data_52475 ####################### # Entry information # ####################### save_entry_information_1 _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information_1 _Entry.ID 52475 _Entry.Title ; Solution NMR backbone assignment of SorcinFL ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2024-05-21 _Entry.Accession_date 2024-05-21 _Entry.Last_release_date 2024-05-21 _Entry.Original_release_date 2024-05-21 _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 . _Entry.Generated_software_label . _Entry.Generated_date . _Entry.DOI . _Entry.UUID . _Entry.Related_coordinate_file_name . _Entry.Details 'backbone residue assignment of SorcinFL' _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 'Kathleen Joyce' Carillo . D. . 0009-0006-1632-5709 52475 2 Qiushi Ye . . . 0000-0002-5569-1545 52475 3 Nicolas Delaeter . . . 0009-0002-8550-5106 52475 4 Yanan He . . . 0000-0002-1428-1507 52475 5 Yihong Chen . . . 0000-0002-9763-7379 52475 6 John Orban . P. . 0000-0002-3895-1800 52475 7 Yanxin Liu . . . 0000-0002-2253-3698 52475 stop_ loop_ _Entry_src.ID _Entry_src.Project_name _Entry_src.Organization_full_name _Entry_src.Organization_initials _Entry_src.Entry_ID 1 . 'Department of Chemistry and Biochemistry, University of Maryland, College Park, MD 20740, USA' . 52475 2 . 'Institute for Bioscience and Biotechnology Research, University of Maryland, Rockville, MD 20850, USA' . 52475 3 . "School of Physics, Xi'an Jiaotong University, Xi'an, Shaanxi, 710049, China" . 52475 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 52475 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 532 52475 '15N chemical shifts' 185 52475 '1H chemical shifts' 185 52475 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 . . 2024-10-31 2024-05-21 update BMRB 'update entry citation' 52475 1 . . 2024-09-09 2024-05-21 original author 'original release' 52475 stop_ save_ ############### # Citations # ############### save_citations_1 _Citation.Sf_category citations _Citation.Sf_framecode citations_1 _Citation.Entry_ID 52475 _Citation.ID 1 _Citation.Name . _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.PubMed_ID 39215797 _Citation.DOI . _Citation.Full_citation . _Citation.Title ; Solution NMR backbone resonance assignment of the full-length resistance-related calcium-binding protein Sorcin ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Biomol. NMR Assign.' _Citation.Journal_name_full . _Citation.Journal_volume 18 _Citation.Journal_issue 2 _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first 253 _Citation.Page_last 256 _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 'Kathleen Joyce' Carillo . D. . . 52475 1 2 Qiushi Ye . . . . 52475 1 3 Nicolas Delaeter . . . . 52475 1 4 Yanan He . . . . 52475 1 5 Yihong Chen . . . . 52475 1 6 John Orban . P. . . 52475 1 7 Yanxin Liu . . . . 52475 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID SorcinFL 52475 1 'backbone resonance assignment' 52475 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly_1 _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly_1 _Assembly.Entry_ID 52475 _Assembly.ID 1 _Assembly.Name SorcinFL _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 22000 _Assembly.Enzyme_commission_number . _Assembly.Details 'A penta-EF hand protein that naturally exists as a homodimer.' _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 SorcinFL 1 $entity_1 . . yes native no no . . . 52475 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 52475 _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 ; GIDPFTAYPGHPGAGGGYYP GGYGGAPGGPAFPGQTQDPL YGYFAAVAGQDGQIDADELQ RCLTQSGIAGGYKPFNLETC RLMVSMLDRDMSGTMGFNEF KELWAVLNGWRQHFISFDTD RSGTVDPQELQKALTTMGFR LSPQAVNSIAKRYSTNGKIT FDDYIACCVKLRALTDSFRR RDTAQQGVVNFPYDDFIQCV MSV ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 203 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method . _Entity.Parent_entity_ID 1 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details ; SorcinFL is a full-length calcium binding protein. The first 5 residues are not part of the actual Sorcin protein sequence but instead are part of the linker used in the protein construct. ; _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 P30626 . SORCN_HUMAN . . . . . . . . . . . . . . 52475 1 stop_ loop_ _Entity_biological_function.Biological_function _Entity_biological_function.Entry_ID _Entity_biological_function.Entity_ID ; A a penta-EF hand calcium-binding protein that confers multidrug resistance in cancer cells and regulates cellular Ca2+ homeostasis by interacting with calcium channels in the endoplasmic reticulum. ; 52475 1 stop_ loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 . GLY . 52475 1 2 . ILE . 52475 1 3 . ASP . 52475 1 4 . PRO . 52475 1 5 . PHE . 52475 1 6 . THR . 52475 1 7 . ALA . 52475 1 8 . TYR . 52475 1 9 . PRO . 52475 1 10 . GLY . 52475 1 11 . HIS . 52475 1 12 . PRO . 52475 1 13 . GLY . 52475 1 14 . ALA . 52475 1 15 . GLY . 