 39 52379 1 . ASP 40 40 52379 1 . VAL 41 41 52379 1 . MET 42 42 52379 1 . LEU 43 43 52379 1 . PRO 44 44 52379 1 . SER 45 45 52379 1 . PRO 46 46 52379 1 . ASN 47 47 52379 1 . GLU 48 48 52379 1 . LYS 49 49 52379 1 . LEU 50 50 52379 1 . GLN 51 51 52379 1 . ASN 52 52 52379 1 . ILE 53 53 52379 1 . ASN 54 54 52379 1 . LEU 55 55 52379 1 . ALA 56 56 52379 1 . MET 57 57 52379 1 . SER 58 58 52379 1 . PRO 59 59 52379 1 . LEU 60 60 52379 1 . PRO 61 61 52379 1 . THR 62 62 52379 1 . ALA 63 63 52379 1 . GLU 64 64 52379 1 . THR 65 65 52379 1 . PRO 66 66 52379 1 . LYS 67 67 52379 1 . PRO 68 68 52379 1 . LEU 69 69 52379 1 . ARG 70 70 52379 1 . SER 71 71 52379 1 . SER 72 72 52379 1 . ALA 73 73 52379 1 . ASP 74 74 52379 1 . PRO 75 75 52379 1 . ALA 76 76 52379 1 . LEU 77 77 52379 1 . ASN 78 78 52379 1 . GLN 79 79 52379 1 . GLU 80 80 52379 1 . VAL 81 81 52379 1 . ALA 82 82 52379 1 . LEU 83 83 52379 1 . LYS 84 84 52379 1 . LEU 85 85 52379 1 . GLU 86 86 52379 1 . PRO 87 87 52379 1 . ASN 88 88 52379 1 . PRO 89 89 52379 1 . GLU 90 90 52379 1 . SER 91 91 52379 1 . LEU 92 92 52379 1 . GLU 93 93 52379 1 . LEU 94 94 52379 1 . SER 95 95 52379 1 . PHE 96 96 52379 1 . THR 97 97 52379 1 . MET 98 98 52379 1 . PRO 99 99 52379 1 . GLN 100 100 52379 1 . ILE 101 101 52379 1 . GLN 102 102 52379 1 . ASP 103 103 52379 1 . GLN 104 104 52379 1 . THR 105 105 52379 1 . PRO 106 106 52379 1 . SER 107 107 52379 1 . PRO 108 108 52379 1 . SER 109 109 52379 1 . ASP 110 110 52379 1 . GLY 111 111 52379 1 . SER 112 112 52379 1 . THR 113 113 52379 1 . ARG 114 114 52379 1 . GLN 115 115 52379 1 . SER 116 116 52379 1 . SER 117 117 52379 1 . PRO 118 118 52379 1 . GLU 119 119 52379 1 . PRO 120 120 52379 1 . ASN 121 121 52379 1 . SER 122 122 52379 1 . PRO 123 123 52379 1 . SER 124 124 52379 1 . GLU 125 125 52379 1 . TYR 126 126 52379 1 . CYS 127 127 52379 1 . PHE 128 128 52379 1 . TYR 129 129 52379 1 . VAL 130 130 52379 1 . ASP 131 131 52379 1 . SER 132 132 52379 1 . ASP 133 133 52379 1 . MET 134 134 52379 1 . VAL 135 135 52379 1 . ASN 136 136 52379 1 . GLU 137 137 52379 1 . PHE 138 138 52379 1 . LYS 139 139 52379 1 . LEU 140 140 52379 1 . GLU 141 141 52379 1 . LEU 142 142 52379 1 . VAL 143 143 52379 1 . GLU 144 144 52379 1 . LYS 145 145 52379 1 . LEU 146 146 52379 1 . PHE 147 147 52379 1 . ALA 148 148 52379 1 . GLU 149 149 52379 1 . ASP 150 150 52379 1 . THR 151 151 52379 1 . GLU 152 152 52379 1 . ALA 153 153 52379 1 . LYS 154 154 52379 1 . ASN 155 155 52379 1 . PRO 156 156 52379 1 . PHE 157 157 52379 1 . SER 158 158 52379 1 . THR 159 159 52379 1 . GLN 160 160 52379 1 . ASP 161 161 52379 1 . THR 162 162 52379 1 . ASP 163 163 52379 1 . LEU 164 164 52379 1 . ASP 165 165 52379 1 . LEU 166 166 52379 1 . GLU 167 167 52379 1 . MET 168 168 52379 1 . LEU 169 169 52379 1 . ALA 170 170 52379 1 . PRO 171 171 52379 1 . TYR 172 172 52379 1 . ILE 173 173 52379 1 . PRO 174 174 52379 1 . MET 175 175 52379 1 . ASP 176 176 52379 1 . ASP 177 177 52379 1 . ASP 178 178 52379 1 . PHE 179 179 52379 1 . GLN 180 180 52379 1 . LEU 181 181 52379 1 stop_ save_ #################### # Natural source # #################### save_natural_source_1 _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source_1 _Entity_natural_src_list.Entry_ID 52379 _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.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.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Details _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $entity_1 . 562 organism . 'Escherichia coli' 'E. coli' . . Bacteria . Escherichia coli 'Rosetta 2 (DE3)' . . . . . . . . . . . . 52379 1 stop_ save_ ######################### # Experimental source # ######################### save_experimental_source_1 _Entity_experimental_src_list.Sf_category experimental_source _Entity_experimental_src_list.Sf_framecode experimental_source_1 _Entity_experimental_src_list.Entry_ID 52379 _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_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.Details _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $entity_1 . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . plasmid . . 'pCDF Ek/LIC' . . . 52379 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 52379 _Sample.ID 1 _Sample.Name '13C 15N labeled HIF-1alpha ODD' _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number 1 _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 'HIF-1alpha ODD' '[U-100% 13C; U-100% 15N]' . . 1 $entity_1 . . 230 . . uM . . . . 52379 1 2 D2O '[U-100% 2H]' . . . . . . 5 . . % . . . . 52379 1 3 H2O 'natural abundance' . . . . . . 95 . . % . . . . 52379 1 4 'sodium chloride' 'natural abundance' . . . . . . 100 . . mM . . . . 52379 1 5 TRIS 'natural abundance' . . . . . . 50 . . mM . . . . 52379 1 6 TCEP 'natural abundance' . . . . . . 1 . . mM . . . . 52379 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 52379 _Sample_condition_list.ID 1 _Sample_condition_list.Name 'Sample condition' _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 0.1 . M 52379 1 pH 7.5 . pH 52379 1 pressure 1 . atm 52379 1 temperature 288 . K 52379 1 stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID 52379 _Software.ID 1 _Software.Type . _Software.Name TOPSPIN _Software.Version 4.1.4 _Software.DOI . _Software.Details . loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID collection . 52379 1 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_NMR_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_1 _NMR_spectrometer.Entry_ID 52379 _NMR_spectrometer.ID 1 _NMR_spectrometer.Name 'Bruker 800 MHz' _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model US2 _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ ############################# # NMR applied experiments # ############################# save_experiment_list_1 _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode experiment_list_1 _Experiment_list.Entry_ID 52379 _Experiment_list.ID 1 _Experiment_list.Details 'We also conducted 13C-detected 2D CON experiments for the assignment of 15N values of proline residues.' loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NUS_flag _Experiment.Interleaved_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.Details _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N HSQC' no no no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 52379 1 2 '3D CBCACONH' no no no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 52379 1 3 '3D HNCACB' no no no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 52379 1 4 '3D HNCO' no no no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 52379 1 5 '3D HNCACO' no no no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 52379 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chem_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chem_shift_reference_1 _Chem_shift_reference.Entry_ID 52379 _Chem_shift_reference.ID 1 _Chem_shift_reference.Name 'DSS referencing' _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.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl carbon' . . . . ppm 176.252 internal indirect 1 . . . . . 52379 1 H 1 DSS protons . . . . ppm 4.783 internal direct 1 . . . . . 52379 1 N 15 DSS nitrogen . . . . ppm 119.186 internal indirect 1 . . . . . 52379 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_chemical_shifts_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1 _Assigned_chem_shift_list.Entry_ID 52379 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name HIF1a_ODD_assignment _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 $chem_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' . . . 52379 1 2 '3D CBCACONH' . . . 52379 1 3 '3D HNCACB' . . . 52379 1 4 '3D HNCO' . . . 52379 1 5 '3D HNCACO' . . . 52379 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 1 $software_1 . . 52379 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_assembly_asym_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.Ambiguity_set_ID _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 1 1 PRO C C 13 177.19 0 . 1 . . . . . 1 PRO C . 52379 1 2 . 1 . 1 1 1 PRO CA C 13 63.67 0 . 1 . . . . . 1 PRO CA . 52379 1 3 . 1 . 1 1 1 PRO CB C 13 32 0 . 1 . . . . . 1 PRO CB . 52379 1 4 . 1 . 1 2 2 ASP H H 1 8.25 0 . 1 . . . . . 2 ASP H . 52379 1 5 . 1 . 1 2 2 ASP C C 13 176.66 0 . 1 . . . . . 2 ASP C . 52379 1 6 . 1 . 1 2 2 ASP CA C 13 54.45 0 . 1 . . . . . 2 ASP CA . 52379 1 7 . 1 . 1 2 2 ASP CB C 13 40.97 0 . 1 . . . . . 2 ASP CB . 52379 1 8 . 1 . 1 2 2 ASP N N 15 120.12 0 . 1 . . . . . 2 ASP N . 52379 1 9 . 1 . 1 3 3 ALA H H 1 8.1 0 . 1 . . . . . 3 ALA H . 52379 1 10 . 1 . 1 3 3 ALA C C 13 178.48 0 . 1 . . . . . 3 ALA C . 52379 1 11 . 1 . 1 3 3 ALA CA C 13 52.64 0 . 1 . . . . . 3 ALA CA . 52379 1 12 . 1 . 1 3 3 ALA CB C 13 18.91 0 . 1 . . . . . 3 ALA CB . 52379 1 13 . 1 . 1 3 3 ALA N N 15 124.16 0 . 1 . . . . . 3 ALA N . 52379 1 14 . 1 . 1 4 4 LEU H H 1 8.15 0 . 1 . . . . . 4 LEU H . 52379 1 15 . 1 . 1 4 4 LEU C C 13 178.36 0 . 1 . . . . . 4 LEU C . 52379 1 16 . 1 . 1 4 4 LEU CA C 13 55.49 0 . 1 . . . . . 4 LEU CA . 52379 1 17 . 1 . 1 4 4 LEU CB C 13 41.75 0 . 1 . . . . . 4 LEU CB . 52379 1 18 . 1 . 1 4 4 LEU N N 15 120.33 0 . 1 . . . . . 4 LEU N . 52379 1 19 . 1 . 1 5 5 THR H H 1 7.95 0 . 1 . . . . . 5 THR H . 52379 1 20 . 1 . 1 5 5 THR C C 13 174.8 0 . 1 . . . . . 5 THR C . 52379 1 21 . 1 . 1 5 5 THR CA C 13 62.25 0 . 1 . . . . . 5 THR CA . 52379 1 22 . 1 . 1 5 5 THR CB C 13 69.6 0 . 1 . . . . . 5 THR CB . 52379 1 23 . 1 . 1 5 5 THR N N 15 115.09 0 . 1 . . . . . 5 THR N . 52379 1 24 . 1 . 1 6 6 LEU H H 1 8.05 0 . 1 . . . . . 6 LEU H . 52379 1 25 . 1 . 1 6 6 LEU C C 13 177.4 0 . 1 . . . . . 6 LEU C . 52379 1 26 . 1 . 1 6 6 LEU CA C 13 55.09 0 . 1 . . . . . 6 LEU CA . 52379 1 27 . 1 . 1 6 6 LEU CB C 13 42.09 0 . 1 . . . . . 6 LEU CB . 52379 1 28 . 1 . 1 6 6 LEU N N 15 124.65 0 . 1 . . . . . 6 LEU N . 52379 1 29 . 1 . 1 7 7 LEU H H 1 8.04 0 . 1 . . . . . 7 LEU H . 52379 1 30 . 1 . 1 7 7 LEU C C 13 176.98 0 . 1 . . . . . 7 LEU C . 52379 1 31 . 1 . 1 7 7 LEU CA C 13 54.58 0 . 1 . . . . . 7 LEU CA . 52379 1 32 . 1 . 1 7 7 LEU CB C 13 42.42 0 . 1 . . . . . 7 LEU CB . 52379 1 33 . 1 . 1 7 7 LEU N N 15 123.07 0 . 1 . . . . . 7 LEU N . 52379 1 34 . 1 . 1 8 8 ALA H H 1 8.13 0 . 1 . . . . . 8 ALA H . 52379 1 35 . 1 . 1 8 8 ALA C C 13 175.65 0 . 1 . . . . . 8 ALA C . 52379 1 36 . 1 . 1 8 8 ALA CA C 13 50.28 0 . 1 . . . . . 8 ALA CA . 52379 1 37 . 1 . 1 8 8 ALA CB C 13 17.96 0 . 1 . . . . . 8 ALA CB . 52379 1 38 . 1 . 1 8 8 ALA N N 15 126.37 0 . 1 . . . . . 8 ALA N . 52379 1 39 . 1 . 1 9 9 PRO C C 13 177.15 0 . 1 . . . . . 9 PRO C . 52379 1 40 . 1 . 1 9 9 PRO CA C 13 63 0 . 1 . . . . . 9 PRO CA . 52379 1 41 . 1 . 1 9 9 PRO CB C 13 31.98 0 . 1 . . . . . 9 PRO CB . 52379 1 42 . 1 . 1 9 9 PRO N N 15 135.74 0 . 1 . . . . . 9 PRO N . 52379 1 43 . 1 . 1 10 10 ALA H H 1 8.4 0 . 1 . . . . . 10 ALA H . 52379 1 44 . 1 . 1 10 10 ALA C C 13 178.11 0 . 1 . . . . . 10 ALA C . 52379 1 45 . 1 . 1 10 10 ALA CA C 13 52.09 0 . 1 . . . . . 10 ALA CA . 52379 1 46 . 1 . 1 10 10 ALA CB C 13 19.04 0 . 1 . . . . . 10 ALA CB . 52379 1 47 . 1 . 1 10 10 ALA N N 15 124.95 0 . 1 . . . . . 10 ALA N . 52379 1 48 . 1 . 1 11 11 ALA H H 1 8.33 0 . 1 . . . . . 11 ALA H . 52379 1 49 . 1 . 1 11 11 ALA C C 13 178.83 0 . 1 . . . . . 11 ALA C . 52379 1 50 . 1 . 1 11 11 ALA CA C 13 52.6 0 . 1 . . . . . 11 ALA CA . 52379 1 51 . 1 . 1 11 11 ALA CB C 13 18.9 0 . 1 . . . . . 11 ALA CB . 52379 1 52 . 1 . 1 11 11 ALA N N 15 123.92 0 . 1 . . . . . 11 ALA N . 52379 1 53 . 1 . 1 12 12 GLY H H 1 8.31 0 . 1 . . . . . 12 GLY H . 52379 1 54 . 1 . 1 12 12 GLY C C 13 174.41 0 . 1 . . . . . 12 GLY C . 52379 1 55 . 1 . 1 12 12 GLY CA C 13 45.11 0 . 1 . . . . . 12 GLY CA . 52379 1 56 . 1 . 1 12 12 GLY N N 15 108.17 0 . 1 . . . . . 12 GLY N . 52379 1 57 . 1 . 1 13 13 ASP H H 1 8.16 0 . 1 . . . . . 13 ASP H . 52379 1 58 . 1 . 1 13 13 ASP C C 13 176.91 0 . 1 . . . . . 13 ASP C . 52379 1 59 . 1 . 1 13 13 ASP CA C 13 55.43 0 . 1 . . . . . 13 ASP CA . 52379 1 60 . 1 . 1 13 13 ASP CB C 13 41.77 0 . 1 . . . . . 13 ASP CB . 52379 1 61 . 1 . 1 13 13 ASP N N 15 120.33 0 . 1 . . . . . 13 ASP N . 52379 1 62 . 1 . 1 14 14 THR H H 1 8.07 0 . 1 . . . . . 14 THR H . 52379 1 63 . 1 . 1 14 14 THR C C 13 174.7 0 . 1 . . . . . 14 THR C . 52379 1 64 . 1 . 1 14 14 THR CA C 13 62.28 0 . 1 . . . . . 14 THR CA . 52379 1 65 . 1 . 1 14 14 THR CB C 13 69.74 0 . 1 . . . . . 14 THR CB . 52379 1 66 . 1 . 1 14 14 THR N N 15 115.12 0 . 1 . . . . . 14 THR N . 52379 1 67 . 1 . 1 15 15 ILE H H 1 8.2 0 . 1 . . . . . 15 ILE H . 52379 1 68 . 1 . 1 15 15 ILE C C 13 176.53 0 . 1 . . . . . 15 ILE C . 52379 1 69 . 1 . 1 15 15 ILE CA C 13 61.02 0 . 1 . . . . . 15 ILE CA . 52379 1 70 . 1 . 1 15 15 ILE CB C 13 38.28 0 . 1 . . . . . 15 ILE CB . 52379 1 71 . 1 . 1 15 15 ILE N N 15 124.76 0 . 1 . . . . . 15 ILE N . 52379 1 72 . 1 . 1 16 16 ILE H H 1 8.25 0 . 1 . . . . . 16 ILE H . 52379 1 73 . 1 . 1 16 16 ILE C C 13 176.44 0 . 1 . . . . . 16 ILE C . 52379 1 74 . 1 . 1 16 16 ILE CA C 13 60.84 0 . 1 . . . . . 16 ILE CA . 52379 1 75 . 1 . 1 16 16 ILE CB C 13 38.25 0 . 1 . . . . . 16 ILE CB . 52379 1 76 . 1 . 1 16 16 ILE N N 15 126.42 0 . 1 . . . . . 16 ILE N . 52379 1 77 . 1 . 1 17 17 SER H H 1 8.34 0 . 1 . . . . . 17 SER H . 52379 1 78 . 1 . 1 17 17 SER C C 13 174.79 0 . 1 . . . . . 17 SER C . 52379 1 79 . 1 . 1 17 17 SER CA C 13 57.85 0 . 1 . . . . . 17 SER CA . 52379 1 80 . 1 . 1 17 17 SER CB C 13 63.85 0 . 1 . . . . . 17 SER CB . 52379 1 81 . 1 . 1 17 17 SER N N 15 120.92 0 . 1 . . . . . 17 SER N . 52379 1 82 . 1 . 1 18 18 LEU H H 1 8.32 0 . 1 . . . . . 18 LEU H . 52379 1 83 . 1 . 1 18 18 LEU C C 13 177.16 0 . 1 . . . . . 18 LEU C . 52379 1 84 . 1 . 1 18 18 LEU CA C 13 55.01 0 . 1 . . . . . 18 LEU CA . 52379 1 85 . 1 . 1 18 18 LEU CB C 13 42.15 0 . 1 . . . . . 18 LEU CB . 52379 1 86 . 1 . 1 18 18 LEU N N 15 125.32 0 . 1 . . . . . 18 LEU N . 52379 1 87 . 1 . 1 19 19 ASP H H 1 8.11 0 . 1 . . . . . 19 ASP H . 52379 1 88 . 1 . 1 19 19 ASP C C 13 176.35 0 . 1 . . . . . 19 ASP C . 52379 1 89 . 1 . 1 19 19 ASP CA C 13 53.95 0 . 1 . . . . . 19 ASP CA . 52379 1 90 . 1 . 1 19 19 ASP CB C 13 41.18 0 . 1 . . . . . 19 ASP CB . 52379 1 91 . 1 . 1 19 19 ASP N N 15 120.64 0 . 1 . . . . . 19 ASP N . 52379 1 92 . 1 . 1 20 20 PHE H H 1 8.14 0 . 1 . . . . . 20 PHE H . 52379 1 93 . 1 . 1 20 20 PHE C C 13 176.88 0 . 1 . . . . . 20 PHE C . 52379 1 94 . 1 . 1 20 20 PHE CA C 13 57.97 0 . 1 . . . . . 20 PHE CA . 52379 1 95 . 1 . 1 20 20 PHE CB C 13 39.33 0 . 1 . . . . . 20 PHE CB . 52379 1 96 . 1 . 1 20 20 PHE N N 15 121.51 0 . 1 . . . . . 20 PHE N . 52379 1 97 . 1 . 1 21 21 GLY H H 1 8.35 0 . 1 . . . . . 21 GLY H . 52379 1 98 . 1 . 1 21 21 GLY C C 13 174.58 0 . 1 . . . . . 21 GLY C . 52379 1 99 . 1 . 1 21 21 GLY CA C 13 45.17 0 . 1 . . . . . 21 GLY CA . 52379 1 100 . 1 . 1 21 21 GLY N N 15 110.64 0 . 1 . . . . . 21 GLY N . 52379 1 101 . 1 . 1 22 22 SER H H 1 8.12 0 . 1 . . . . . 22 SER H . 52379 1 102 . 1 . 1 22 22 SER C C 13 174.81 0 . 1 . . . . . 22 SER C . 52379 1 103 . 1 . 1 22 22 SER CA C 13 58.25 0 . 1 . . . . . 22 SER CA . 52379 1 104 . 1 . 1 22 22 SER CB C 13 63.94 0 . 1 . . . . . 22 SER CB . 52379 1 105 . 1 . 1 22 22 SER N N 15 115.61 0 . 1 . . . . . 22 SER N . 52379 1 106 . 1 . 1 23 23 ASN H H 1 8.51 0 . 1 . . . . . 23 ASN H . 52379 1 107 . 1 . 1 23 23 ASN C C 13 175.37 0 . 1 . . . . . 23 ASN C . 52379 1 108 . 1 . 1 23 23 ASN CA C 13 53.29 0 . 1 . . . . . 23 ASN CA . 52379 1 109 . 1 . 1 23 23 ASN CB C 13 38.94 0 . 1 . . . . . 23 ASN CB . 52379 1 110 . 1 . 1 23 23 ASN N N 15 120.83 0 . 1 . . . . . 23 ASN N . 52379 1 111 . 1 . 1 24 24 ASP H H 1 8.31 0 . 1 . . . . . 24 ASP H . 52379 1 112 . 1 . 1 24 24 ASP C C 13 176.84 0 . 1 . . . . . 24 ASP C . 52379 1 113 . 1 . 1 24 24 ASP CA C 13 54.64 0 . 1 . . . . . 24 ASP CA . 52379 1 114 . 1 . 1 24 24 ASP CB C 13 40.88 0 . 1 . . . . . 24 ASP CB . 52379 1 115 . 1 . 1 24 24 ASP N N 15 121.09 0 . 1 . . . . . 24 ASP N . 52379 1 116 . 1 . 1 25 25 THR H H 1 8.06 0 . 1 . . . . . 25 THR H . 52379 1 117 . 1 . 1 25 25 THR C C 13 175.13 0 . 1 . . . . . 25 THR C . 52379 1 118 . 1 . 1 25 25 THR CA C 13 62.06 0 . 1 . . . . . 25 THR CA . 52379 1 119 . 1 . 1 25 25 THR CB C 13 69.93 0 . 1 . . . . . 25 THR CB . 52379 1 120 . 1 . 1 25 25 THR N N 15 114.01 0 . 1 . . . . . 25 THR N . 52379 1 121 . 1 . 1 26 26 GLU H H 1 8.39 0 . 1 . . . . . 26 GLU H . 52379 1 122 . 1 . 1 26 26 GLU C C 13 177.08 0 . 1 . . . . . 26 GLU C . 52379 1 123 . 1 . 1 26 26 GLU CA C 13 56.54 0 . 1 . . . . . 26 GLU CA . 52379 1 124 . 1 . 1 26 26 GLU CB C 13 29.99 0 . 1 . . . . . 26 GLU CB . 52379 1 125 . 1 . 1 26 26 GLU N N 15 123.5 0 . 1 . . . . . 26 GLU N . 52379 1 126 . 1 . 1 27 27 THR H H 1 8.15 0 . 1 . . . . . 27 THR H . 52379 1 127 . 1 . 1 27 27 THR C C 13 174.72 0 . 1 . . . . . 27 THR C . 52379 1 128 . 1 . 1 27 27 THR CA C 13 61.75 0 . 1 . . . . . 27 THR CA . 52379 1 129 . 1 . 1 27 27 THR CB C 13 70.05 0 . 1 . . . . . 27 THR CB . 52379 1 130 . 1 . 1 27 27 THR N N 15 115.22 0 . 1 . . . . . 27 THR N . 52379 1 131 . 1 . 1 28 28 ASP H H 1 8.36 0 . 1 . . . . . 28 ASP H . 52379 1 132 . 1 . 1 28 28 ASP C C 13 176.55 0 . 1 . . . . . 28 ASP C . 52379 1 133 . 1 . 1 28 28 ASP CA C 13 54.23 0 . 1 . . . . . 28 ASP CA . 52379 1 134 . 1 . 1 28 28 ASP CB C 13 41.12 0 . 1 . . . . . 28 ASP CB . 52379 1 135 . 1 . 1 28 28 ASP N N 15 123.2 0 . 1 . . . . . 28 ASP N . 52379 1 136 . 1 . 1 29 29 ASP H H 1 8.28 0 . 1 . . . . . 29 ASP H . 52379 1 137 . 1 . 1 29 29 ASP C C 13 176.91 0 . 1 . . . . . 29 ASP C . 52379 1 138 . 1 . 