52475 1 16 . GLY . 52475 1 17 . GLY . 52475 1 18 . TYR . 52475 1 19 . TYR . 52475 1 20 . PRO . 52475 1 21 . GLY . 52475 1 22 . GLY . 52475 1 23 . TYR . 52475 1 24 . GLY . 52475 1 25 . GLY . 52475 1 26 . ALA . 52475 1 27 . PRO . 52475 1 28 . GLY . 52475 1 29 . GLY . 52475 1 30 . PRO . 52475 1 31 . ALA . 52475 1 32 . PHE . 52475 1 33 . PRO . 52475 1 34 . GLY . 52475 1 35 . GLN . 52475 1 36 . THR . 52475 1 37 . GLN . 52475 1 38 . ASP . 52475 1 39 . PRO . 52475 1 40 . LEU . 52475 1 41 . TYR . 52475 1 42 . GLY . 52475 1 43 . TYR . 52475 1 44 . PHE . 52475 1 45 . ALA . 52475 1 46 . ALA . 52475 1 47 . VAL . 52475 1 48 . ALA . 52475 1 49 . GLY . 52475 1 50 . GLN . 52475 1 51 . ASP . 52475 1 52 . GLY . 52475 1 53 . GLN . 52475 1 54 . ILE . 52475 1 55 . ASP . 52475 1 56 . ALA . 52475 1 57 . ASP . 52475 1 58 . GLU . 52475 1 59 . LEU . 52475 1 60 . GLN . 52475 1 61 . ARG . 52475 1 62 . CYS . 52475 1 63 . LEU . 52475 1 64 . THR . 52475 1 65 . GLN . 52475 1 66 . SER . 52475 1 67 . GLY . 52475 1 68 . ILE . 52475 1 69 . ALA . 52475 1 70 . GLY . 52475 1 71 . GLY . 52475 1 72 . TYR . 52475 1 73 . LYS . 52475 1 74 . PRO . 52475 1 75 . PHE . 52475 1 76 . ASN . 52475 1 77 . LEU . 52475 1 78 . GLU . 52475 1 79 . THR . 52475 1 80 . CYS . 52475 1 81 . ARG . 52475 1 82 . LEU . 52475 1 83 . MET . 52475 1 84 . VAL . 52475 1 85 . SER . 52475 1 86 . MET . 52475 1 87 . LEU . 52475 1 88 . ASP . 52475 1 89 . ARG . 52475 1 90 . ASP . 52475 1 91 . MET . 52475 1 92 . SER . 52475 1 93 . GLY . 52475 1 94 . THR . 52475 1 95 . MET . 52475 1 96 . GLY . 52475 1 97 . PHE . 52475 1 98 . ASN . 52475 1 99 . GLU . 52475 1 100 . PHE . 52475 1 101 . LYS . 52475 1 102 . GLU . 52475 1 103 . LEU . 52475 1 104 . TRP . 52475 1 105 . ALA . 52475 1 106 . VAL . 52475 1 107 . LEU . 52475 1 108 . ASN . 52475 1 109 . GLY . 52475 1 110 . TRP . 52475 1 111 . ARG . 52475 1 112 . GLN . 52475 1 113 . HIS . 52475 1 114 . PHE . 52475 1 115 . ILE . 52475 1 116 . SER . 52475 1 117 . PHE . 52475 1 118 . ASP . 52475 1 119 . THR . 52475 1 120 . ASP . 52475 1 121 . ARG . 52475 1 122 . SER . 52475 1 123 . GLY . 52475 1 124 . THR . 52475 1 125 . VAL . 52475 1 126 . ASP . 52475 1 127 . PRO . 52475 1 128 . GLN . 52475 1 129 . GLU . 52475 1 130 . LEU . 52475 1 131 . GLN . 52475 1 132 . LYS . 52475 1 133 . ALA . 52475 1 134 . LEU . 52475 1 135 . THR . 52475 1 136 . THR . 52475 1 137 . MET . 52475 1 138 . GLY . 52475 1 139 . PHE . 52475 1 140 . ARG . 52475 1 141 . LEU . 52475 1 142 . SER . 52475 1 143 . PRO . 52475 1 144 . GLN . 52475 1 145 . ALA . 52475 1 146 . VAL . 52475 1 147 . ASN . 52475 1 148 . SER . 52475 1 149 . ILE . 52475 1 150 . ALA . 52475 1 151 . LYS . 52475 1 152 . ARG . 52475 1 153 . TYR . 52475 1 154 . SER . 52475 1 155 . THR . 52475 1 156 . ASN . 52475 1 157 . GLY . 52475 1 158 . LYS . 52475 1 159 . ILE . 52475 1 160 . THR . 52475 1 161 . PHE . 52475 1 162 . ASP . 52475 1 163 . ASP . 52475 1 164 . TYR . 52475 1 165 . ILE . 52475 1 166 . ALA . 52475 1 167 . CYS . 52475 1 168 . CYS . 52475 1 169 . VAL . 52475 1 170 . LYS . 52475 1 171 . LEU . 52475 1 172 . ARG . 52475 1 173 . ALA . 52475 1 174 . LEU . 52475 1 175 . THR . 52475 1 176 . ASP . 52475 1 177 . SER . 52475 1 178 . PHE . 52475 1 179 . ARG . 52475 1 180 . ARG . 52475 1 181 . ARG . 52475 1 182 . ASP . 52475 1 183 . THR . 52475 1 184 . ALA . 52475 1 185 . GLN . 52475 1 186 . GLN . 52475 1 187 . GLY . 52475 1 188 . VAL . 52475 1 189 . VAL . 52475 1 190 . ASN . 52475 1 191 . PHE . 52475 1 192 . PRO . 52475 1 193 . TYR . 52475 1 194 . ASP . 52475 1 195 . ASP . 52475 1 196 . PHE . 52475 1 197 . ILE . 52475 1 198 . GLN . 52475 1 199 . CYS . 52475 1 200 . VAL . 52475 1 201 . MET . 52475 1 202 . SER . 52475 1 203 . VAL . 52475 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . GLY 1 1 52475 1 . ILE 2 2 52475 1 . ASP 3 3 52475 1 . PRO 4 4 52475 1 . PHE 5 5 52475 1 . THR 6 6 52475 1 . ALA 7 7 52475 1 . TYR 8 8 52475 1 . PRO 9 9 52475 1 . GLY 10 10 52475 1 . HIS 11 11 52475 1 . PRO 12 12 52475 1 . GLY 13 13 52475 1 . ALA 14 14 52475 1 . GLY 15 15 52475 1 . GLY 16 16 52475 1 . GLY 17 17 52475 1 . TYR 18 18 52475 1 . TYR 19 19 52475 1 . PRO 20 20 52475 1 . GLY 21 21 52475 1 . GLY 22 22 52475 1 . TYR 23 23 52475 1 . GLY 24 24 52475 1 . GLY 25 25 52475 1 . ALA 26 26 52475 1 . PRO 27 27 52475 1 . GLY 28 28 52475 1 . GLY 29 29 52475 1 . PRO 30 30 52475 1 . ALA 31 31 52475 1 . PHE 32 32 52475 1 . PRO 33 33 52475 1 . GLY 34 34 52475 1 . GLN 35 35 52475 1 . THR 36 36 52475 1 . GLN 37 37 52475 1 . ASP 38 38 52475 1 . PRO 39 39 52475 1 . LEU 40 40 52475 1 . TYR 41 41 52475 1 . GLY 42 42 52475 1 . TYR 43 43 52475 1 . PHE 44 44 52475 1 . ALA 45 45 52475 1 . ALA 46 46 52475 1 . VAL 47 47 52475 1 . ALA 48 48 52475 1 . GLY 49 49 52475 1 . GLN 50 50 52475 1 . ASP 51 51 52475 1 . GLY 52 52 52475 1 . GLN 53 53 52475 1 . ILE 54 54 52475 1 . ASP 55 55 52475 1 . ALA 56 56 52475 1 . ASP 57 57 52475 1 . GLU 58 58 52475 1 . LEU 59 59 52475 1 . GLN 60 60 52475 1 . ARG 61 61 52475 1 . CYS 