1 29 29 ASP CA C 13 54.59 0 . 1 . . . . . 29 ASP CA . 52379 1 139 . 1 . 1 29 29 ASP CB C 13 41.1 0 . 1 . . . . . 29 ASP CB . 52379 1 140 . 1 . 1 29 29 ASP N N 15 121.42 0 . 1 . . . . . 29 ASP N . 52379 1 141 . 1 . 1 30 30 GLN H H 1 8.25 0 . 1 . . . . . 30 GLN H . 52379 1 142 . 1 . 1 30 30 GLN C C 13 176.45 0 . 1 . . . . . 30 GLN C . 52379 1 143 . 1 . 1 30 30 GLN CA C 13 55.84 0 . 1 . . . . . 30 GLN CA . 52379 1 144 . 1 . 1 30 30 GLN CB C 13 29.53 0 . 1 . . . . . 30 GLN CB . 52379 1 145 . 1 . 1 30 30 GLN N N 15 120.52 0 . 1 . . . . . 30 GLN N . 52379 1 146 . 1 . 1 31 31 GLN H H 1 8.33 0 . 1 . . . . . 31 GLN H . 52379 1 147 . 1 . 1 31 31 GLN C C 13 176.29 0 . 1 . . . . . 31 GLN C . 52379 1 148 . 1 . 1 31 31 GLN CA C 13 55.46 0 . 1 . . . . . 31 GLN CA . 52379 1 149 . 1 . 1 31 31 GLN CB C 13 28.64 0 . 1 . . . . . 31 GLN CB . 52379 1 150 . 1 . 1 31 31 GLN N N 15 121.43 0 . 1 . . . . . 31 GLN N . 52379 1 151 . 1 . 1 32 32 LEU H H 1 8.23 0 . 1 . . . . . 32 LEU H . 52379 1 152 . 1 . 1 32 32 LEU C C 13 177.76 0 . 1 . . . . . 32 LEU C . 52379 1 153 . 1 . 1 32 32 LEU CA C 13 55.2 0 . 1 . . . . . 32 LEU CA . 52379 1 154 . 1 . 1 32 32 LEU CB C 13 42.31 0 . 1 . . . . . 32 LEU CB . 52379 1 155 . 1 . 1 32 32 LEU N N 15 123.86 0 . 1 . . . . . 32 LEU N . 52379 1 156 . 1 . 1 33 33 GLU H H 1 8.31 0 . 1 . . . . . 33 GLU H . 52379 1 157 . 1 . 1 33 33 GLU C C 13 176.63 0 . 1 . . . . . 33 GLU C . 52379 1 158 . 1 . 1 33 33 GLU CA C 13 56.09 0 . 1 . . . . . 33 GLU CA . 52379 1 159 . 1 . 1 33 33 GLU CB C 13 30.17 0 . 1 . . . . . 33 GLU CB . 52379 1 160 . 1 . 1 33 33 GLU N N 15 122.1 0 . 1 . . . . . 33 GLU N . 52379 1 161 . 1 . 1 34 34 GLU H H 1 8.37 0 . 1 . . . . . 34 GLU H . 52379 1 162 . 1 . 1 34 34 GLU C C 13 176.57 0 . 1 . . . . . 34 GLU C . 52379 1 163 . 1 . 1 34 34 GLU CA C 13 56.14 0 . 1 . . . . . 34 GLU CA . 52379 1 164 . 1 . 1 34 34 GLU CB C 13 29.94 0 . 1 . . . . . 34 GLU CB . 52379 1 165 . 1 . 1 34 34 GLU N N 15 123 0 . 1 . . . . . 34 GLU N . 52379 1 166 . 1 . 1 35 35 VAL H H 1 8.24 0 . 1 . . . . . 35 VAL H . 52379 1 167 . 1 . 1 35 35 VAL C C 13 174.72 0 . 1 . . . . . 35 VAL C . 52379 1 168 . 1 . 1 35 35 VAL CA C 13 59.77 0 . 1 . . . . . 35 VAL CA . 52379 1 169 . 1 . 1 35 35 VAL CB C 13 32.34 0 . 1 . . . . . 35 VAL CB . 52379 1 170 . 1 . 1 35 35 VAL N N 15 124.18 0 . 1 . . . . . 35 VAL N . 52379 1 171 . 1 . 1 36 36 PRO C C 13 176.76 0 . 1 . . . . . 36 PRO C . 52379 1 172 . 1 . 1 36 36 PRO CA C 13 62.95 0 . 1 . . . . . 36 PRO CA . 52379 1 173 . 1 . 1 36 36 PRO CB C 13 32.04 0 . 1 . . . . . 36 PRO CB . 52379 1 174 . 1 . 1 36 36 PRO N N 15 139.53 0 . 1 . . . . . 36 PRO N . 52379 1 175 . 1 . 1 37 37 LEU H H 1 8.17 0 . 1 . . . . . 37 LEU H . 52379 1 176 . 1 . 1 37 37 LEU C C 13 177.5 0 . 1 . . . . . 37 LEU C . 52379 1 177 . 1 . 1 37 37 LEU CA C 13 55.02 0 . 1 . . . . . 37 LEU CA . 52379 1 178 . 1 . 1 37 37 LEU CB C 13 42.45 0 . 1 . . . . . 37 LEU CB . 52379 1 179 . 1 . 1 37 37 LEU N N 15 122.36 0 . 1 . . . . . 37 LEU N . 52379 1 180 . 1 . 1 38 38 TYR H H 1 8.09 0 . 1 . . . . . 38 TYR H . 52379 1 181 . 1 . 1 38 38 TYR C C 13 175.77 0 . 1 . . . . . 38 TYR C . 52379 1 182 . 1 . 1 38 38 TYR CA C 13 57.61 0 . 1 . . . . . 38 TYR CA . 52379 1 183 . 1 . 1 38 38 TYR CB C 13 38.62 0 . 1 . . . . . 38 TYR CB . 52379 1 184 . 1 . 1 38 38 TYR N N 15 120.65 0 . 1 . . . . . 38 TYR N . 52379 1 185 . 1 . 1 39 39 ASN H H 1 8.22 0 . 1 . . . . . 39 ASN H . 52379 1 186 . 1 . 1 39 39 ASN C C 13 174.86 0 . 1 . . . . . 39 ASN C . 52379 1 187 . 1 . 1 39 39 ASN CA C 13 53.04 0 . 1 . . . . . 39 ASN CA . 52379 1 188 . 1 . 1 39 39 ASN CB C 13 39.21 0 . 1 . . . . . 39 ASN CB . 52379 1 189 . 1 . 1 39 39 ASN N N 15 120.81 0 . 1 . . . . . 39 ASN N . 52379 1 190 . 1 . 1 40 40 ASP H H 1 8.2 0 . 1 . . . . . 40 ASP H . 52379 1 191 . 1 . 1 40 40 ASP C C 13 176.54 0 . 1 . . . . . 40 ASP C . 52379 1 192 . 1 . 1 40 40 ASP CA C 13 54.31 0 . 1 . . . . . 40 ASP CA . 52379 1 193 . 1 . 1 40 40 ASP CB C 13 40.96 0 . 1 . . . . . 40 ASP CB . 52379 1 194 . 1 . 1 40 40 ASP N N 15 121.01 0 . 1 . . . . . 40 ASP N . 52379 1 195 . 1 . 1 41 41 VAL H H 1 7.92 0 . 1 . . . . . 41 VAL H . 52379 1 196 . 1 . 1 41 41 VAL C C 13 176.42 0 . 1 . . . . . 41 VAL C . 52379 1 197 . 1 . 1 41 41 VAL CA C 13 62.31 0 . 1 . . . . . 41 VAL CA . 52379 1 198 . 1 . 1 41 41 VAL CB C 13 32.5 0 . 1 . . . . . 41 VAL CB . 52379 1 199 . 1 . 1 41 41 VAL N N 15 119.88 0 . 1 . . . . . 41 VAL N . 52379 1 200 . 1 . 1 42 42 MET H H 1 8.32 0 . 1 . . . . . 42 MET H . 52379 1 201 . 1 . 1 42 42 MET C C 13 176.21 0 . 1 . . . . . 42 MET C . 52379 1 202 . 1 . 1 42 42 MET CA C 13 54.99 0 . 1 . . . . . 42 MET CA . 52379 1 203 . 1 . 1 42 42 MET CB C 13 32.51 0 . 1 . . . . . 42 MET CB . 52379 1 204 . 1 . 1 42 42 MET N N 15 123.82 0 . 1 . . . . . 42 MET N . 52379 1 205 . 1 . 1 43 43 LEU H H 1 8.18 0 . 1 . . . . . 43 LEU H . 52379 1 206 . 1 . 1 43 43 LEU C C 13 175.42 0 . 1 . . . . . 43 LEU C . 52379 1 207 . 1 . 1 43 43 LEU CA C 13 52.66 0 . 1 . . . . . 43 LEU CA . 52379 1 208 . 1 . 1 43 43 LEU CB C 13 41.43 0 . 1 . . . . . 43 LEU CB . 52379 1 209 . 1 . 1 43 43 LEU N N 15 125.49 0 . 1 . . . . . 43 LEU N . 52379 1 210 . 1 . 1 44 44 PRO C C 13 177.17 0 . 1 . . . . . 44 PRO C . 52379 1 211 . 1 . 1 44 44 PRO CA C 13 62.8 0 . 1 . . . . . 44 PRO CA . 52379 1 212 . 1 . 1 44 44 PRO CB C 13 32.07 0 . 1 . . . . . 44 PRO CB . 52379 1 213 . 1 . 1 44 44 PRO N N 15 136.05 0 . 1 . . . . . 44 PRO N . 52379 1 214 . 1 . 1 45 45 SER H H 1 8.46 0 . 1 . . . . . 45 SER H . 52379 1 215 . 1 . 1 45 45 SER C C 13 173.8 0 . 1 . . . . . 45 SER C . 52379 1 216 . 1 . 1 45 45 SER CA C 13 56.4 0 . 1 . . . . . 45 SER CA . 52379 1 217 . 1 . 1 45 45 SER CB C 13 63.69 0 . 1 . . . . . 45 SER CB . 52379 1 218 . 1 . 1 45 45 SER N N 15 117.9 0 . 1 . . . . . 45 SER N . 52379 1 219 . 1 . 1 46 46 PRO C C 13 177.36 0 . 1 . . . . . 46 PRO C . 52379 1 220 . 1 . 1 46 46 PRO CA C 13 63.83 0 . 1 . . . . . 46 PRO CA . 52379 1 221 . 1 . 1 46 46 PRO CB C 13 31.93 0 . 1 . . . . . 46 PRO CB . 52379 1 222 . 1 . 1 46 46 PRO N N 15 137.93 0 . 1 . . . . . 46 PRO N . 52379 1 223 . 1 . 1 47 47 ASN H H 1 8.35 0 . 1 . . . . . 47 ASN H . 52379 1 224 . 1 . 1 47 47 ASN C C 13 176.01 0 . 1 . . . . . 47 ASN C . 52379 1 225 . 1 . 1 47 47 ASN CA C 13 53.5 0 . 1 . . . . . 47 ASN CA . 52379 1 226 . 1 . 1 47 47 ASN CB C 13 38.38 0 . 1 . . . . . 47 ASN CB . 52379 1 227 . 1 . 1 47 47 ASN N N 15 117.97 0 . 1 . . . . . 47 ASN N . 52379 1 228 . 1 . 1 48 48 GLU H H 1 8.21 0 . 1 . . . . . 48 GLU H . 52379 1 229 . 1 . 1 48 48 GLU C C 13 177.07 0 . 1 . . . . . 48 GLU C . 52379 1 230 . 1 . 1 48 48 GLU CA C 13 57.07 0 . 1 . . . . . 48 GLU CA . 52379 1 231 . 1 . 1 48 48 GLU CB C 13 30.02 0 . 1 . . . . . 48 GLU CB . 52379 1 232 . 1 . 1 48 48 GLU N N 15 121.78 0 . 1 . . . . . 48 GLU N . 52379 1 233 . 1 . 1 49 49 LYS H H 1 8.2 0 . 1 . . . . . 49 LYS H . 52379 1 234 . 1 . 1 49 49 LYS C C 13 177.24 0 . 1 . . . . . 49 LYS C . 52379 1 235 . 1 . 1 49 49 LYS CA C 13 56.84 0 . 1 . . . . . 49 LYS CA . 52379 1 236 . 1 . 1 49 49 LYS CB C 13 32.52 0 . 1 . . . . . 49 LYS CB . 52379 1 237 . 1 . 1 49 49 LYS N N 15 121.5 0 . 1 . . . . . 49 LYS N . 52379 1 238 . 1 . 1 50 50 LEU H H 1 8.03 0 . 1 . . . . . 50 LEU H . 52379 1 239 . 1 . 1 50 50 LEU C C 13 177.87 0 . 1 . . . . . 50 LEU C . 52379 1 240 . 1 . 1 50 50 LEU CA C 13 54.99 0 . 1 . . . . . 50 LEU CA . 52379 1 241 . 1 . 1 50 50 LEU CB C 13 41.95 0 . 1 . . . . . 50 LEU CB . 52379 1 242 . 1 . 1 50 50 LEU N N 15 122.47 0 . 1 . . . . . 50 LEU N . 52379 1 243 . 1 . 1 51 51 GLN H H 1 8.22 0 . 1 . . . . . 51 GLN H . 52379 1 244 . 1 . 1 51 51 GLN C C 13 176.14 0 . 1 . . . . . 51 GLN C . 52379 1 245 . 1 . 1 51 51 GLN CA C 13 55.55 0 . 1 . . . . . 51 GLN CA . 52379 1 246 . 1 . 1 51 51 GLN CB C 13 29.42 0 . 1 . . . . . 51 GLN CB . 52379 1 247 . 1 . 1 51 51 GLN N N 15 120.38 0 . 1 . . . . . 51 GLN N . 52379 1 248 . 1 . 1 52 52 ASN H H 1 8.35 0 . 1 . . . . . 52 ASN H . 52379 1 249 . 1 . 1 52 52 ASN C C 13 175.75 0 . 1 . . . . . 52 ASN C . 52379 1 250 . 1 . 1 52 52 ASN CA C 13 53.25 0 . 1 . . . . . 52 ASN CA . 52379 1 251 . 1 . 1 52 52 ASN CB C 13 38.34 0 . 1 . . . . . 52 ASN CB . 52379 1 252 . 1 . 1 52 52 ASN N N 15 119.79 0 . 1 . . . . . 52 ASN N . 52379 1 253 . 1 . 1 53 53 ILE H H 1 8.01 0 . 1 . . . . . 53 ILE H . 52379 1 254 . 1 . 1 53 53 ILE C C 13 176.27 0 . 1 . . . . . 53 ILE C . 52379 1 255 . 1 . 1 53 53 ILE CA C 13 61.42 0 . 1 . . . . . 53 ILE CA . 52379 1 256 . 1 . 1 53 53 ILE CB C 13 38.37 0 . 1 . . . . . 53 ILE CB . 52379 1 257 . 1 . 1 53 53 ILE N N 15 120.97 0 . 1 . . . . . 53 ILE N . 52379 1 258 . 1 . 1 54 54 ASN H H 1 8.41 0 . 1 . . . . . 54 ASN H . 52379 1 259 . 1 . 1 54 54 ASN C C 13 175.76 0 . 1 . . . . . 54 ASN C . 52379 1 260 . 1 . 1 54 54 ASN CA C 13 53.24 0 . 1 . . . . . 54 ASN CA . 52379 1 261 . 1 . 1 54 54 ASN CB C 13 38.51 0 . 1 . . . . . 54 ASN CB . 52379 1 262 . 1 . 1 54 54 ASN N N 15 122.11 0 . 1 . . . . . 54 ASN N . 52379 1 263 . 1 . 1 55 55 LEU H H 1 8.14 0 . 1 . . . . . 55 LEU H . 52379 1 264 . 1 . 1 55 55 LEU C C 13 177.67 0 . 1 . . . . . 55 LEU C . 52379 1 265 . 1 . 1 55 55 LEU CA C 13 55.29 0 . 1 . . . . . 55 LEU CA . 52379 1 266 . 1 . 1 55 55 LEU CB C 13 42.15 0 . 1 . . . . . 55 LEU CB . 52379 1 267 . 1 . 1 55 55 LEU N N 15 123.13 0 . 1 . . . . . 55 LEU N . 52379 1 268 . 1 . 1 56 56 ALA H H 1 8.1 0 . 1 . . . . . 56 ALA H . 52379 1 269 . 1 . 1 56 56 ALA C C 13 178.11 0 . 1 . . . . . 56 ALA C . 52379 1 270 . 1 . 1 56 56 ALA CA C 13 52.55 0 . 1 . . . . . 56 ALA CA . 52379 1 271 . 1 . 1 56 56 ALA CB C 13 18.93 0 . 1 . . . . . 56 ALA CB . 52379 1 272 . 1 . 1 56 56 ALA N N 15 123.91 0 . 1 . . . . . 56 ALA N . 52379 1 273 . 1 . 1 57 57 MET H H 1 8.06 0 . 1 . . . . . 57 MET H . 52379 1 274 . 1 . 1 57 57 MET C C 13 176.5 0 . 1 . . . . . 57 MET C . 52379 1 275 . 1 . 1 57 57 MET CA C 13 55.1 0 . 1 . . . . . 57 MET CA . 52379 1 276 . 1 . 1 57 57 MET CB C 13 32.76 0 . 1 . . . . . 57 MET CB . 52379 1 277 . 1 . 1 57 57 MET N N 15 119.08 0 . 1 . . . . . 57 MET N . 52379 1 278 . 1 . 1 58 58 SER H H 1 8.21 0 . 1 . . . . . 58 SER H . 52379 1 279 . 1 . 1 58 58 SER C C 13 172.84 0 . 1 . . . . . 58 SER C . 52379 1 280 . 1 . 1 58 58 SER CA C 13 56.4 0 . 1 . . . . . 58 SER CA . 52379 1 281 . 1 . 1 58 58 SER CB C 13 63.36 0 . 1 . . . . . 58 SER CB . 52379 1 282 . 1 . 1 58 58 SER N N 15 118.66 0 . 1 . . . . . 58 SER N . 52379 1 283 . 1 . 1 59 59 PRO C C 13 177.15 0 . 1 . . . . . 59 PRO C . 52379 1 284 . 1 . 1 59 59 PRO CA C 13 62.74 0 . 1 . . . . . 59 PRO CA . 52379 1 285 . 1 . 1 59 59 PRO CB C 13 32.06 0 . 1 . . . . . 59 PRO CB . 52379 1 286 . 1 . 1 59 59 PRO N N 15 137.57 0 . 1 . . . . . 59 PRO N . 52379 1 287 . 1 . 1 60 60 LEU H H 1 8.26 0 . 1 . . . . . 60 LEU H . 52379 1 288 . 1 . 1 60 60 LEU C C 13 175.94 0 . 1 . . . . . 60 LEU C . 52379 1 289 . 1 . 1 60 60 LEU CA C 13 53.11 0 . 1 . . . . . 60 LEU CA . 52379 1 290 . 1 . 1 60 60 LEU CB C 13 41.25 0 . 1 . . . . . 60 LEU CB . 52379 1 291 . 1 . 1 60 60 LEU N N 15 123.87 0 . 1 . . . . . 60 LEU N . 52379 1 292 . 1 . 1 61 61 PRO C C 13 177.48 0 . 1 . . . . . 61 PRO C . 52379 1 293 . 1 . 1 61 61 PRO CA C 13 63.19 0 . 1 . . . . . 61 PRO CA . 52379 1 294 . 1 . 1 61 61 PRO CB C 13 31.99 0 . 1 . . . . . 61 PRO CB . 52379 1 295 . 1 . 1 61 61 PRO N N 15 136.33 0 . 1 . . . . . 61 PRO N . 52379 1 296 . 1 . 1 62 62 THR H H 1 8.14 0 . 1 . . . . . 62 THR H . 52379 1 297 . 1 . 1 62 62 THR C C 13 174.8 0 . 1 . . . . . 62 THR C . 52379 1 298 . 1 . 1 62 62 THR CA C 13 61.93 0 . 1 . . . . . 62 THR CA . 52379 1 299 . 1 . 1 62 62 THR CB C 13 70.14 0 . 1 . . . . . 62 THR CB . 52379 1 300 . 1 . 1 62 62 THR N N 15 114.75 0 . 1 . . . . . 62 THR N . 52379 1 301 . 1 . 1 63 63 ALA H H 1 8.3 0 . 1 . . . . . 63 ALA H . 52379 1 302 . 1 . 1 63 63 ALA C C 13 177.99 0 . 1 . . . . . 63 ALA C . 52379 1 303 . 1 . 1 63 63 ALA CA C 13 52.35 0 . 1 . . . . . 63 ALA CA . 52379 1 304 . 1 . 1 63 63 ALA CB C 13 19.14 0 . 1 . . . . . 63 ALA CB . 52379 1 305 . 1 . 1 63 63 ALA N N 15 126.57 0 . 1 . . . . . 63 ALA N . 52379 1 306 . 1 . 1 64 64 GLU H H 1 8.32 0 . 1 . . . . . 64 GLU H . 52379 1 307 . 1 . 1 64 64 GLU C C 13 176.88 0 . 1 . . . . . 64 GLU C . 52379 1 308 . 1 . 1 64 64 GLU CA C 13 56.26 0 . 1 . . . . . 64 GLU CA . 52379 1 309 . 1 . 1 64 64 GLU CB C 13 30.09 0 . 1 . . . . . 64 GLU CB . 52379 1 310 . 1 . 1 64 64 GLU N N 15 120.56 0 . 1 . . . . . 64 GLU N . 52379 1 311 . 1 . 1 65 65 THR H H 1 8.27 0 . 1 . . . . . 65 THR H . 52379 1 312 . 1 . 1 65 65 THR C C 13 173.14 0 . 1 . . . . . 65 THR C . 52379 1 313 . 1 . 1 65 65 THR CA C 13 60.06 0 . 1 . . . . . 65 THR CA . 52379 1 314 . 1 . 1 65 65 THR CB C 13 69.73 0 . 1 . . . . . 65 THR CB . 52379 1 315 . 1 . 1 65 65 THR N N 15 119.39 0 . 1 . . . . . 65 THR N . 52379 1 316 . 1 . 1 66 66 PRO C C 13 177.05 0 . 1 . . . . . 66 PRO C . 52379 1 317 . 1 . 1 66 66 PRO CA C 13 63.15 0 . 1 . . . . . 66 PRO CA . 52379 1 318 . 1 . 1 66 66 PRO CB C 13 32.12 0 . 1 . . . . . 66 PRO CB . 52379 1 319 . 1 . 1 66 66 PRO N N 15 139.52 0 . 1 . . . . . 66 PRO N . 52379 1 320 . 1 . 1 67 67 LYS H H 1 8.41 0 . 1 . . . . . 67 LYS H . 52379 1 321 . 1 . 1 67 67 LYS C C 13 175.04 0 . 1 . . . . . 67 LYS C . 52379 1 322 . 1 . 1 67 67 LYS CA C 13 54.07 0 . 1 . . . . . 67 LYS CA . 52379 1 323 . 1 . 1 67 67 LYS CB C 13 31.85 0 . 1 . . . . . 67 LYS CB . 52379 1 324 . 1 . 1 67 67 LYS N N 15 123.52 0 . 1 . . . . . 67 LYS N . 52379 1 325 . 1 . 1 68 68 PRO C C 13 177.21 0 . 1 . . . . . 68 PRO C . 52379 1 326 . 1 . 1 68 68 PRO CA C 13 63.29 0 . 1 . . . . . 68 PRO CA . 52379 1 327 . 1 . 1 68 68 PRO CB C 13 31.98 0 . 1 . . . . . 68 PRO CB . 52379 1 328 . 1 . 1 68 68 PRO N N 15 136.75 0 . 1 . . . . . 68 PRO N . 52379 1 329 . 1 . 1 69 69 LEU H H 1 8.33 0 . 1 . . . . . 69 LEU H . 52379 1 330 . 1 . 1 69 69 LEU C C 13 177.94 0 . 1 . . . . . 69 LEU C . 52379 1 331 . 1 . 1 69 69 LEU CA C 13 54.75 0 . 1 . . . . . 69 LEU CA . 52379 1 332 . 1 . 1 69 69 LEU CB C 13 42.26 0 . 1 . . . . . 69 LEU CB . 52379 1 333 . 1 . 1 69 69 LEU N N 15 122.93 0 . 1 . . . . . 69 LEU N . 52379 1 334 . 1 . 1 72 72 SER C C 13 174.44 0 . 1 . . . . . 72 SER C . 52379 1 335 . 1 . 1 72 72 SER CA C 13 58.4 0 . 1 . . . . . 72 SER CA . 52379 1 336 . 1 . 1 72 72 SER CB C 13 63.94 0 . 1 . . . . . 72 SER CB . 52379 1 337 . 1 . 1 73 73 ALA H H 1 8.21 0 . 1 . . . . . 73 ALA H . 52379 1 338 . 1 . 1 73 73 ALA C C 13 177.52 0 . 1 . . . . . 73 ALA C . 52379 1 339 . 1 . 1 73 73 ALA CA C 13 52.45 0 . 1 . . . . . 73 ALA CA . 52379 1 340 . 1 . 1 73 73 ALA CB C 13 19.28 0 . 1 . . . . . 73 ALA CB . 52379 1 341 . 1 . 1 73 73 ALA N N 15 125.54 0 . 1 . . . . . 73 ALA N . 52379 1 342 . 1 . 1 74 74 ASP H H 1 8.12 0 . 1 . . . . . 74 ASP H . 52379 1 343 . 1 . 1 74 74 ASP C C 13 175.52 0 . 1 . . . . . 74 ASP C . 52379 1 344 . 1 . 1 74 74 ASP CA C 13 55.24 0 . 1 . . . . . 74 ASP CA . 52379 1 345 . 1 . 1 74 74 ASP CB C 13 41.08 0 . 1 . . . . . 74 ASP CB . 52379 1 346 . 1 . 1 74 74 ASP N N 15 121.76 0 . 1 . . . . . 74 ASP N . 52379 1 347 . 1 . 1 75 75 PRO C C 13 177.56 0 . 1 . . . . . 75 PRO C . 52379 1 348 . 1 . 1 75 75 PRO CA C 13 63.84 0 . 1 . . . . . 75 PRO CA . 52379 1 349 . 1 . 1 75 75 PRO CB C 13 32.13 0 . 1 . . . . . 75 PRO CB . 52379 1 350 . 1 . 1 75 75 PRO N N 15 138.32 0 . 1 . . . . . 75 PRO N . 52379 1 351 . 1 . 1 76 76 ALA H H 1 8.35 0 . 1 . . . . . 76 ALA H . 52379 1 352 . 1 . 1 76 76 ALA C C 13 178.62 0 . 1 . . . . . 76 ALA C . 52379 1 353 . 1 . 1 76 76 ALA CA C 13 52.71 0 . 1 . . . . . 76 ALA CA . 52379 1 354 . 1 . 1 76 76 ALA CB C 13 18.85 0 . 1 . . . . . 76 ALA CB . 52379 1 355 . 1 . 1 76 76 ALA N N 15 122.57 0 . 1 . . . . . 76 ALA N . 52379 1 356 . 1 . 1 77 77 LEU H H 1 7.84 0 . 1 . . . . . 77 LEU H . 52379 1 357 . 1 . 1 77 77 LEU C C 13 177.67 0 . 1 . . . . . 77 LEU C . 52379 1 358 . 1 . 1 77 77 LEU CA C 13 55.11 0 . 1 . . . . . 77 LEU CA . 52379 1 359 . 1 . 1 77 77 LEU CB C 13 42.12 0 . 1 . . . . . 77 LEU CB . 52379 1 360 . 1 . 1 77 77 LEU N N 15 119.91 0 . 1 . . . . . 77 LEU N . 52379 1 361 . 1 . 1 78 78 ASN H H 1 8.17 0 . 1 . . . . . 78 ASN H . 52379 1 362 . 1 . 1 78 78 ASN C C 13 175.59 0 . 1 . . . . . 78 ASN C . 52379 1 363 . 1 . 1 78 78 ASN CA C 13 53.28 0 . 1 . . . . . 78 ASN CA . 52379 1 364 . 1 . 1 78 78 ASN CB C 13 38.58 0 . 1 . . . . . 78 ASN CB . 52379 1 365 . 1 . 1 78 78 ASN N N 15 119.05 0 . 1 . . . . . 78 ASN N . 52379 1 366 . 1 . 1 79 79 GLN H H 1 8.27 0 . 1 . . . . . 79 GLN H . 52379 1 367 . 1 . 1 79 79 GLN C C 13 176.4 0 . 1 . . . . . 79 GLN C . 52379 1 368 . 1 . 1 79 79 GLN CA C 13 55.77 0 . 1 . . . . . 79 GLN CA . 52379 1 369 . 1 . 1 79 79 GLN CB C 13 29.51 0 . 1 . . . . . 79 GLN CB . 52379 1 370 . 1 . 1 79 79 GLN N N 15 120.73 0 . 1 . . . . . 79 GLN N . 52379 1 371 . 1 . 1 80 80 GLU H H 1 8.38 0 . 1 . . . . . 80 GLU H . 52379 1 372 . 1 . 1 80 80 GLU C C 13 177.12 0 . 1 . . . . . 80 GLU C . 52379 1 373 . 1 . 1 80 80 GLU CA C 13 56.85 0 . 1 . . . . . 80 GLU CA . 52379 1 374 . 1 . 1 80 80 GLU CB C 13 30.15 0 . 1 . . . . . 80 GLU CB . 52379 1 375 . 1 . 1 80 80 GLU N N 15 122.1 0 . 1 . . . . . 80 GLU N . 52379 1 376 . 1 . 1 81 81 VAL H H 1 8.08 0 . 1 . . . . . 81 VAL H . 52379 1 377 . 1 . 1 81 81 VAL C C 13 176.32 0 . 1 . . . . . 81 VAL C . 52379 1 378 . 1 . 1 81 81 VAL CA C 13 62.48 0 . 1 . . . . . 81 VAL CA . 52379 1 379 . 1 . 1 81 81 VAL CB C 13 32.49 0 . 1 . . . . . 81 VAL CB . 52379 1 380 . 1 . 1 81 81 VAL N N 15 121.47 0 . 1 . . . . . 81 VAL N . 52379 1 381 . 1 . 1 82 82 ALA H H 1 8.26 0 . 1 . . . . . 82 ALA H . 52379 1 382 . 1 . 1 82 82 ALA C C 13 178.03 0 . 1 . . . . . 82 ALA C . 52379 1 383 . 1 . 1 82 82 ALA CA C 13 52.33 0 . 1 . . . . . 82 ALA CA . 52379 1 384 . 1 . 