62 62 52475 1 . LEU 63 63 52475 1 . THR 64 64 52475 1 . GLN 65 65 52475 1 . SER 66 66 52475 1 . GLY 67 67 52475 1 . ILE 68 68 52475 1 . ALA 69 69 52475 1 . GLY 70 70 52475 1 . GLY 71 71 52475 1 . TYR 72 72 52475 1 . LYS 73 73 52475 1 . PRO 74 74 52475 1 . PHE 75 75 52475 1 . ASN 76 76 52475 1 . LEU 77 77 52475 1 . GLU 78 78 52475 1 . THR 79 79 52475 1 . CYS 80 80 52475 1 . ARG 81 81 52475 1 . LEU 82 82 52475 1 . MET 83 83 52475 1 . VAL 84 84 52475 1 . SER 85 85 52475 1 . MET 86 86 52475 1 . LEU 87 87 52475 1 . ASP 88 88 52475 1 . ARG 89 89 52475 1 . ASP 90 90 52475 1 . MET 91 91 52475 1 . SER 92 92 52475 1 . GLY 93 93 52475 1 . THR 94 94 52475 1 . MET 95 95 52475 1 . GLY 96 96 52475 1 . PHE 97 97 52475 1 . ASN 98 98 52475 1 . GLU 99 99 52475 1 . PHE 100 100 52475 1 . LYS 101 101 52475 1 . GLU 102 102 52475 1 . LEU 103 103 52475 1 . TRP 104 104 52475 1 . ALA 105 105 52475 1 . VAL 106 106 52475 1 . LEU 107 107 52475 1 . ASN 108 108 52475 1 . GLY 109 109 52475 1 . TRP 110 110 52475 1 . ARG 111 111 52475 1 . GLN 112 112 52475 1 . HIS 113 113 52475 1 . PHE 114 114 52475 1 . ILE 115 115 52475 1 . SER 116 116 52475 1 . PHE 117 117 52475 1 . ASP 118 118 52475 1 . THR 119 119 52475 1 . ASP 120 120 52475 1 . ARG 121 121 52475 1 . SER 122 122 52475 1 . GLY 123 123 52475 1 . THR 124 124 52475 1 . VAL 125 125 52475 1 . ASP 126 126 52475 1 . PRO 127 127 52475 1 . GLN 128 128 52475 1 . GLU 129 129 52475 1 . LEU 130 130 52475 1 . GLN 131 131 52475 1 . LYS 132 132 52475 1 . ALA 133 133 52475 1 . LEU 134 134 52475 1 . THR 135 135 52475 1 . THR 136 136 52475 1 . MET 137 137 52475 1 . GLY 138 138 52475 1 . PHE 139 139 52475 1 . ARG 140 140 52475 1 . LEU 141 141 52475 1 . SER 142 142 52475 1 . PRO 143 143 52475 1 . GLN 144 144 52475 1 . ALA 145 145 52475 1 . VAL 146 146 52475 1 . ASN 147 147 52475 1 . SER 148 148 52475 1 . ILE 149 149 52475 1 . ALA 150 150 52475 1 . LYS 151 151 52475 1 . ARG 152 152 52475 1 . TYR 153 153 52475 1 . SER 154 154 52475 1 . THR 155 155 52475 1 . ASN 156 156 52475 1 . GLY 157 157 52475 1 . LYS 158 158 52475 1 . ILE 159 159 52475 1 . THR 160 160 52475 1 . PHE 161 161 52475 1 . ASP 162 162 52475 1 . ASP 163 163 52475 1 . TYR 164 164 52475 1 . ILE 165 165 52475 1 . ALA 166 166 52475 1 . CYS 167 167 52475 1 . CYS 168 168 52475 1 . VAL 169 169 52475 1 . LYS 170 170 52475 1 . LEU 171 171 52475 1 . ARG 172 172 52475 1 . ALA 173 173 52475 1 . LEU 174 174 52475 1 . THR 175 175 52475 1 . ASP 176 176 52475 1 . SER 177 177 52475 1 . PHE 178 178 52475 1 . ARG 179 179 52475 1 . ARG 180 180 52475 1 . ARG 181 181 52475 1 . ASP 182 182 52475 1 . THR 183 183 52475 1 . ALA 184 184 52475 1 . GLN 185 185 52475 1 . GLN 186 186 52475 1 . GLY 187 187 52475 1 . VAL 188 188 52475 1 . VAL 189 189 52475 1 . ASN 190 190 52475 1 . PHE 191 191 52475 1 . PRO 192 192 52475 1 . TYR 193 193 52475 1 . ASP 194 194 52475 1 . ASP 195 195 52475 1 . PHE 196 196 52475 1 . ILE 197 197 52475 1 . GLN 198 198 52475 1 . CYS 199 199 52475 1 . VAL 200 200 52475 1 . MET 201 201 52475 1 . SER 202 202 52475 1 . VAL 203 203 52475 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 52475 _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 . 9606 organism . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . 52475 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 52475 _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 Rosetta(DE3) . . plasmid . . pET151D-TOPO . . . 52475 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 52475 _Sample.ID 1 _Sample.Name SorcinFL _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number 1 _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 SorcinFL '[U-13C; U-15N; U-2H]' . . 1 $entity_1 . . 0.44 . . mM . . . . 52475 1 2 D2O '[U-100% 2H]' . . . . . . 10 . . % . . . . 52475 1 3 H2O 'natural abundance' . . . . . . 90 . . % . . . . 52475 1 4 'potassium chloride' 'natural abundance' . . . . . . 150 . . mM . . . . 52475 1 5 HEPES 'natural abundance' . . . . . . 40 . . mM . . . . 52475 1 6 TCEP 'natural abundance' . . . . . . 0.5 . . mM . . . . 52475 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 52475 _Sample_condition_list.ID 1 _Sample_condition_list.Name 'High temp and neutral pH 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' 0.15 . M 52475 1 pH 7.5 . pH 52475 1 pressure 1 . atm 52475 1 temperature 310 . K 52475 1 stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID 52475 _Software.ID 1 _Software.Type . _Software.Name CARA _Software.Version 1.9.1.7 _Software.DOI . _Software.Details . loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' . 52475 1 stop_ save_ save_software_2 _Software.Sf_category software _Software.Sf_framecode software_2 _Software.Entry_ID 52475 _Software.ID 2 _Software.Type . _Software.Name TOPSPIN _Software.Version 3.6 _Software.DOI . _Software.Details . loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID collection . 