1 82 82 ALA CB C 13 18.93 0 . 1 . . . . . 82 ALA CB . 52379 1 385 . 1 . 1 82 82 ALA N N 15 127.72 0 . 1 . . . . . 82 ALA N . 52379 1 386 . 1 . 1 83 83 LEU H H 1 8.1 0 . 1 . . . . . 83 LEU H . 52379 1 387 . 1 . 1 83 83 LEU C C 13 177.53 0 . 1 . . . . . 83 LEU C . 52379 1 388 . 1 . 1 83 83 LEU CA C 13 55.06 0 . 1 . . . . . 83 LEU CA . 52379 1 389 . 1 . 1 83 83 LEU CB C 13 42.32 0 . 1 . . . . . 83 LEU CB . 52379 1 390 . 1 . 1 83 83 LEU N N 15 121.91 0 . 1 . . . . . 83 LEU N . 52379 1 391 . 1 . 1 84 84 LYS H H 1 8.2 0 . 1 . . . . . 84 LYS H . 52379 1 392 . 1 . 1 84 84 LYS C C 13 176.46 0 . 1 . . . . . 84 LYS C . 52379 1 393 . 1 . 1 84 84 LYS CA C 13 55.95 0 . 1 . . . . . 84 LYS CA . 52379 1 394 . 1 . 1 84 84 LYS CB C 13 32.67 0 . 1 . . . . . 84 LYS CB . 52379 1 395 . 1 . 1 84 84 LYS N N 15 123.06 0 . 1 . . . . . 84 LYS N . 52379 1 396 . 1 . 1 85 85 LEU H H 1 8.23 0 . 1 . . . . . 85 LEU H . 52379 1 397 . 1 . 1 85 85 LEU C C 13 177.45 0 . 1 . . . . . 85 LEU C . 52379 1 398 . 1 . 1 85 85 LEU CA C 13 54.82 0 . 1 . . . . . 85 LEU CA . 52379 1 399 . 1 . 1 85 85 LEU CB C 13 42.33 0 . 1 . . . . . 85 LEU CB . 52379 1 400 . 1 . 1 85 85 LEU N N 15 124.6 0 . 1 . . . . . 85 LEU N . 52379 1 401 . 1 . 1 86 86 GLU H H 1 8.34 0 . 1 . . . . . 86 GLU H . 52379 1 402 . 1 . 1 86 86 GLU C C 13 174.79 0 . 1 . . . . . 86 GLU C . 52379 1 403 . 1 . 1 86 86 GLU CA C 13 52.4 0 . 1 . . . . . 86 GLU CA . 52379 1 404 . 1 . 1 86 86 GLU CB C 13 29.68 0 . 1 . . . . . 86 GLU CB . 52379 1 405 . 1 . 1 86 86 GLU N N 15 123.6 0 . 1 . . . . . 86 GLU N . 52379 1 406 . 1 . 1 87 87 PRO C C 13 176.78 0 . 1 . . . . . 87 PRO C . 52379 1 407 . 1 . 1 87 87 PRO CA C 13 62.92 0 . 1 . . . . . 87 PRO CA . 52379 1 408 . 1 . 1 87 87 PRO CB C 13 32.05 0 . 1 . . . . . 87 PRO CB . 52379 1 409 . 1 . 1 87 87 PRO N N 15 136.77 0 . 1 . . . . . 87 PRO N . 52379 1 410 . 1 . 1 88 88 ASN H H 1 8.57 0 . 1 . . . . . 88 ASN H . 52379 1 411 . 1 . 1 88 88 ASN C C 13 174.28 0 . 1 . . . . . 88 ASN C . 52379 1 412 . 1 . 1 88 88 ASN CA C 13 51.07 0 . 1 . . . . . 88 ASN CA . 52379 1 413 . 1 . 1 88 88 ASN CB C 13 38.36 0 . 1 . . . . . 88 ASN CB . 52379 1 414 . 1 . 1 88 88 ASN N N 15 120.24 0 . 1 . . . . . 88 ASN N . 52379 1 415 . 1 . 1 89 89 PRO C C 13 177.78 0 . 1 . . . . . 89 PRO C . 52379 1 416 . 1 . 1 89 89 PRO CA C 13 63.88 0 . 1 . . . . . 89 PRO CA . 52379 1 417 . 1 . 1 89 89 PRO CB C 13 31.98 0 . 1 . . . . . 89 PRO CB . 52379 1 418 . 1 . 1 89 89 PRO N N 15 137.5 0 . 1 . . . . . 89 PRO N . 52379 1 419 . 1 . 1 90 90 GLU H H 1 8.44 0 . 1 . . . . . 90 GLU H . 52379 1 420 . 1 . 1 90 90 GLU C C 13 177.25 0 . 1 . . . . . 90 GLU C . 52379 1 421 . 1 . 1 90 90 GLU CA C 13 56.94 0 . 1 . . . . . 90 GLU CA . 52379 1 422 . 1 . 1 90 90 GLU CB C 13 29.66 0 . 1 . . . . . 90 GLU CB . 52379 1 423 . 1 . 1 90 90 GLU N N 15 119.89 0 . 1 . . . . . 90 GLU N . 52379 1 424 . 1 . 1 91 91 SER H H 1 8.09 0 . 1 . . . . . 91 SER H . 52379 1 425 . 1 . 1 91 91 SER C C 13 175.15 0 . 1 . . . . . 91 SER C . 52379 1 426 . 1 . 1 91 91 SER CA C 13 58.29 0 . 1 . . . . . 91 SER CA . 52379 1 427 . 1 . 1 91 91 SER CB C 13 63.78 0 . 1 . . . . . 91 SER CB . 52379 1 428 . 1 . 1 91 91 SER N N 15 116.03 0 . 1 . . . . . 91 SER N . 52379 1 429 . 1 . 1 92 92 LEU H H 1 8.12 0 . 1 . . . . . 92 LEU H . 52379 1 430 . 1 . 1 92 92 LEU C C 13 177.98 0 . 1 . . . . . 92 LEU C . 52379 1 431 . 1 . 1 92 92 LEU CA C 13 55.24 0 . 1 . . . . . 92 LEU CA . 52379 1 432 . 1 . 1 92 92 LEU CB C 13 42.17 0 . 1 . . . . . 92 LEU CB . 52379 1 433 . 1 . 1 92 92 LEU N N 15 124.4 0 . 1 . . . . . 92 LEU N . 52379 1 434 . 1 . 1 93 93 GLU H H 1 8.23 0 . 1 . . . . . 93 GLU H . 52379 1 435 . 1 . 1 93 93 GLU C C 13 177.03 0 . 1 . . . . . 93 GLU C . 52379 1 436 . 1 . 1 93 93 GLU CA C 13 56.73 0 . 1 . . . . . 93 GLU CA . 52379 1 437 . 1 . 1 93 93 GLU CB C 13 29.79 0 . 1 . . . . . 93 GLU CB . 52379 1 438 . 1 . 1 93 93 GLU N N 15 121.15 0 . 1 . . . . . 93 GLU N . 52379 1 439 . 1 . 1 94 94 LEU H H 1 8.13 0 . 1 . . . . . 94 LEU H . 52379 1 440 . 1 . 1 94 94 LEU C C 13 177.91 0 . 1 . . . . . 94 LEU C . 52379 1 441 . 1 . 1 94 94 LEU CA C 13 55.22 0 . 1 . . . . . 94 LEU CA . 52379 1 442 . 1 . 1 94 94 LEU CB C 13 42.02 0 . 1 . . . . . 94 LEU CB . 52379 1 443 . 1 . 1 94 94 LEU N N 15 123.06 0 . 1 . . . . . 94 LEU N . 52379 1 444 . 1 . 1 95 95 SER H H 1 8.11 0 . 1 . . . . . 95 SER H . 52379 1 445 . 1 . 1 95 95 SER C C 13 174.56 0 . 1 . . . . . 95 SER C . 52379 1 446 . 1 . 1 95 95 SER CA C 13 58.31 0 . 1 . . . . . 95 SER CA . 52379 1 447 . 1 . 1 95 95 SER CB C 13 63.86 0 . 1 . . . . . 95 SER CB . 52379 1 448 . 1 . 1 95 95 SER N N 15 116.07 0 . 1 . . . . . 95 SER N . 52379 1 449 . 1 . 1 96 96 PHE H H 1 8.08 0 . 1 . . . . . 96 PHE H . 52379 1 450 . 1 . 1 96 96 PHE C C 13 176.08 0 . 1 . . . . . 96 PHE C . 52379 1 451 . 1 . 1 96 96 PHE CA C 13 57.77 0 . 1 . . . . . 96 PHE CA . 52379 1 452 . 1 . 1 96 96 PHE CB C 13 39.67 0 . 1 . . . . . 96 PHE CB . 52379 1 453 . 1 . 1 96 96 PHE N N 15 122.03 0 . 1 . . . . . 96 PHE N . 52379 1 454 . 1 . 1 97 97 THR H H 1 7.99 0 . 1 . . . . . 97 THR H . 52379 1 455 . 1 . 1 97 97 THR C C 13 174.27 0 . 1 . . . . . 97 THR C . 52379 1 456 . 1 . 1 97 97 THR CA C 13 61.58 0 . 1 . . . . . 97 THR CA . 52379 1 457 . 1 . 1 97 97 THR CB C 13 70.04 0 . 1 . . . . . 97 THR CB . 52379 1 458 . 1 . 1 97 97 THR N N 15 116.45 0 . 1 . . . . . 97 THR N . 52379 1 459 . 1 . 1 98 98 MET H H 1 8.28 0 . 1 . . . . . 98 MET H . 52379 1 460 . 1 . 1 98 98 MET C C 13 174.53 0 . 1 . . . . . 98 MET C . 52379 1 461 . 1 . 1 98 98 MET CA C 13 53.36 0 . 1 . . . . . 98 MET CA . 52379 1 462 . 1 . 1 98 98 MET CB C 13 32.14 0 . 1 . . . . . 98 MET CB . 52379 1 463 . 1 . 1 98 98 MET N N 15 124.52 0 . 1 . . . . . 98 MET N . 52379 1 464 . 1 . 1 99 99 PRO C C 13 177.11 0 . 1 . . . . . 99 PRO C . 52379 1 465 . 1 . 1 99 99 PRO CA C 13 63.22 0 . 1 . . . . . 99 PRO CA . 52379 1 466 . 1 . 1 99 99 PRO CB C 13 32.04 0 . 1 . . . . . 99 PRO CB . 52379 1 467 . 1 . 1 99 99 PRO N N 15 137.22 0 . 1 . . . . . 99 PRO N . 52379 1 468 . 1 . 1 100 100 GLN H H 1 8.47 0 . 1 . . . . . 100 GLN H . 52379 1 469 . 1 . 1 100 100 GLN C C 13 176.54 0 . 1 . . . . . 100 GLN C . 52379 1 470 . 1 . 1 100 100 GLN CA C 13 55.43 0 . 1 . . . . . 100 GLN CA . 52379 1 471 . 1 . 1 100 100 GLN CB C 13 29.38 0 . 1 . . . . . 100 GLN CB . 52379 1 472 . 1 . 1 100 100 GLN N N 15 121.16 0 . 1 . . . . . 100 GLN N . 52379 1 473 . 1 . 1 101 101 ILE H H 1 8.24 0 . 1 . . . . . 101 ILE H . 52379 1 474 . 1 . 1 101 101 ILE C C 13 176.74 0 . 1 . . . . . 101 ILE C . 52379 1 475 . 1 . 1 101 101 ILE CA C 13 61.13 0 . 1 . . . . . 101 ILE CA . 52379 1 476 . 1 . 1 101 101 ILE CB C 13 38.36 0 . 1 . . . . . 101 ILE CB . 52379 1 477 . 1 . 1 101 101 ILE N N 15 123.15 0 . 1 . . . . . 101 ILE N . 52379 1 478 . 1 . 1 102 102 GLN H H 1 8.48 0 . 1 . . . . . 102 GLN H . 52379 1 479 . 1 . 1 102 102 GLN C C 13 175.99 0 . 1 . . . . . 102 GLN C . 52379 1 480 . 1 . 1 102 102 GLN CA C 13 55.67 0 . 1 . . . . . 102 GLN CA . 52379 1 481 . 1 . 1 102 102 GLN CB C 13 29.37 0 . 1 . . . . . 102 GLN CB . 52379 1 482 . 1 . 1 102 102 GLN N N 15 124.87 0 . 1 . . . . . 102 GLN N . 52379 1 483 . 1 . 1 103 103 ASP H H 1 8.35 0 . 1 . . . . . 103 ASP H . 52379 1 484 . 1 . 1 103 103 ASP C C 13 176.54 0 . 1 . . . . . 103 ASP C . 52379 1 485 . 1 . 1 103 103 ASP CA C 13 54.51 0 . 1 . . . . . 103 ASP CA . 52379 1 486 . 1 . 1 103 103 ASP CB C 13 41.1 0 . 1 . . . . . 103 ASP CB . 52379 1 487 . 1 . 1 103 103 ASP N N 15 122.07 0 . 1 . . . . . 103 ASP N . 52379 1 488 . 1 . 1 104 104 GLN H H 1 8.32 0 . 1 . . . . . 104 GLN H . 52379 1 489 . 1 . 1 104 104 GLN C C 13 176.37 0 . 1 . . . . . 104 GLN C . 52379 1 490 . 1 . 1 104 104 GLN CA C 13 55.77 0 . 1 . . . . . 104 GLN CA . 52379 1 491 . 1 . 1 104 104 GLN CB C 13 29.58 0 . 1 . . . . . 104 GLN CB . 52379 1 492 . 1 . 1 104 104 GLN N N 15 120.83 0 . 1 . . . . . 104 GLN N . 52379 1 493 . 1 . 1 105 105 THR H H 1 8.28 0 . 1 . . . . . 105 THR H . 52379 1 494 . 1 . 1 105 105 THR C C 13 173.14 0 . 1 . . . . . 105 THR C . 52379 1 495 . 1 . 1 105 105 THR CA C 13 60.24 0 . 1 . . . . . 105 THR CA . 52379 1 496 . 1 . 1 105 105 THR CB C 13 69.65 0 . 1 . . . . . 105 THR CB . 52379 1 497 . 1 . 1 105 105 THR N N 15 119.19 0 . 1 . . . . . 105 THR N . 52379 1 498 . 1 . 1 106 106 PRO C C 13 177.17 0 . 1 . . . . . 106 PRO C . 52379 1 499 . 1 . 1 106 106 PRO CA C 13 63.2 0 . 1 . . . . . 106 PRO CA . 52379 1 500 . 1 . 1 106 106 PRO CB C 13 32.08 0 . 1 . . . . . 106 PRO CB . 52379 1 501 . 1 . 1 106 106 PRO N N 15 139.55 0 . 1 . . . . . 106 PRO N . 52379 1 502 . 1 . 1 107 107 SER H H 1 8.52 0 . 1 . . . . . 107 SER H . 52379 1 503 . 1 . 1 107 107 SER C C 13 173.49 0 . 1 . . . . . 107 SER C . 52379 1 504 . 1 . 1 107 107 SER CA C 13 56.54 0 . 1 . . . . . 107 SER CA . 52379 1 505 . 1 . 1 107 107 SER CB C 13 63.47 0 . 1 . . . . . 