52475 2 stop_ save_ save_software_3 _Software.Sf_category software _Software.Sf_framecode software_3 _Software.Entry_ID 52475 _Software.ID 3 _Software.Type . _Software.Name NMRFAM-SPARKY _Software.Version 3.115 _Software.DOI . _Software.Details . loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID processing . 52475 3 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 52475 _NMR_spectrometer.ID 1 _NMR_spectrometer.Name 'Bruker AVANCE III 600 MHz' _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model 'AVANCE III' _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 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 52475 _Experiment_list.ID 1 _Experiment_list.Details . 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 TROSY' yes no no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 52475 1 2 '3D CBCA(CO)NH' yes no no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 52475 1 3 '3D HNCACB' yes no no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 52475 1 4 '3D HNCO' yes no no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 52475 1 5 '3D HNCACO' yes no no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 52475 1 stop_ loop_ _Experiment_file.Experiment_ID _Experiment_file.Experiment_name _Experiment_file.Name _Experiment_file.Type _Experiment_file.Content _Experiment_file.Directory_path _Experiment_file.Details _Experiment_file.Entry_ID _Experiment_file.Experiment_list_ID 1 '2D 1H-15N TROSY' sorcin_FL_trhsqc_37C.ucsf . 'Time-domain (raw spectral data)' . . 52475 1 2 '3D CBCA(CO)NH' sorcin_FL_trhncocacb_37C.ucsf . 'Time-domain (raw spectral data)' . . 52475 1 3 '3D HNCACB' sorcin_FL_trhncacb_37C.ucsf . 'Time-domain (raw spectral data)' . . 52475 1 4 '3D HNCO' sorcin_FL_trhnco.ucsf . 'Time-domain (raw spectral data)' . . 52475 1 5 '3D HNCACO' sorcin_FL_trhncaco_37C.ucsf . 'Time-domain (raw spectral data)' . . 52475 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 52475 _Chem_shift_reference.ID 1 _Chem_shift_reference.Name 'IUPAC 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 carbons' . . . . ppm 0 internal direct 1 . . . . . 52475 1 H 1 DSS 'methyl protons' . . . . ppm 0 internal direct 1 . . . . . 52475 1 N 15 DSS nitrogen . . . . ppm 0 internal direct 1 . . . . . 52475 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 52475 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name SorcinFL _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 2 '3D CBCA(CO)NH' . . . 52475 1 3 '3D HNCACB' . . . 52475 1 4 '3D HNCO' . . . 52475 1 5 '3D HNCACO' . . . 52475 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 . . 52475 1 2 $software_2 . . 52475 1 3 $software_3 . . 52475 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 2 2 ILE H H 1 7.942 0.020 . 1 . . . . . 2 ILE H . 52475 1 2 . 1 . 1 2 2 ILE C C 13 176.204 0.3 . 1 . . . . . 2 ILE C . 52475 1 3 . 1 . 1 2 2 ILE CA C 13 57.635 0.3 . 1 . . . . . 2 ILE CA . 52475 1 4 . 1 . 1 2 2 ILE CB C 13 37.973 0.3 . 1 . . . . . 2 ILE CB . 52475 1 5 . 1 . 1 2 2 ILE N N 15 120.691 0.3 . 1 . . . . . 2 ILE N . 52475 1 6 . 1 . 1 3 3 ASP H H 1 8.269 0.020 . 1 . . . . . 3 ASP H . 52475 1 7 . 1 . 1 3 3 ASP C C 13 174.780 0.3 . 1 . . . . . 3 ASP C . 52475 1 8 . 1 . 1 3 3 ASP CA C 13 51.496 0.3 . 1 . . . . . 3 ASP CA . 52475 1 9 . 1 . 1 3 3 ASP CB C 13 40.731 0.3 . 1 . . . . . 3 ASP CB . 52475 1 10 . 1 . 1 3 3 ASP N N 15 126.506 0.3 . 1 . . . . . 3 ASP N . 52475 1 11 . 1 . 1 5 5 PHE H H 1 8.084 0.020 . 1 . . . . . 5 PHE H . 52475 1 12 . 1 . 1 5 5 PHE C C 13 175.900 0.3 . 1 . . . . . 5 PHE C . 52475 1 13 . 1 . 1 5 5 PHE CA C 13 57.724 0.3 . 1 . . . . . 5 PHE CA . 52475 1 14 . 1 . 1 5 5 PHE CB C 13 37.884 0.3 . 1 . . . . . 5 PHE CB . 52475 1 15 . 1 . 1 5 5 PHE N N 15 118.881 0.3 . 1 . . . . . 5 PHE N . 52475 1 16 . 1 . 1 6 6 THR H H 1 7.592 0.020 . 1 . . . . . 6 THR H . 52475 1 17 . 1 . 1 6 6 THR C C 13 173.546 0.3 . 1 . . . . . 6 THR C . 52475 1 18 . 1 . 1 6 6 THR CA C 13 61.282 0.3 . 1 . . . . . 6 THR CA . 52475 1 19 . 1 . 1 6 6 THR CB C 13 68.933 0.3 . 1 . . . . . 6 THR CB . 52475 1 20 . 1 . 1 6 6 THR N N 15 115.371 0.3 . 1 . . . . . 6 THR N . 52475 1 21 . 1 . 1 7 7 ALA H H 1 7.812 0.020 . 1 . . . . . 7 ALA H . 52475 1 22 . 1 . 1 7 7 ALA C C 13 176.507 0.3 . 1 . . . . . 7 ALA C . 52475 1 23 . 1 . 1 7 7 ALA CA C 13 51.763 0.3 . 1 . . . . . 7 ALA CA . 52475 1 24 . 1 . 1 7 7 ALA CB C 13 18.490 0.3 . 1 . . . . . 7 ALA CB . 52475 1 25 . 1 . 1 7 7 ALA N N 15 126.319 0.3 . 1 . . . . . 7 ALA N . 52475 1 26 . 1 . 1 8 8 TYR H H 1 7.824 0.020 . 1 . . . . . 8 TYR H . 52475 1 27 . 1 . 1 8 8 TYR C C 13 173.906 0.3 . 1 . . . . . 8 TYR C . 52475 1 28 . 1 . 1 8 8 TYR CA C 13 54.788 0.3 . 1 . . . . . 8 TYR CA . 52475 1 29 . 1 . 1 8 8 TYR CB C 13 37.262 0.3 . 1 . . . . . 8 TYR CB . 52475 1 30 . 1 . 1 8 8 TYR N N 15 120.440 0.3 . 1 . . . . . 8 TYR N . 52475 1 31 . 1 . 1 10 10 GLY H H 1 7.898 0.020 . 1 . . . . . 10 GLY H . 52475 1 32 . 1 . 1 10 10 GLY C C 13 174.248 0.3 . 1 . . . . . 10 GLY C . 52475 1 33 . 1 . 1 10 10 GLY CA C 13 44.290 0.3 . 1 . . . . . 10 GLY CA . 