107 SER CB . 52379 1 506 . 1 . 1 107 107 SER N N 15 118.44 0 . 1 . . . . . 107 SER N . 52379 1 507 . 1 . 1 108 108 PRO C C 13 177.66 0 . 1 . . . . . 108 PRO C . 52379 1 508 . 1 . 1 108 108 PRO CA C 13 63.61 0 . 1 . . . . . 108 PRO CA . 52379 1 509 . 1 . 1 108 108 PRO CB C 13 32.01 0 . 1 . . . . . 108 PRO CB . 52379 1 510 . 1 . 1 108 108 PRO N N 15 138.39 0 . 1 . . . . . 108 PRO N . 52379 1 511 . 1 . 1 109 109 SER H H 1 8.38 0 . 1 . . . . . 109 SER H . 52379 1 512 . 1 . 1 109 109 SER C C 13 175.06 0 . 1 . . . . . 109 SER C . 52379 1 513 . 1 . 1 109 109 SER CA C 13 58.64 0 . 1 . . . . . 109 SER CA . 52379 1 514 . 1 . 1 109 109 SER CB C 13 63.79 0 . 1 . . . . . 109 SER CB . 52379 1 515 . 1 . 1 109 109 SER N N 15 116.02 0 . 1 . . . . . 109 SER N . 52379 1 516 . 1 . 1 110 110 ASP H H 1 8.22 0 . 1 . . . . . 110 ASP H . 52379 1 517 . 1 . 1 110 110 ASP C C 13 177.43 0 . 1 . . . . . 110 ASP C . 52379 1 518 . 1 . 1 110 110 ASP CA C 13 54.35 0 . 1 . . . . . 110 ASP CA . 52379 1 519 . 1 . 1 110 110 ASP CB C 13 41.03 0 . 1 . . . . . 110 ASP CB . 52379 1 520 . 1 . 1 110 110 ASP N N 15 122.43 0 . 1 . . . . . 110 ASP N . 52379 1 521 . 1 . 1 111 111 GLY H H 1 8.35 0 . 1 . . . . . 111 GLY H . 52379 1 522 . 1 . 1 111 111 GLY C C 13 175.15 0 . 1 . . . . . 111 GLY C . 52379 1 523 . 1 . 1 111 111 GLY CA C 13 45.59 0 . 1 . . . . . 111 GLY CA . 52379 1 524 . 1 . 1 111 111 GLY N N 15 109.52 0 . 1 . . . . . 111 GLY N . 52379 1 525 . 1 . 1 112 112 SER H H 1 8.22 0 . 1 . . . . . 112 SER H . 52379 1 526 . 1 . 1 112 112 SER C C 13 175.45 0 . 1 . . . . . 112 SER C . 52379 1 527 . 1 . 1 112 112 SER CA C 13 58.9 0 . 1 . . . . . 112 SER CA . 52379 1 528 . 1 . 1 112 112 SER CB C 13 63.96 0 . 1 . . . . . 112 SER CB . 52379 1 529 . 1 . 1 112 112 SER N N 15 116.06 0 . 1 . . . . . 112 SER N . 52379 1 530 . 1 . 1 113 113 THR H H 1 8.13 0 . 1 . . . . . 113 THR H . 52379 1 531 . 1 . 1 113 113 THR C C 13 173.62 0 . 1 . . . . . 113 THR C . 52379 1 532 . 1 . 1 113 113 THR CA C 13 61.94 0 . 1 . . . . . 113 THR CA . 52379 1 533 . 1 . 1 113 113 THR CB C 13 70.02 0 . 1 . . . . . 113 THR CB . 52379 1 534 . 1 . 1 113 113 THR N N 15 115.61 0 . 1 . . . . . 113 THR N . 52379 1 535 . 1 . 1 115 115 GLN C C 13 176.36 0 . 1 . . . . . 115 GLN C . 52379 1 536 . 1 . 1 115 115 GLN CA C 13 55.74 0 . 1 . . . . . 115 GLN CA . 52379 1 537 . 1 . 1 115 115 GLN CB C 13 29.47 0 . 1 . . . . . 115 GLN CB . 52379 1 538 . 1 . 1 116 116 SER H H 1 8.37 0 . 1 . . . . . 116 SER H . 52379 1 539 . 1 . 1 116 116 SER C C 13 174.5 0 . 1 . . . . . 116 SER C . 52379 1 540 . 1 . 1 116 116 SER CA C 13 58.08 0 . 1 . . . . . 116 SER CA . 52379 1 541 . 1 . 1 116 116 SER CB C 13 63.84 0 . 1 . . . . . 116 SER CB . 52379 1 542 . 1 . 1 116 116 SER N N 15 117.9 0 . 1 . . . . . 116 SER N . 52379 1 543 . 1 . 1 117 117 SER H H 1 8.34 0 . 1 . . . . . 117 SER H . 52379 1 544 . 1 . 1 117 117 SER C C 13 172.78 0 . 1 . . . . . 117 SER C . 52379 1 545 . 1 . 1 117 117 SER CA C 13 56.45 0 . 1 . . . . . 117 SER CA . 52379 1 546 . 1 . 1 117 117 SER CB C 13 63.29 0 . 1 . . . . . 117 SER CB . 52379 1 547 . 1 . 1 117 117 SER N N 15 118.98 0 . 1 . . . . . 117 SER N . 52379 1 548 . 1 . 1 118 118 PRO C C 13 176.47 0 . 1 . . . . . 118 PRO C . 52379 1 549 . 1 . 1 118 118 PRO CA C 13 63.43 0 . 1 . . . . . 118 PRO CA . 52379 1 550 . 1 . 1 118 118 PRO CB C 13 31.95 0 . 1 . . . . . 118 PRO CB . 52379 1 551 . 1 . 1 119 119 GLU H H 1 7.97 0 . 1 . . . . . 119 GLU H . 52379 1 552 . 1 . 1 119 119 GLU C C 13 181.69 0 . 1 . . . . . 119 GLU C . 52379 1 553 . 1 . 1 119 119 GLU CA C 13 57.37 0 . 1 . . . . . 119 GLU CA . 52379 1 554 . 1 . 1 119 119 GLU CB C 13 31.44 0 . 1 . . . . . 119 GLU CB . 52379 1 555 . 1 . 1 119 119 GLU N N 15 127.07 0 . 1 . . . . . 119 GLU N . 52379 1 556 . 1 . 1 120 120 PRO C C 13 177.17 0 . 1 . . . . . 120 PRO C . 52379 1 557 . 1 . 1 120 120 PRO CA C 13 63.34 0 . 1 . . . . . 120 PRO CA . 52379 1 558 . 1 . 1 120 120 PRO CB C 13 32.11 0 . 1 . . . . . 120 PRO CB . 52379 1 559 . 1 . 1 121 121 ASN H H 1 8.53 0 . 1 . . . . . 121 ASN H . 52379 1 560 . 1 . 1 121 121 ASN C C 13 175.32 0 . 1 . . . . . 121 ASN C . 52379 1 561 . 1 . 1 121 121 ASN CA C 13 53.25 0 . 1 . . . . . 121 ASN CA . 52379 1 562 . 1 . 1 121 121 ASN CB C 13 38.8 0 . 1 . . . . . 121 ASN CB . 52379 1 563 . 1 . 1 121 121 ASN N N 15 118.45 0 . 1 . . . . . 121 ASN N . 52379 1 564 . 1 . 1 122 122 SER H H 1 8.15 0 . 1 . . . . . 122 SER H . 52379 1 565 . 1 . 1 122 122 SER C C 13 173.22 0 . 1 . . . . . 122 SER C . 52379 1 566 . 1 . 1 122 122 SER CA C 13 56.45 0 . 1 . . . . . 122 SER CA . 52379 1 567 . 1 . 1 122 122 SER CB C 13 63.63 0 . 1 . . . . . 122 SER CB . 52379 1 568 . 1 . 1 122 122 SER N N 15 117.11 0 . 1 . . . . . 122 SER N . 52379 1 569 . 1 . 1 123 123 PRO C C 13 177.55 0 . 1 . . . . . 123 PRO C . 52379 1 570 . 1 . 1 123 123 PRO CA C 13 63.61 0 . 1 . . . . . 123 PRO CA . 52379 1 571 . 1 . 1 123 123 PRO CB C 13 32.01 0 . 1 . . . . . 123 PRO CB . 52379 1 572 . 1 . 1 123 123 PRO N N 15 138.07 0 . 1 . . . . . 123 PRO N . 52379 1 573 . 1 . 1 124 124 SER H H 1 8.29 0 . 1 . . . . . 124 SER H . 52379 1 574 . 1 . 1 124 124 SER C C 13 175.06 0 . 1 . . . . . 124 SER C . 52379 1 575 . 1 . 1 124 124 SER CA C 13 58.64 0 . 1 . . . . . 124 SER CA . 52379 1 576 . 1 . 1 124 124 SER CB C 13 63.79 0 . 1 . . . . . 124 SER CB . 52379 1 577 . 1 . 1 124 124 SER N N 15 115.9 0 . 1 . . . . . 124 SER N . 52379 1 578 . 1 . 1 125 125 GLU H H 1 8.3 0 . 1 . . . . . 125 GLU H . 52379 1 579 . 1 . 1 125 125 GLU C C 13 176.45 0 . 1 . . . . . 125 GLU C . 52379 1 580 . 1 . 1 125 125 GLU CA C 13 56.37 0 . 1 . . . . . 125 GLU CA . 52379 1 581 . 1 . 1 125 125 GLU CB C 13 29.98 0 . 1 . . . . . 125 GLU CB . 52379 1 582 . 1 . 1 125 125 GLU N N 15 122.42 0 . 1 . . . . . 125 GLU N . 52379 1 583 . 1 . 1 126 126 TYR H H 1 8.07 0 . 1 . . . . . 126 TYR H . 52379 1 584 . 1 . 1 126 126 TYR C C 13 175.85 0 . 1 . . . . . 126 TYR C . 52379 1 585 . 1 . 1 126 126 TYR CA C 13 58.24 0 . 1 . . . . . 126 TYR CA . 52379 1 586 . 1 . 1 126 126 TYR CB C 13 38.64 0 . 1 . . . . . 126 TYR CB . 52379 1 587 . 1 . 1 126 126 TYR N N 15 120.87 0 . 1 . . . . . 126 TYR N . 52379 1 588 . 1 . 1 127 127 CYS H H 1 7.94 0 . 1 . . . . . 127 CYS H . 52379 1 589 . 1 . 1 127 127 CYS C C 13 173.98 0 . 1 . . . . . 127 CYS C . 52379 1 590 . 1 . 1 127 127 CYS CA C 13 58.31 0 . 1 . . . . . 127 CYS CA . 52379 1 591 . 1 . 1 127 127 CYS CB C 13 27.97 0 . 1 . . . . . 127 CYS CB . 52379 1 592 . 1 . 1 127 127 CYS N N 15 121.66 0 . 1 . . . . . 127 CYS N . 52379 1 593 . 1 . 1 128 128 PHE H H 1 8.02 0 . 1 . . . . . 128 PHE H . 52379 1 594 . 1 . 1 128 128 PHE C C 13 175.35 0 . 1 . . . . . 128 PHE C . 52379 1 595 . 1 . 1 128 128 PHE CA C 13 57.76 0 . 1 . . . . . 128 PHE CA . 52379 1 596 . 1 . 1 128 128 PHE CB C 13 39.55 0 . 1 . . . . . 128 PHE CB . 52379 1 597 . 1 . 1 128 128 PHE N N 15 123.02 0 . 1 . . . . . 128 PHE N . 52379 1 598 . 1 . 1 129 129 TYR H H 1 7.99 0 . 1 . . . . . 129 TYR H . 52379 1 599 . 1 . 1 129 129 TYR C C 13 175.56 0 . 1 . . . . . 129 TYR C . 52379 1 600 . 1 . 1 129 129 TYR CA C 13 58.03 0 . 1 . . . . . 129 TYR CA . 52379 1 601 . 1 . 1 129 129 TYR CB C 13 39.07 0 . 1 . . . . . 129 TYR CB . 52379 1 602 . 1 . 1 129 129 TYR N N 15 122.33 0 . 1 . . . . . 129 TYR N . 52379 1 603 . 1 . 1 130 130 VAL H H 1 7.91 0 . 1 . . . . . 130 VAL H . 52379 1 604 . 1 . 1 130 130 VAL C C 13 175.71 0 . 1 . . . . . 130 VAL C . 52379 1 605 . 1 . 1 130 130 VAL CA C 13 61.94 0 . 1 . . . . . 130 VAL CA . 52379 1 606 . 1 . 1 130 130 VAL CB C 13 33.07 0 . 1 . . . . . 130 VAL CB . 52379 1 607 . 1 . 1 130 130 VAL N N 15 122.73 0 . 1 . . . . . 130 VAL N . 52379 1 608 . 1 . 1 131 131 ASP H H 1 8.25 0 . 1 . . . . . 131 ASP H . 52379 1 609 . 1 . 1 131 131 ASP C C 13 176.95 0 . 1 . . . . . 131 ASP C . 52379 1 610 . 1 . 1 131 131 ASP CA C 13 54.23 0 . 1 . . . . . 131 ASP CA . 52379 1 611 . 1 . 1 131 131 ASP CB C 13 41.19 0 . 1 . . . . . 131 ASP CB . 52379 1 612 . 1 . 1 131 131 ASP N N 15 124.3 0 . 1 . . . . . 131 ASP N . 52379 1 613 . 1 . 1 132 132 SER H H 1 8.2 0 . 1 . . . . . 132 SER H . 52379 1 614 . 1 . 1 132 132 SER C C 13 175 0 . 1 . . . . . 132 SER C . 52379 1 615 . 1 . 1 132 132 SER CA C 13 59.06 0 . 1 . . . . . 132 SER CA . 52379 1 616 . 1 . 1 132 132 SER CB C 13 63.82 0 . 1 . . . . . 132 SER CB . 52379 1 617 . 1 . 1 132 132 SER N N 15 116.78 0 . 1 . . . . . 132 SER N . 52379 1 618 . 1 . 1 133 133 ASP H H 1 8.34 0 . 1 . . . . . 133 ASP H . 52379 1 619 . 1 . 1 133 133 ASP C C 13 176.89 0 . 1 . . . . . 133 ASP C . 52379 1 620 . 1 . 1 133 133 ASP CA C 13 54.7 0 . 1 . . . . . 133 ASP CA . 52379 1 621 . 1 . 1 133 133 ASP CB C 13 40.76 0 . 1 . . . . . 133 ASP CB . 52379 1 622 . 1 . 1 133 133 ASP N N 15 121.96 0 . 1 . . . . . 133 ASP N . 52379 1 623 . 1 . 1 134 134 MET H H 1 8.02 0 . 1 . . . . . 