52475 1 34 . 1 . 1 10 10 GLY N N 15 109.185 0.3 . 1 . . . . . 10 GLY N . 52475 1 35 . 1 . 1 11 11 HIS H H 1 7.893 0.020 . 1 . . . . . 11 HIS H . 52475 1 36 . 1 . 1 11 11 HIS C C 13 174.286 0.3 . 1 . . . . . 11 HIS C . 52475 1 37 . 1 . 1 11 11 HIS CA C 13 54.877 0.3 . 1 . . . . . 11 HIS CA . 52475 1 38 . 1 . 1 11 11 HIS CB C 13 29.700 0.3 . 1 . . . . . 11 HIS CB . 52475 1 39 . 1 . 1 11 11 HIS N N 15 121.272 0.3 . 1 . . . . . 11 HIS N . 52475 1 40 . 1 . 1 13 13 GLY H H 1 8.249 0.020 . 1 . . . . . 13 GLY H . 52475 1 41 . 1 . 1 13 13 GLY C C 13 172.786 0.3 . 1 . . . . . 13 GLY C . 52475 1 42 . 1 . 1 13 13 GLY CA C 13 44.379 0.3 . 1 . . . . . 13 GLY CA . 52475 1 43 . 1 . 1 13 13 GLY N N 15 111.283 0.3 . 1 . . . . . 13 GLY N . 52475 1 44 . 1 . 1 14 14 ALA H H 1 7.888 0.020 . 1 . . . . . 14 ALA H . 52475 1 45 . 1 . 1 14 14 ALA C C 13 175.556 0.3 . 1 . . . . . 14 ALA C . 52475 1 46 . 1 . 1 14 14 ALA CA C 13 49.539 0.3 . 1 . . . . . 14 ALA CA . 52475 1 47 . 1 . 1 14 14 ALA CB C 13 17.334 0.3 . 1 . . . . . 14 ALA CB . 52475 1 48 . 1 . 1 14 14 ALA N N 15 124.905 0.3 . 1 . . . . . 14 ALA N . 52475 1 49 . 1 . 1 15 15 GLY H H 1 8.199 0.020 . 1 . . . . . 15 GLY H . 52475 1 50 . 1 . 1 15 15 GLY C C 13 175.007 0.3 . 1 . . . . . 15 GLY C . 52475 1 51 . 1 . 1 15 15 GLY CA C 13 44.913 0.3 . 1 . . . . . 15 GLY CA . 52475 1 52 . 1 . 1 15 15 GLY N N 15 111.712 0.3 . 1 . . . . . 15 GLY N . 52475 1 53 . 1 . 1 16 16 GLY H H 1 8.004 0.020 . 1 . . . . . 16 GLY H . 52475 1 54 . 1 . 1 16 16 GLY C C 13 170.926 0.3 . 1 . . . . . 16 GLY C . 52475 1 55 . 1 . 1 16 16 GLY CA C 13 44.735 0.3 . 1 . . . . . 16 GLY CA . 52475 1 56 . 1 . 1 16 16 GLY N N 15 108.760 0.3 . 1 . . . . . 16 GLY N . 52475 1 57 . 1 . 1 17 17 GLY H H 1 7.961 0.020 . 1 . . . . . 17 GLY H . 52475 1 58 . 1 . 1 17 17 GLY C C 13 173.773 0.3 . 1 . . . . . 17 GLY C . 52475 1 59 . 1 . 1 17 17 GLY CA C 13 44.735 0.3 . 1 . . . . . 17 GLY CA . 52475 1 60 . 1 . 1 17 17 GLY N N 15 108.901 0.3 . 1 . . . . . 17 GLY N . 52475 1 61 . 1 . 1 18 18 TYR H H 1 7.763 0.020 . 1 . . . . . 18 TYR H . 52475 1 62 . 1 . 1 18 18 TYR C C 13 174.419 0.3 . 1 . . . . . 18 TYR C . 52475 1 63 . 1 . 1 18 18 TYR CA C 13 57.190 0.3 . 1 . . . . . 18 TYR CA . 52475 1 64 . 1 . 1 18 18 TYR CB C 13 37.884 0.3 . 1 . . . . . 18 TYR CB . 52475 1 65 . 1 . 1 18 18 TYR N N 15 120.563 0.3 . 1 . . . . . 18 TYR N . 52475 1 66 . 1 . 1 19 19 TYR H H 1 7.877 0.020 . 1 . . . . . 19 TYR H . 52475 1 67 . 1 . 1 19 19 TYR C C 13 173.508 0.3 . 1 . . . . . 19 TYR C . 52475 1 68 . 1 . 1 19 19 TYR CA C 13 54.165 0.3 . 1 . . . . . 19 TYR CA . 52475 1 69 . 1 . 1 19 19 TYR CB C 13 37.795 0.3 . 1 . . . . . 19 TYR CB . 52475 1 70 . 1 . 1 19 19 TYR N N 15 124.229 0.3 . 1 . . . . . 19 TYR N . 52475 1 71 . 1 . 1 21 21 GLY H H 1 8.209 0.020 . 1 . . . . . 21 GLY H . 52475 1 72 . 1 . 1 21 21 GLY C C 13 174.176 0.3 . 1 . . . . . 21 GLY C . 52475 1 73 . 1 . 1 21 21 GLY CA C 13 44.379 0.3 . 1 . . . . . 21 GLY CA . 52475 1 74 . 1 . 1 21 21 GLY N N 15 109.584 0.3 . 1 . . . . . 21 GLY N . 52475 1 75 . 1 . 1 22 22 GLY H H 1 7.861 0.020 . 1 . . . . . 22 GLY H . 52475 1 76 . 1 . 1 22 22 GLY C C 13 174.153 0.3 . 1 . . . . . 22 GLY C . 52475 1 77 . 1 . 1 22 22 GLY CA C 13 43.756 0.3 . 1 . . . . . 22 GLY CA . 52475 1 78 . 1 . 1 22 22 GLY N N 15 109.172 0.3 . 1 . . . . . 22 GLY N . 52475 1 79 . 1 . 1 23 23 TYR H H 1 7.039 0.020 . 1 . . . . . 23 TYR H . 52475 1 80 . 1 . 1 23 23 TYR C C 13 175.729 0.3 . 1 . . . . . 23 TYR C . 52475 1 81 . 1 . 1 23 23 TYR CA C 13 59.948 0.3 . 1 . . . . . 23 TYR CA . 52475 1 82 . 1 . 1 23 23 TYR CB C 13 37.173 0.3 . 1 . . . . . 23 TYR CB . 52475 1 83 . 1 . 1 23 23 TYR N N 15 119.590 0.3 . 1 . . . . . 23 TYR N . 52475 1 84 . 1 . 1 24 24 GLY H H 1 7.777 0.020 . 1 . . . . . 24 GLY H . 52475 1 85 . 1 . 1 24 24 GLY C C 13 176.772 0.3 . 1 . . . . . 24 GLY C . 52475 1 86 . 1 . 1 24 24 GLY CA C 13 46.597 0.3 . 1 . . . . . 24 GLY CA . 52475 1 87 . 1 . 1 24 24 GLY N N 15 105.384 0.3 . 1 . . . . . 24 GLY N . 52475 1 88 . 1 . 1 25 25 GLY H H 1 8.054 0.020 . 1 . . . . . 25 GLY H . 52475 1 89 . 1 . 1 25 25 GLY C C 13 173.679 0.3 . 1 . . . . . 25 GLY C . 52475 1 90 . 1 . 1 25 25 GLY CA C 13 44.913 0.3 . 1 . . . . . 25 GLY CA . 52475 1 91 . 1 . 1 25 25 GLY N N 15 108.888 0.3 . 1 . . . . . 25 GLY N . 52475 1 92 . 1 . 1 26 26 ALA H H 1 7.974 0.020 . 1 . . . . . 26 ALA H . 52475 1 93 . 1 . 1 26 26 ALA C C 13 175.406 0.3 . 1 . . . . . 26 ALA C . 52475 1 94 . 1 . 1 26 26 ALA CA C 13 51.852 0.3 . 1 . . . . . 26 ALA CA . 52475 1 95 . 1 . 1 26 26 ALA CB C 13 17.956 0.3 . 1 . . . . . 26 ALA CB . 52475 1 96 . 1 . 1 26 26 ALA N N 15 124.086 0.3 . 1 . . . . . 26 ALA N . 52475 1 97 . 1 . 1 29 29 GLY H H 1 7.566 0.020 . 1 . . . . . 29 GLY H . 52475 1 98 . 1 . 1 29 29 GLY C C 13 174.134 0.3 . 1 . . . . . 29 GLY C . 52475 1 99 . 1 . 1 29 29 GLY CA C 13 44.256 0.3 . 1 . . . . . 29 GLY CA . 52475 1 100 . 1 . 1 29 29 GLY N N 15 108.474 0.3 . 1 . . . . . 29 GLY N . 52475 1 101 . 1 . 1 31 31 ALA H H 1 8.086 0.020 . 1 . . . . . 31 ALA H . 52475 1 102 . 1 . 1 31 31 ALA C C 13 176.811 0.3 . 1 . . . . . 31 ALA C . 52475 1 103 . 1 . 1 31 31 ALA CA C 13 51.763 0.3 . 1 . . . . . 31 ALA CA . 52475 1 104 . 1 . 1 31 31 ALA CB C 13 18.401 0.3 . 1 . . . . . 31 ALA CB . 52475 1 105 . 1 . 1 31 31 ALA N N 15 123.941 0.3 . 1 . . . . . 31 ALA N . 52475 1 106 . 1 . 1 32 32 PHE H H 1 7.846 0.020 . 1 . . . . . 32 PHE H . 52475 1 107 . 1 . 1 32 32 PHE C C 13 173.906 0.3 . 1 . . . . . 32 PHE C . 52475 1 108 . 1 . 1 32 32 PHE CA C 13 54.432 0.3 . 1 . . . . . 32 PHE CA . 52475 1 109 . 1 . 1 32 32 PHE CB C 13 38.329 0.3 . 1 . . . . . 32 PHE CB . 52475 1 110 . 1 . 1 32 32 PHE N N 15 119.887 0.3 . 1 . . . . . 32 PHE N . 52475 1 111 . 1 . 1 37 37 GLN H H 1 7.947 0.020 . 1 . . . . . 37 GLN H . 52475 1 112 . 1 . 1 37 37 GLN C C 13 174.172 0.3 . 1 . . . . . 37 GLN C . 52475 1 113 . 1 . 1 37 37 GLN CA C 13 54.877 0.3 . 1 . . . . . 37 GLN CA . 52475 1 114 . 1 . 1 37 37 GLN CB C 13 28.365 0.3 . 1 . . . . . 37 GLN CB . 52475 1 115 . 1 . 1 37 37 GLN N N 15 122.610 0.3 . 1 . . . . . 37 GLN N . 52475 1 116 . 1 . 1 38 38 ASP H H 1 8.019 0.020 . 1 . . . . . 38 ASP H . 52475 1 117 . 1 . 1 38 38 ASP C C 13 175.159 0.3 . 1 . . . . . 38 ASP C . 52475 1 118 . 1 . 1 38 38 ASP CA C 13 51.763 0.3 . 1 . . . . . 38 ASP CA . 52475 1 119 . 1 . 1 38 38 ASP CB C 13 41.888 0.3 . 1 . . . . . 38 ASP CB . 52475 1 120 . 1 . 1 38 38 ASP N N 15 124.363 0.3 . 1 . . . . . 38 ASP N . 52475 1 121 . 1 . 1 40 40 LEU H H 1 8.344 0.020 . 1 . . . . . 40 LEU H . 52475 1 122 . 1 . 1 40 40 LEU C C 13 178.896 0.3 . 1 . . . . . 40 LEU C . 52475 1 123 . 1 . 1 40 40 LEU CA C 13 55.944 0.3 . 1 . . . . . 40 LEU CA . 52475 1 124 . 1 . 1 40 40 LEU CB C 13 40.642 0.3 . 1 . . . . . 40 LEU CB . 52475 1 125 . 1 . 1 40 40 LEU N N 15 117.620 0.3 . 1 . . . . . 40 LEU N . 52475 1 126 . 1 . 1 41 41 TYR H H 1 8.223 0.020 . 1 . . . . . 41 TYR H . 52475 1 127 . 1 . 1 41 41 TYR C C 13 176.409 0.3 . 1 . . . . . 41 TYR C . 52475 1 128 . 1 . 1 41 41 TYR CA C 13 56.567 0.3 . 1 . . . . . 41 TYR CA . 52475 1 129 . 1 . 1 41 41 TYR CB C 13 37.440 0.3 . 1 . . . . . 41 TYR CB . 52475 1 130 . 1 . 1 41 41 TYR N N 15 118.167 0.3 . 1 . . . . . 41 TYR N . 52475 1 131 . 1 . 1 42 42 GLY H H 1 7.531 0.020 . 1 . . . . . 42 GLY H . 52475 1 132 . 1 . 1 42 42 GLY C C 13 176.808 0.3 . 1 . . . . . 42 GLY C . 52475 1 133 . 1 . 1 42 42 GLY CA C 13 46.514 0.3 . 1 . . . . . 42 GLY CA . 52475 1 134 . 1 . 1 42 42 GLY N N 15 107.497 0.3 . 1 . . . . . 42 GLY N . 52475 1 135 . 1 . 1 43 43 TYR H H 1 7.026 0.020 . 1 . . . . . 43 TYR H . 52475 1 136 . 1 . 1 43 43 TYR C C 13 177.280 0.3 . 1 . . . . . 43 TYR C . 52475 1 137 . 1 . 1 43 43 TYR CA C 13 58.346 0.3 . 1 . . . . . 43 TYR CA . 52475 1 138 . 1 . 1 43 43 TYR CB C 13 36.728 0.3 . 1 . . . . . 43 TYR CB . 52475 1 139 . 1 . 1 43 43 TYR N N 15 119.046 0.3 . 1 . . . . . 43 TYR N . 52475 1 140 . 1 . 1 44 44 PHE H H 1 7.291 0.020 . 1 . . . . . 44 PHE H . 52475 1 141 . 1 . 1 44 44 PHE C C 13 176.526 0.3 . 1 . . . . . 44 PHE C . 52475 1 142 . 1 . 1 44 44 PHE CA C 13 60.660 0.3 . 1 . . . . . 44 PHE CA . 52475 1 143 . 1 . 1 44 44 PHE CB C 13 39.664 0.3 . 1 . . . . . 44 PHE CB . 52475 1 144 . 1 . 1 44 44 PHE N N 15 120.145 0.3 . 1 . . . . . 44 PHE N . 52475 1 145 . 1 . 1 45 45 ALA H H 1 8.791 0.020 . 1 . . . . . 45 ALA H . 52475 1 146 . 1 . 1 45 45 ALA C C 13 178.805 0.3 . 1 . . . . . 45 ALA C . 52475 1 147 . 1 . 1 45 45 ALA CA C 13 53.009 0.3 . 1 . . . . . 45 ALA CA . 52475 1 148 . 1 . 1 45 45 ALA CB C 13 16.622 0.3 . 1 . . . . . 45 ALA CB . 52475 1 149 . 1 . 1 45 45 ALA N N 15 120.122 0.3 . 1 . . . . . 45 ALA N . 52475 1 150 . 1 . 1 46 46 ALA H H 1 6.934 0.020 . 1 . . . . . 46 ALA H . 52475 1 151 . 1 . 1 46 46 ALA C C 13 178.533 0.3 . 1 . . . . . 46 ALA C . 52475 1 152 . 1 . 1 46 46 ALA CA C 13 53.542 0.3 . 1 . . . . . 46 ALA CA . 52475 1 153 . 1 . 1 46 46 ALA CB C 13 17.422 0.3 . 1 . . . . . 46 ALA CB . 52475 1 154 . 1 . 1 46 46 ALA N N 15 117.322 0.3 . 1 . . . . . 46 ALA N . 52475 1 155 . 1 . 1 47 47 VAL H H 1 6.819 0.020 . 1 . . . . . 47 VAL H . 52475 1 156 . 1 . 1 47 47 VAL C C 13 175.156 0.3 . 1 . . . . . 47 VAL C . 52475 1 157 . 1 . 1 47 47 VAL CA C 13 60.749 0.3 . 1 . . . . . 47 VAL CA . 52475 1 158 . 1 . 1 47 47 VAL CB C 13 32.547 0.3 . 1 . . . . . 47 VAL CB . 52475 1 159 . 1 . 1 47 47 VAL N N 15 109.320 0.3 . 1 . . . . . 47 VAL N . 52475 1 160 . 1 . 1 48 48 ALA H H 1 7.326 0.020 . 1 . . . . . 48 ALA H . 52475 1 161 . 1 . 1 48 48 ALA C C 13 178.297 0.3 . 1 . . . . . 48 ALA C . 52475 1 162 . 1 . 1 48 48 ALA CA C 13 51.941 0.3 . 1 . . . . . 48 ALA CA . 52475 1 163 . 1 . 1 48 48 ALA CB C 13 19.113 0.3 . 1 . . . . . 48 ALA CB . 52475 1 164 . 1 . 1 48 48 ALA N N 15 122.819 0.3 . 1 . . . . . 48 ALA N . 52475 1 165 . 1 . 1 49 49 GLY H H 1 8.011 0.020 . 1 . . . . . 49 GLY H . 52475 1 166 . 1 . 1 49 49 GLY C C 13 175.425 0.3 . 1 . . . . . 49 GLY C . 52475 1 167 . 1 . 1 49 49 GLY CA C 13 43.756 0.3 . 1 . . . . . 49 GLY CA . 52475 1 168 . 