134 MET H . 52379 1 624 . 1 . 1 134 134 MET C C 13 176.85 0 . 1 . . . . . 134 MET C . 52379 1 625 . 1 . 1 134 134 MET CA C 13 55.63 0 . 1 . . . . . 134 MET CA . 52379 1 626 . 1 . 1 134 134 MET CB C 13 32.63 0 . 1 . . . . . 134 MET CB . 52379 1 627 . 1 . 1 134 134 MET N N 15 119.99 0 . 1 . . . . . 134 MET N . 52379 1 628 . 1 . 1 135 135 VAL H H 1 7.97 0 . 1 . . . . . 135 VAL H . 52379 1 629 . 1 . 1 135 135 VAL C C 13 176.46 0 . 1 . . . . . 135 VAL C . 52379 1 630 . 1 . 1 135 135 VAL CA C 13 62.8 0 . 1 . . . . . 135 VAL CA . 52379 1 631 . 1 . 1 135 135 VAL CB C 13 32.33 0 . 1 . . . . . 135 VAL CB . 52379 1 632 . 1 . 1 135 135 VAL N N 15 120.9 0 . 1 . . . . . 135 VAL N . 52379 1 633 . 1 . 1 136 136 ASN H H 1 8.35 0 . 1 . . . . . 136 ASN H . 52379 1 634 . 1 . 1 136 136 ASN C C 13 175.65 0 . 1 . . . . . 136 ASN C . 52379 1 635 . 1 . 1 136 136 ASN CA C 13 53.15 0 . 1 . . . . . 136 ASN CA . 52379 1 636 . 1 . 1 136 136 ASN CB C 13 38.85 0 . 1 . . . . . 136 ASN CB . 52379 1 637 . 1 . 1 136 136 ASN N N 15 121.98 0 . 1 . . . . . 136 ASN N . 52379 1 638 . 1 . 1 137 137 GLU H H 1 8.28 0 . 1 . . . . . 137 GLU H . 52379 1 639 . 1 . 1 137 137 GLU C C 13 176.59 0 . 1 . . . . . 137 GLU C . 52379 1 640 . 1 . 1 137 137 GLU CA C 13 56.98 0 . 1 . . . . . 137 GLU CA . 52379 1 641 . 1 . 1 137 137 GLU CB C 13 30.06 0 . 1 . . . . . 137 GLU CB . 52379 1 642 . 1 . 1 137 137 GLU N N 15 121.73 0 . 1 . . . . . 137 GLU N . 52379 1 643 . 1 . 1 138 138 PHE H H 1 8.15 0 . 1 . . . . . 138 PHE H . 52379 1 644 . 1 . 1 138 138 PHE C C 13 175.97 0 . 1 . . . . . 138 PHE C . 52379 1 645 . 1 . 1 138 138 PHE CA C 13 57.86 0 . 1 . . . . . 138 PHE CA . 52379 1 646 . 1 . 1 138 138 PHE CB C 13 39.24 0 . 1 . . . . . 138 PHE CB . 52379 1 647 . 1 . 1 138 138 PHE N N 15 120.99 0 . 1 . . . . . 138 PHE N . 52379 1 648 . 1 . 1 139 139 LYS H H 1 7.96 0 . 1 . . . . . 139 LYS H . 52379 1 649 . 1 . 1 139 139 LYS C C 13 176.43 0 . 1 . . . . . 139 LYS C . 52379 1 650 . 1 . 1 139 139 LYS CA C 13 56.12 0 . 1 . . . . . 139 LYS CA . 52379 1 651 . 1 . 1 139 139 LYS CB C 13 32.83 0 . 1 . . . . . 139 LYS CB . 52379 1 652 . 1 . 1 139 139 LYS N N 15 123.28 0 . 1 . . . . . 139 LYS N . 52379 1 653 . 1 . 1 140 140 LEU H H 1 8.13 0 . 1 . . . . . 140 LEU H . 52379 1 654 . 1 . 1 140 140 LEU C C 13 177.74 0 . 1 . . . . . 140 LEU C . 52379 1 655 . 1 . 1 140 140 LEU CA C 13 55.24 0 . 1 . . . . . 140 LEU CA . 52379 1 656 . 1 . 1 140 140 LEU CB C 13 42.26 0 . 1 . . . . . 140 LEU CB . 52379 1 657 . 1 . 1 140 140 LEU N N 15 123.94 0 . 1 . . . . . 140 LEU N . 52379 1 658 . 1 . 1 141 141 GLU H H 1 8.38 0 . 1 . . . . . 141 GLU H . 52379 1 659 . 1 . 1 141 141 GLU C C 13 176.7 0 . 1 . . . . . 141 GLU C . 52379 1 660 . 1 . 1 141 141 GLU CA C 13 56.36 0 . 1 . . . . . 141 GLU CA . 52379 1 661 . 1 . 1 141 141 GLU CB C 13 29.93 0 . 1 . . . . . 141 GLU CB . 52379 1 662 . 1 . 1 141 141 GLU N N 15 122.09 0 . 1 . . . . . 141 GLU N . 52379 1 663 . 1 . 1 142 142 LEU H H 1 8.15 0 . 1 . . . . . 142 LEU H . 52379 1 664 . 1 . 1 142 142 LEU C C 13 177.68 0 . 1 . . . . . 142 LEU C . 52379 1 665 . 1 . 1 142 142 LEU CA C 13 55.18 0 . 1 . . . . . 142 LEU CA . 52379 1 666 . 1 . 1 142 142 LEU CB C 13 42.12 0 . 1 . . . . . 142 LEU CB . 52379 1 667 . 1 . 1 142 142 LEU N N 15 123.5 0 . 1 . . . . . 142 LEU N . 52379 1 668 . 1 . 1 143 143 VAL H H 1 8 0 . 1 . . . . . 143 VAL H . 52379 1 669 . 1 . 1 143 143 VAL C C 13 176.62 0 . 1 . . . . . 143 VAL C . 52379 1 670 . 1 . 1 143 143 VAL CA C 13 62.48 0 . 1 . . . . . 143 VAL CA . 52379 1 671 . 1 . 1 143 143 VAL CB C 13 32.56 0 . 1 . . . . . 143 VAL CB . 52379 1 672 . 1 . 1 143 143 VAL N N 15 121.63 0 . 1 . . . . . 143 VAL N . 52379 1 673 . 1 . 1 144 144 GLU H H 1 8.38 0 . 1 . . . . . 144 GLU H . 52379 1 674 . 1 . 1 144 144 GLU C C 13 176.73 0 . 1 . . . . . 144 GLU C . 52379 1 675 . 1 . 1 144 144 GLU CA C 13 56.64 0 . 1 . . . . . 144 GLU CA . 52379 1 676 . 1 . 1 144 144 GLU CB C 13 30.11 0 . 1 . . . . . 144 GLU CB . 52379 1 677 . 1 . 1 144 144 GLU N N 15 124.91 0 . 1 . . . . . 144 GLU N . 52379 1 678 . 1 . 1 145 145 LYS H H 1 8.24 0 . 1 . . . . . 145 LYS H . 52379 1 679 . 1 . 1 145 145 LYS C C 13 176.58 0 . 1 . . . . . 145 LYS C . 52379 1 680 . 1 . 1 145 145 LYS CA C 13 55.95 0 . 1 . . . . . 145 LYS CA . 52379 1 681 . 1 . 1 145 145 LYS CB C 13 32.64 0 . 1 . . . . . 145 LYS CB . 52379 1 682 . 1 . 1 145 145 LYS N N 15 123.15 0 . 1 . . . . . 145 LYS N . 52379 1 683 . 1 . 1 146 146 LEU H H 1 8.15 0 . 1 . . . . . 146 LEU H . 52379 1 684 . 1 . 1 146 146 LEU C C 13 177.46 0 . 1 . . . . . 146 LEU C . 52379 1 685 . 1 . 1 146 146 LEU CA C 13 55.23 0 . 1 . . . . . 146 LEU CA . 52379 1 686 . 1 . 1 146 146 LEU CB C 13 42.16 0 . 1 . . . . . 146 LEU CB . 52379 1 687 . 1 . 1 146 146 LEU N N 15 123.5 0 . 1 . . . . . 146 LEU N . 52379 1 688 . 1 . 1 147 147 PHE H H 1 8.16 0 . 1 . . . . . 147 PHE H . 52379 1 689 . 1 . 1 147 147 PHE C C 13 175.77 0 . 1 . . . . . 147 PHE C . 52379 1 690 . 1 . 1 147 147 PHE CA C 13 57.62 0 . 1 . . . . . 147 PHE CA . 52379 1 691 . 1 . 1 147 147 PHE CB C 13 39.46 0 . 1 . . . . . 147 PHE CB . 52379 1 692 . 1 . 1 147 147 PHE N N 15 120.76 0 . 1 . . . . . 147 PHE N . 52379 1 693 . 1 . 1 148 148 ALA H H 1 8.13 0 . 1 . . . . . 148 ALA H . 52379 1 694 . 1 . 1 148 148 ALA C C 13 177.78 0 . 1 . . . . . 148 ALA C . 52379 1 695 . 1 . 1 148 148 ALA CA C 13 52.23 0 . 1 . . . . . 148 ALA CA . 52379 1 696 . 1 . 1 148 148 ALA CB C 13 19.38 0 . 1 . . . . . 148 ALA CB . 52379 1 697 . 1 . 1 148 148 ALA N N 15 125.74 0 . 1 . . . . . 148 ALA N . 52379 1 698 . 1 . 1 149 149 GLU H H 1 8.3 0 . 1 . . . . . 149 GLU H . 52379 1 699 . 1 . 1 149 149 GLU C C 13 176.73 0 . 1 . . . . . 149 GLU C . 52379 1 700 . 1 . 1 149 149 GLU CA C 13 56.49 0 . 1 . . . . . 149 GLU CA . 52379 1 701 . 1 . 1 149 149 GLU CB C 13 30.1 0 . 1 . . . . . 149 GLU CB . 52379 1 702 . 1 . 1 149 149 GLU N N 15 120.31 0 . 1 . . . . . 149 GLU N . 52379 1 703 . 1 . 1 150 150 ASP H H 1 8.38 0 . 1 . . . . . 150 ASP H . 52379 1 704 . 1 . 1 150 150 ASP C C 13 177.15 0 . 1 . . . . . 150 ASP C . 52379 1 705 . 1 . 1 150 150 ASP CA C 13 54.28 0 . 1 . . . . . 150 ASP CA . 52379 1 706 . 1 . 1 150 150 ASP CB C 13 40.85 0 . 1 . . . . . 150 ASP CB . 52379 1 707 . 1 . 1 150 150 ASP N N 15 121.72 0 . 1 . . . . . 150 ASP N . 52379 1 708 . 1 . 1 151 151 THR H H 1 8.07 0 . 1 . . . . . 151 THR H . 52379 1 709 . 1 . 1 151 151 THR C C 13 175.4 0 . 1 . . . . . 151 THR C . 52379 1 710 . 1 . 1 151 151 THR CA C 13 62.38 0 . 1 . . . . . 151 THR CA . 52379 1 711 . 1 . 1 151 151 THR CB C 13 69.61 0 . 1 . . . . . 151 THR CB . 52379 1 712 . 1 . 1 151 151 THR N N 15 114.75 0 . 1 . . . . . 151 THR N . 52379 1 713 . 1 . 1 152 152 GLU H H 1 8.27 0 . 1 . . . . . 152 GLU H . 52379 1 714 . 1 . 1 152 152 GLU C C 13 176.78 0 . 1 . . . . . 152 GLU C . 52379 1 715 . 1 . 1 152 152 GLU CA C 13 56.53 0 . 1 . . . . . 152 GLU CA . 52379 1 716 . 1 . 1 152 152 GLU CB C 13 29.91 0 . 1 . . . . . 152 GLU CB . 52379 1 717 . 1 . 1 152 152 GLU N N 15 122.92 0 . 1 . . . . . 152 GLU N . 52379 1 718 . 1 . 1 153 153 ALA H H 1 8.12 0 . 1 . . . . . 153 ALA H . 52379 1 719 . 1 . 1 153 153 ALA C C 13 178.07 0 . 1 . . . . . 153 ALA C . 52379 1 720 . 1 . 1 153 153 ALA CA C 13 52.3 0 . 1 . . . . . 153 ALA CA . 52379 1 721 . 1 . 1 153 153 ALA CB C 13 18.87 0 . 1 . . . . . 153 ALA CB . 52379 1 722 . 1 . 1 153 153 ALA N N 15 125.12 0 . 1 . . . . . 153 ALA N . 52379 1 723 . 1 . 1 154 154 LYS H H 1 8.16 0 . 1 . . . . . 154 LYS H . 52379 1 724 . 1 . 1 154 154 LYS C C 13 176.56 0 . 1 . . . . . 154 LYS C . 52379 1 725 . 1 . 1 154 154 LYS CA C 13 55.74 0 . 1 . . . . . 154 LYS CA . 52379 1 726 . 1 . 1 154 154 LYS CB C 13 32.71 0 . 1 . . . . . 154 LYS CB . 52379 1 727 . 1 . 1 154 154 LYS N N 15 120.55 0 . 1 . . . . . 154 LYS N . 52379 1 728 . 1 . 1 155 155 ASN H H 1 8.42 0 . 1 . . . . . 155 ASN H . 52379 1 729 . 1 . 1 155 155 ASN C C 13 174.25 0 . 1 . . . . . 155 ASN C . 52379 1 730 . 1 . 1 155 155 ASN CA C 13 50.98 0 . 1 . . . . . 155 ASN CA . 52379 1 731 . 1 . 1 155 155 ASN CB C 13 38.67 0 . 1 . . . . . 155 ASN CB . 52379 1 732 . 1 . 1 155 155 ASN N N 15 121.1 0 . 1 . . . . . 155 ASN N . 52379 1 733 . 1 . 1 156 156 PRO C C 13 177.09 0 . 1 . . . . . 156 PRO C . 52379 1 734 . 1 . 1 156 156 PRO CA C 13 63.59 0 . 1 . . . . . 156 PRO CA . 52379 1 735 . 1 . 1 156 156 PRO CB C 13 31.85 0 . 1 . . . . . 156 PRO CB . 52379 1 736 . 1 . 1 156 156 PRO N N 15 136.86 0 . 1 . . . . . 156 PRO N . 52379 1 737 . 1 . 1 157 157 PHE H H 1 8.09 0 . 1 . . . . . 157 PHE H . 52379 1 738 . 1 . 1 157 157 PHE C C 13 176.27 0 . 1 . . . . . 157 PHE C . 52379 1 739 . 1 . 1 157 157 PHE CA C 13 57.58 0 . 1 . . . . . 157 PHE CA . 52379 1 740 . 1 . 1 157 157 PHE CB C 13 38.94 0 . 1 . . . . . 157 PHE CB . 52379 1 741 . 1 . 1 157 157 PHE N N 15 119.09 0 . 1 . . . . . 157 PHE N . 