1 . 1 49 49 GLY N N 15 106.929 0.3 . 1 . . . . . 49 GLY N . 52475 1 169 . 1 . 1 50 50 GLN H H 1 8.048 0.020 . 1 . . . . . 50 GLN H . 52475 1 170 . 1 . 1 50 50 GLN C C 13 177.286 0.3 . 1 . . . . . 50 GLN C . 52475 1 171 . 1 . 1 50 50 GLN CA C 13 57.724 0.3 . 1 . . . . . 50 GLN CA . 52475 1 172 . 1 . 1 50 50 GLN CB C 13 27.387 0.3 . 1 . . . . . 50 GLN CB . 52475 1 173 . 1 . 1 50 50 GLN N N 15 121.138 0.3 . 1 . . . . . 50 GLN N . 52475 1 174 . 1 . 1 51 51 ASP H H 1 8.287 0.020 . 1 . . . . . 51 ASP H . 52475 1 175 . 1 . 1 51 51 ASP C C 13 176.536 0.3 . 1 . . . . . 51 ASP C . 52475 1 176 . 1 . 1 51 51 ASP CA C 13 53.631 0.3 . 1 . . . . . 51 ASP CA . 52475 1 177 . 1 . 1 51 51 ASP CB C 13 39.575 0.3 . 1 . . . . . 51 ASP CB . 52475 1 178 . 1 . 1 51 51 ASP N N 15 117.875 0.3 . 1 . . . . . 51 ASP N . 52475 1 179 . 1 . 1 52 52 GLY H H 1 7.956 0.020 . 1 . . . . . 52 GLY H . 52475 1 180 . 1 . 1 52 52 GLY C C 13 172.778 0.3 . 1 . . . . . 52 GLY C . 52475 1 181 . 1 . 1 52 52 GLY CA C 13 45.535 0.3 . 1 . . . . . 52 GLY CA . 52475 1 182 . 1 . 1 52 52 GLY N N 15 107.209 0.3 . 1 . . . . . 52 GLY N . 52475 1 183 . 1 . 1 53 53 GLN H H 1 7.435 0.020 . 1 . . . . . 53 GLN H . 52475 1 184 . 1 . 1 53 53 GLN C C 13 175.634 0.3 . 1 . . . . . 53 GLN C . 52475 1 185 . 1 . 1 53 53 GLN CA C 13 53.009 0.3 . 1 . . . . . 53 GLN CA . 52475 1 186 . 1 . 1 53 53 GLN CB C 13 30.678 0.3 . 1 . . . . . 53 GLN CB . 52475 1 187 . 1 . 1 53 53 GLN N N 15 117.329 0.3 . 1 . . . . . 53 GLN N . 52475 1 188 . 1 . 1 54 54 ILE H H 1 9.059 0.020 . 1 . . . . . 54 ILE H . 52475 1 189 . 1 . 1 54 54 ILE C C 13 174.286 0.3 . 1 . . . . . 54 ILE C . 52475 1 190 . 1 . 1 54 54 ILE CA C 13 58.346 0.3 . 1 . . . . . 54 ILE CA . 52475 1 191 . 1 . 1 54 54 ILE CB C 13 40.642 0.3 . 1 . . . . . 54 ILE CB . 52475 1 192 . 1 . 1 54 54 ILE N N 15 115.549 0.3 . 1 . . . . . 54 ILE N . 52475 1 193 . 1 . 1 55 55 ASP H H 1 8.565 0.020 . 1 . . . . . 55 ASP H . 52475 1 194 . 1 . 1 55 55 ASP C C 13 176.412 0.3 . 1 . . . . . 55 ASP C . 52475 1 195 . 1 . 1 55 55 ASP CA C 13 50.251 0.3 . 1 . . . . . 55 ASP CA . 52475 1 196 . 1 . 1 55 55 ASP CB C 13 40.820 0.3 . 1 . . . . . 55 ASP CB . 52475 1 197 . 1 . 1 55 55 ASP N N 15 121.947 0.3 . 1 . . . . . 55 ASP N . 52475 1 198 . 1 . 1 56 56 ALA H H 1 8.606 0.020 . 1 . . . . . 56 ALA H . 52475 1 199 . 1 . 1 56 56 ALA C C 13 178.188 0.3 . 1 . . . . . 56 ALA C . 52475 1 200 . 1 . 1 56 56 ALA CA C 13 55.411 0.3 . 1 . . . . . 56 ALA CA . 52475 1 201 . 1 . 1 56 56 ALA CB C 13 17.956 0.3 . 1 . . . . . 56 ALA CB . 52475 1 202 . 1 . 1 56 56 ALA N N 15 118.760 0.3 . 1 . . . . . 56 ALA N . 52475 1 203 . 1 . 1 57 57 ASP H H 1 7.659 0.020 . 1 . . . . . 57 ASP H . 52475 1 204 . 1 . 1 57 57 ASP C C 13 178.880 0.3 . 1 . . . . . 57 ASP C . 52475 1 205 . 1 . 1 57 57 ASP CA C 13 57.101 0.3 . 1 . . . . . 57 ASP CA . 52475 1 206 . 1 . 1 57 57 ASP CB C 13 41.265 0.3 . 1 . . . . . 57 ASP CB . 52475 1 207 . 1 . 1 57 57 ASP N N 15 118.462 0.3 . 1 . . . . . 57 ASP N . 52475 1 208 . 1 . 1 58 58 GLU H H 1 8.378 0.020 . 1 . . . . . 58 GLU H . 52475 1 209 . 1 . 1 58 58 GLU C C 13 179.032 0.3 . 1 . . . . . 58 GLU C . 52475 1 210 . 1 . 1 58 58 GLU CA C 13 58.257 0.3 . 1 . . . . . 58 GLU CA . 52475 1 211 . 1 . 1 58 58 GLU CB C 13 27.831 0.3 . 1 . . . . . 58 GLU CB . 52475 1 212 . 1 . 1 58 58 GLU N N 15 121.260 0.3 . 1 . . . . . 58 GLU N . 52475 1 213 . 1 . 1 59 59 LEU H H 1 9.098 0.020 . 1 . . . . . 59 LEU H . 52475 1 214 . 1 . 1 59 59 LEU C C 13 177.741 0.3 . 1 . . . . . 59 LEU C . 52475 1 215 . 1 . 1 59 59 LEU CA C 13 57.724 0.3 . 1 . . . . . 59 LEU CA . 52475 1 216 . 1 . 1 59 59 LEU CB C 13 39.664 0.3 . 1 . . . . . 59 LEU CB . 52475 1 217 . 1 . 1 59 59 LEU N N 15 121.703 0.3 . 1 . . . . . 59 LEU N . 52475 1 218 . 1 . 1 60 60 GLN H H 1 8.355 0.020 . 1 . . . . . 60 GLN H . 52475 1 219 . 1 . 1 60 60 GLN C C 13 180.133 0.3 . 1 . . . . . 60 GLN C . 52475 1 220 . 1 . 1 60 60 GLN CA C 13 59.503 0.3 . 1 . . . . . 60 GLN CA . 52475 1 221 . 1 . 1 60 60 GLN CB C 13 27.298 0.3 . 1 . . . . . 60 GLN CB . 52475 1 222 . 1 . 1 60 60 GLN N N 15 121.423 0.3 . 1 . . . . . 60 GLN N . 52475 1 223 . 1 . 1 61 61 ARG H H 1 7.701 0.020 . 1 . . . . . 61 ARG H . 52475 1 224 . 1 . 1 61 61 ARG C C 13 178.539 0.3 . 1 . . . . . 61 ARG C . 52475 1 225 . 1 . 1 61 61 ARG CA C 13 59.503 0.3 . 1 . . . . . 61 ARG CA . 52475 1 226 . 1 . 1 61 61 ARG CB C 13 29.077 0.3 . 1 . . . . . 61 ARG CB . 52475 1 227 . 1 . 1 61 61 ARG N N 15 121.423 0.3 . 1 . . . . . 61 ARG N . 52475 1 228 . 1 . 1 62 62 CYS H H 1 8.723 0.020 . 1 . . . . . 62 CYS H . 52475 1 229 . 1 . 1 62 62 CYS C C 13 178.007 0.3 . 1 . . . . . 62 CYS C . 52475 1 230 . 1 . 1 62 62 CYS CA C 13 61.460 0.3 . 1 . . . . . 62 CYS CA . 52475 1 231 . 1 . 1 62 62 CYS CB C 13 26.230 0.3 . 1 . . . . . 62 CYS CB . 52475 1 232 . 1 . 1 62 62 CYS N N 15 121.120 0.3 . 1 . . . . . 62 CYS N . 52475 1 233 . 1 . 1 63 63 LEU H H 1 9.387 0.020 . 1 . . . . . 63 LEU H . 52475 1 234 . 1 . 1 63 63 LEU C C 13 181.785 0.3 . 1 . . . . . 