52379 1 742 . 1 . 1 158 158 SER H H 1 7.95 0 . 1 . . . . . 158 SER H . 52379 1 743 . 1 . 1 158 158 SER C C 13 175.04 0 . 1 . . . . . 158 SER C . 52379 1 744 . 1 . 1 158 158 SER CA C 13 57.95 0 . 1 . . . . . 158 SER CA . 52379 1 745 . 1 . 1 158 158 SER CB C 13 64 0 . 1 . . . . . 158 SER CB . 52379 1 746 . 1 . 1 158 158 SER N N 15 116.86 0 . 1 . . . . . 158 SER N . 52379 1 747 . 1 . 1 159 159 THR H H 1 8.19 0 . 1 . . . . . 159 THR H . 52379 1 748 . 1 . 1 159 159 THR C C 13 174.94 0 . 1 . . . . . 159 THR C . 52379 1 749 . 1 . 1 159 159 THR CA C 13 62.1 0 . 1 . . . . . 159 THR CA . 52379 1 750 . 1 . 1 159 159 THR CB C 13 69.7 0 . 1 . . . . . 159 THR CB . 52379 1 751 . 1 . 1 159 159 THR N N 15 116.04 0 . 1 . . . . . 159 THR N . 52379 1 752 . 1 . 1 160 160 GLN H H 1 8.31 0 . 1 . . . . . 160 GLN H . 52379 1 753 . 1 . 1 160 160 GLN C C 13 176.12 0 . 1 . . . . . 160 GLN C . 52379 1 754 . 1 . 1 160 160 GLN CA C 13 56.11 0 . 1 . . . . . 160 GLN CA . 52379 1 755 . 1 . 1 160 160 GLN CB C 13 29.74 0 . 1 . . . . . 160 GLN CB . 52379 1 756 . 1 . 1 160 160 GLN N N 15 122.1 0 . 1 . . . . . 160 GLN N . 52379 1 757 . 1 . 1 161 161 ASP H H 1 8.39 0 . 1 . . . . . 161 ASP H . 52379 1 758 . 1 . 1 161 161 ASP C C 13 176.89 0 . 1 . . . . . 161 ASP C . 52379 1 759 . 1 . 1 161 161 ASP CA C 13 54.55 0 . 1 . . . . . 161 ASP CA . 52379 1 760 . 1 . 1 161 161 ASP CB C 13 40.92 0 . 1 . . . . . 161 ASP CB . 52379 1 761 . 1 . 1 161 161 ASP N N 15 122.08 0 . 1 . . . . . 161 ASP N . 52379 1 762 . 1 . 1 162 162 THR H H 1 8.03 0 . 1 . . . . . 162 THR H . 52379 1 763 . 1 . 1 162 162 THR C C 13 174.79 0 . 1 . . . . . 162 THR C . 52379 1 764 . 1 . 1 162 162 THR CA C 13 62.03 0 . 1 . . . . . 162 THR CA . 52379 1 765 . 1 . 1 162 162 THR CB C 13 69.94 0 . 1 . . . . . 162 THR CB . 52379 1 766 . 1 . 1 162 162 THR N N 15 113.97 0 . 1 . . . . . 162 THR N . 52379 1 767 . 1 . 1 163 163 ASP H H 1 8.33 0 . 1 . . . . . 163 ASP H . 52379 1 768 . 1 . 1 163 163 ASP C C 13 176.74 0 . 1 . . . . . 163 ASP C . 52379 1 769 . 1 . 1 163 163 ASP CA C 13 54.73 0 . 1 . . . . . 163 ASP CA . 52379 1 770 . 1 . 1 163 163 ASP CB C 13 40.79 0 . 1 . . . . . 163 ASP CB . 52379 1 771 . 1 . 1 163 163 ASP N N 15 122.92 0 . 1 . . . . . 163 ASP N . 52379 1 772 . 1 . 1 164 164 LEU H H 1 8.03 0 . 1 . . . . . 164 LEU H . 52379 1 773 . 1 . 1 164 164 LEU C C 13 177.61 0 . 1 . . . . . 164 LEU C . 52379 1 774 . 1 . 1 164 164 LEU CA C 13 55.19 0 . 1 . . . . . 164 LEU CA . 52379 1 775 . 1 . 1 164 164 LEU CB C 13 42.08 0 . 1 . . . . . 164 LEU CB . 52379 1 776 . 1 . 1 164 164 LEU N N 15 122.48 0 . 1 . . . . . 164 LEU N . 52379 1 777 . 1 . 1 165 165 ASP H H 1 8.23 0 . 1 . . . . . 165 ASP H . 52379 1 778 . 1 . 1 165 165 ASP C C 13 177.02 0 . 1 . . . . . 165 ASP C . 52379 1 779 . 1 . 1 165 165 ASP CA C 13 54.51 0 . 1 . . . . . 165 ASP CA . 52379 1 780 . 1 . 1 165 165 ASP CB C 13 40.8 0 . 1 . . . . . 165 ASP CB . 52379 1 781 . 1 . 1 165 165 ASP N N 15 121.14 0 . 1 . . . . . 165 ASP N . 52379 1 782 . 1 . 1 166 166 LEU H H 1 8.02 0 . 1 . . . . . 166 LEU H . 52379 1 783 . 1 . 1 166 166 LEU C C 13 178.46 0 . 1 . . . . . 166 LEU C . 52379 1 784 . 1 . 1 166 166 LEU CA C 13 55.19 0 . 1 . . . . . 166 LEU CA . 52379 1 785 . 1 . 1 166 166 LEU CB C 13 42.08 0 . 1 . . . . . 166 LEU CB . 52379 1 786 . 1 . 1 166 166 LEU N N 15 122.47 0 . 1 . . . . . 166 LEU N . 52379 1 787 . 1 . 1 167 167 GLU H H 1 8.26 0 . 1 . . . . . 167 GLU H . 52379 1 788 . 1 . 1 167 167 GLU C C 13 177.15 0 . 1 . . . . . 167 GLU C . 52379 1 789 . 1 . 1 167 167 GLU CA C 13 56.8 0 . 1 . . . . . 167 GLU CA . 52379 1 790 . 1 . 1 167 167 GLU CB C 13 29.45 0 . 1 . . . . . 167 GLU CB . 52379 1 791 . 1 . 1 167 167 GLU N N 15 120.6 0 . 1 . . . . . 167 GLU N . 52379 1 792 . 1 . 1 168 168 MET H H 1 8.07 0 . 1 . . . . . 168 MET H . 52379 1 793 . 1 . 1 168 168 MET C C 13 176.5 0 . 1 . . . . . 168 MET C . 52379 1 794 . 1 . 1 168 168 MET CA C 13 55.32 0 . 1 . . . . . 168 MET CA . 52379 1 795 . 1 . 1 168 168 MET CB C 13 32.54 0 . 1 . . . . . 168 MET CB . 52379 1 796 . 1 . 1 168 168 MET N N 15 120.47 0 . 1 . . . . . 168 MET N . 52379 1 797 . 1 . 1 169 169 LEU H H 1 8.03 0 . 1 . . . . . 169 LEU H . 52379 1 798 . 1 . 1 169 169 LEU C C 13 177.17 0 . 1 . . . . . 169 LEU C . 52379 1 799 . 1 . 1 169 169 LEU CA C 13 54.81 0 . 1 . . . . . 169 LEU CA . 52379 1 800 . 1 . 1 169 169 LEU CB C 13 42.32 0 . 1 . . . . . 169 LEU CB . 52379 1 801 . 1 . 1 169 169 LEU N N 15 123.17 0 . 1 . . . . . 169 LEU N . 52379 1 802 . 1 . 1 170 170 ALA H H 1 8.14 0 . 1 . . . . . 170 ALA H . 52379 1 803 . 1 . 1 170 170 ALA C C 13 175.71 0 . 1 . . . . . 170 ALA C . 52379 1 804 . 1 . 1 170 170 ALA CA C 13 50.38 0 . 1 . . . . . 170 ALA CA . 52379 1 805 . 1 . 1 170 170 ALA CB C 13 18 0 . 1 . . . . . 170 ALA CB . 52379 1 806 . 1 . 1 170 170 ALA N N 15 126.31 0 . 1 . . . . . 170 ALA N . 52379 1 807 . 1 . 1 171 171 PRO C C 13 176.75 0 . 1 . . . . . 171 PRO C . 52379 1 808 . 1 . 1 171 171 PRO CA C 13 63 0 . 1 . . . . . 171 PRO CA . 52379 1 809 . 1 . 1 171 171 PRO CB C 13 32 0 . 1 . . . . . 171 PRO CB . 52379 1 810 . 1 . 1 171 171 PRO N N 15 135.29 0 . 1 . . . . . 171 PRO N . 52379 1 811 . 1 . 1 172 172 TYR H H 1 8.24 0 . 1 . . . . . 172 TYR H . 52379 1 812 . 1 . 1 172 172 TYR C C 13 175.32 0 . 1 . . . . . 172 TYR C . 52379 1 813 . 1 . 1 172 172 TYR CA C 13 57.74 0 . 1 . . . . . 172 TYR CA . 52379 1 814 . 1 . 1 172 172 TYR CB C 13 38.56 0 . 1 . . . . . 172 TYR CB . 52379 1 815 . 1 . 1 172 172 TYR N N 15 121.51 0 . 1 . . . . . 172 TYR N . 52379 1 816 . 1 . 1 173 173 ILE H H 1 7.87 0 . 1 . . . . . 173 ILE H . 52379 1 817 . 1 . 1 173 173 ILE C C 13 173.72 0 . 1 . . . . . 173 ILE C . 52379 1 818 . 1 . 1 173 173 ILE CA C 13 57.72 0 . 1 . . . . . 173 ILE CA . 52379 1 819 . 1 . 1 173 173 ILE CB C 13 38.79 0 . 1 . . . . . 173 ILE CB . 52379 1 820 . 1 . 1 173 173 ILE N N 15 128.25 0 . 1 . . . . . 173 ILE N . 52379 1 821 . 1 . 1 174 174 PRO C C 13 177.16 0 . 1 . . . . . 174 PRO C . 52379 1 822 . 1 . 1 174 174 PRO CA C 13 62.83 0 . 1 . . . . . 174 PRO CA . 52379 1 823 . 1 . 1 174 174 PRO CB C 13 32.06 0 . 1 . . . . . 174 PRO CB . 52379 1 824 . 1 . 1 174 174 PRO N N 15 138.49 0 . 1 . . . . . 174 PRO N . 52379 1 825 . 1 . 1 175 175 MET H H 1 8.33 0 . 1 . . . . . 175 MET H . 52379 1 826 . 1 . 1 175 175 MET C C 13 176.45 0 . 1 . . . . . 175 MET C . 52379 1 827 . 1 . 1 175 175 MET CA C 13 55.25 0 . 1 . . . . . 175 MET CA . 52379 1 828 . 1 . 1 175 175 MET CB C 13 33.04 0 . 1 . . . . . 175 MET CB . 52379 1 829 . 1 . 1 175 175 MET N N 15 120.99 0 . 1 . . . . . 175 MET N . 52379 1 830 . 1 . 1 176 176 ASP H H 1 8.29 0 . 1 . . . . . 176 ASP H . 52379 1 831 . 1 . 1 176 176 ASP C C 13 175.64 0 . 1 . . . . . 176 ASP C . 52379 1 832 . 1 . 1 176 176 ASP CA C 13 54.51 0 . 1 . . . . . 176 ASP CA . 52379 1 833 . 1 . 1 176 176 ASP CB C 13 41.34 0 . 1 . . . . . 176 ASP CB . 52379 1 834 . 1 . 1 176 176 ASP N N 15 121.74 0 . 1 . . . . . 176 ASP N . 52379 1 835 . 1 . 1 177 177 ASP H H 1 8.28 0 . 1 . . . . . 177 ASP H . 52379 1 836 . 1 . 1 177 177 ASP C C 13 176.56 0 . 1 . . . . . 177 ASP C . 52379 1 837 . 1 . 1 177 177 ASP CA C 13 54.51 0 . 1 . . . . . 177 ASP CA . 52379 1 838 . 1 . 1 177 177 ASP CB C 13 41 0 . 1 . . . . . 177 ASP CB . 52379 1 839 . 1 . 1 177 177 ASP N N 15 121.63 0 . 1 . . . . . 177 ASP N . 52379 1 840 . 1 . 1 178 178 ASP H H 1 8.18 0 . 1 . . . . . 178 ASP H . 52379 1 841 . 1 . 1 178 178 ASP C C 13 176.77 0 . 1 . . . . . 178 ASP C . 52379 1 842 . 1 . 1 178 178 ASP CA C 13 54.5 0 . 1 . . . . . 178 ASP CA . 52379 1 843 . 1 . 1 178 178 ASP CB C 13 40.75 0 . 1 . . . . . 178 ASP CB . 52379 1 844 . 1 . 1 178 178 ASP N N 15 120.27 0 . 1 . . . . . 178 ASP N . 52379 1 845 . 1 . 1 179 179 PHE H H 1 8.04 0 . 1 . . . . . 179 PHE H . 52379 1 846 . 1 . 1 179 179 PHE C C 13 176.17 0 . 1 . . . . . 179 PHE C . 52379 1 847 . 1 . 1 179 179 PHE CA C 13 58.3 0 . 1 . . . . . 179 PHE CA . 52379 1 848 . 1 . 1 179 179 PHE CB C 13 38.99 0 . 1 . . . . . 179 PHE CB . 52379 1 849 . 1 . 1 179 179 PHE N N 15 120.62 0 . 1 . . . . . 179 PHE N . 52379 1 850 . 1 . 1 180 180 GLN H H 1 8.04 0 . 1 . . . . . 180 GLN H . 52379 1 851 . 1 . 1 180 180 GLN C C 13 175.86 0 . 1 . . . . . 180 GLN C . 52379 1 852 . 1 . 1 180 180 GLN CA C 13 55.47 0 . 1 . . . . . 180 GLN CA . 52379 1 853 . 1 . 1 180 180 GLN CB C 13 29.24 0 . 1 . . . . . 180 GLN CB . 52379 1 854 . 1 . 1 180 180 GLN N N 15 121.19 0 . 1 . . . . . 180 GLN N . 52379 1 855 . 1 . 1 181 181 LEU H H 1 8.1 0 . 1 . . . . . 181 LEU H . 52379 1 856 . 1 . 1 181 181 LEU C C 13 177.52 0 . 1 . . . . . 181 LEU C . 52379 1 857 . 1 . 1 181 181 LEU CA C 13 55.29 0 . 1 . . . . . 181 LEU CA . 52379 1 858 . 1 . 1 181 181 LEU CB C 13 42.13 0 . 1 . . . . . 181 LEU CB . 52379 1 859 . 1 . 1 181 181 LEU N N 15 123.02 0 . 1 . . . . . 181 LEU N . 52379 1 stop_ save_