63 LEU C . 52475 1 235 . 1 . 1 63 63 LEU CA C 13 57.190 0.3 . 1 . . . . . 63 LEU CA . 52475 1 236 . 1 . 1 63 63 LEU CB C 13 39.575 0.3 . 1 . . . . . 63 LEU CB . 52475 1 237 . 1 . 1 63 63 LEU N N 15 119.216 0.3 . 1 . . . . . 63 LEU N . 52475 1 238 . 1 . 1 64 64 THR H H 1 8.245 0.020 . 1 . . . . . 64 THR H . 52475 1 239 . 1 . 1 64 64 THR C C 13 175.156 0.3 . 1 . . . . . 64 THR C . 52475 1 240 . 1 . 1 64 64 THR CA C 13 65.197 0.3 . 1 . . . . . 64 THR CA . 52475 1 241 . 1 . 1 64 64 THR CB C 13 68.222 0.3 . 1 . . . . . 64 THR CB . 52475 1 242 . 1 . 1 64 64 THR N N 15 120.281 0.3 . 1 . . . . . 64 THR N . 52475 1 243 . 1 . 1 65 65 GLN H H 1 8.032 0.020 . 1 . . . . . 65 GLN H . 52475 1 244 . 1 . 1 65 65 GLN C C 13 177.286 0.3 . 1 . . . . . 65 GLN C . 52475 1 245 . 1 . 1 65 65 GLN CA C 13 57.724 0.3 . 1 . . . . . 65 GLN CA . 52475 1 246 . 1 . 1 65 65 GLN CB C 13 27.298 0.3 . 1 . . . . . 65 GLN CB . 52475 1 247 . 1 . 1 65 65 GLN N N 15 121.803 0.3 . 1 . . . . . 65 GLN N . 52475 1 248 . 1 . 1 66 66 SER H H 1 7.928 0.020 . 1 . . . . . 66 SER H . 52475 1 249 . 1 . 1 66 66 SER C C 13 175.029 0.3 . 1 . . . . . 66 SER C . 52475 1 250 . 1 . 1 66 66 SER CA C 13 59.414 0.3 . 1 . . . . . 66 SER CA . 52475 1 251 . 1 . 1 66 66 SER CB C 13 63.506 0.3 . 1 . . . . . 66 SER CB . 52475 1 252 . 1 . 1 66 66 SER N N 15 112.626 0.3 . 1 . . . . . 66 SER N . 52475 1 253 . 1 . 1 67 67 GLY H H 1 7.285 0.020 . 1 . . . . . 67 GLY H . 52475 1 254 . 1 . 1 67 67 GLY C C 13 176.373 0.3 . 1 . . . . . 67 GLY C . 52475 1 255 . 1 . 1 67 67 GLY CA C 13 45.535 0.3 . 1 . . . . . 67 GLY CA . 52475 1 256 . 1 . 1 67 67 GLY N N 15 107.633 0.3 . 1 . . . . . 67 GLY N . 52475 1 257 . 1 . 1 68 68 ILE H H 1 7.449 0.020 . 1 . . . . . 68 ILE H . 52475 1 258 . 1 . 1 68 68 ILE C C 13 174.381 0.3 . 1 . . . . . 68 ILE C . 52475 1 259 . 1 . 1 68 68 ILE CA C 13 61.282 0.3 . 1 . . . . . 68 ILE CA . 52475 1 260 . 1 . 1 68 68 ILE CB C 13 36.016 0.3 . 1 . . . . . 68 ILE CB . 52475 1 261 . 1 . 1 68 68 ILE N N 15 121.838 0.3 . 1 . . . . . 68 ILE N . 52475 1 262 . 1 . 1 69 69 ALA H H 1 8.318 0.020 . 1 . . . . . 69 ALA H . 52475 1 263 . 1 . 1 69 69 ALA C C 13 178.769 0.3 . 1 . . . . . 69 ALA C . 52475 1 264 . 1 . 1 69 69 ALA CA C 13 51.941 0.3 . 1 . . . . . 69 ALA CA . 52475 1 265 . 1 . 1 69 69 ALA CB C 13 17.422 0.3 . 1 . . . . . 69 ALA CB . 52475 1 266 . 1 . 1 69 69 ALA N N 15 122.824 0.3 . 1 . . . . . 69 ALA N . 52475 1 267 . 1 . 1 70 70 GLY H H 1 7.675 0.020 . 1 . . . . . 70 GLY H . 52475 1 268 . 1 . 1 70 70 GLY C C 13 174.666 0.3 . 1 . . . . . 70 GLY C . 52475 1 269 . 1 . 1 70 70 GLY CA C 13 46.014 0.3 . 1 . . . . . 70 GLY CA . 52475 1 270 . 1 . 1 70 70 GLY N N 15 106.225 0.3 . 1 . . . . . 70 GLY N . 52475 1 271 . 1 . 1 71 71 GLY H H 1 8.627 0.020 . 1 . . . . . 71 GLY H . 52475 1 272 . 1 . 1 71 71 GLY C C 13 174.393 0.3 . 1 . . . . . 71 GLY C . 52475 1 273 . 1 . 1 71 71 GLY CA C 13 44.379 0.3 . 1 . . . . . 71 GLY CA . 52475 1 274 . 1 . 1 71 71 GLY N N 15 110.350 0.3 . 1 . . . . . 71 GLY N . 52475 1 275 . 1 . 1 72 72 TYR H H 1 7.162 0.020 . 1 . . . . . 72 TYR H . 52475 1 276 . 1 . 1 72 72 TYR C C 13 174.552 0.3 . 1 . . . . . 72 TYR C . 52475 1 277 . 1 . 1 72 72 TYR CA C 13 54.165 0.3 . 1 . . . . . 72 TYR CA . 52475 1 278 . 1 . 1 72 72 TYR CB C 13 37.262 0.3 . 1 . . . . . 72 TYR CB . 52475 1 279 . 1 . 1 72 72 TYR N N 15 120.585 0.3 . 1 . . . . . 72 TYR N . 52475 1 280 . 1 . 1 73 73 LYS H H 1 8.223 0.020 . 1 . . . . . 73 LYS H . 52475 1 281 . 1 . 1 73 73 LYS C C 13 174.020 0.3 . 1 . . . . . 73 LYS C . 52475 1 282 . 1 . 1 73 73 LYS CA C 13 54.165 0.3 . 1 . . . . . 73 LYS CA . 52475 1 283 . 1 . 1 73 73 LYS CB C 13 30.856 0.3 . 1 . . . . . 73 LYS CB . 52475 1 284 . 1 . 1 73 73 LYS N N 15 121.423 0.3 . 1 . . . . . 73 LYS N . 52475 1 285 . 1 . 1 75 75 PHE H H 1 7.689 0.020 . 1 . . . . . 75 PHE H . 52475 1 286 . 1 . 1 75 75 PHE C C 13 177.077 0.3 . 1 . . . . . 75 PHE C . 52475 1 287 . 1 . 1 75 75 PHE CA C 13 57.190 0.3 . 1 . . . . . 75 PHE CA . 52475 1 288 . 1 . 1 75 75 PHE CB C 13 39.397 0.3 . 1 . . . . . 75 PHE CB . 52475 1 289 . 1 . 1 75 75 PHE N N 15 118.737 0.3 . 1 . . . . . 75 PHE N . 52475 1 290 . 1 . 1 76 76 ASN H H 1 8.908 0.020 . 1 . . . . . 76 ASN H . 52475 1 291 . 1 . 1 76 76 ASN C C 13 176.185 0.3 . 1 . . . . . 76 ASN C . 52475 1 292 . 1 . 1 76 76 ASN CA C 13 51.941 0.3 . 1 . . . . . 76 ASN CA . 52475 1 293 . 1 . 1 76 76 ASN CB C 13 38.952 0.3 . 1 . . . . . 76 ASN CB . 52475 1 294 . 1 . 1 76 76 ASN N N 15 121.241 0.3 . 1 . . . . . 76 ASN N . 52475 1 295 . 1 . 1 77 77 LEU H H 1 8.641 0.020 . 1 . . . . . 77 LEU H . 52475 1 296 . 1 . 1 77 77 LEU C C 13 178.747 0.3 . 1 . . . . . 77 LEU C . 52475 1 297 . 1 . 1 77 77 LEU CA C 13 57.724 0.3 . 1 . . . . . 77 LEU CA . 52475 1 298 . 1 . 1 77 77 LEU CB C 13 40.553 0.3 . 1 . . . . . 77 LEU CB . 52475 1 299 . 1 . 1 77 77 LEU N N 15 123.941 0.3 . 1 . . . . . 77 LEU N . 52475 1 300 . 1 . 1 78 78 GLU H H 1 8.798 0.020 . 1 . . . . . 78 GLU H . 52475 1 301 . 1 . 1 78 78 GLU C C 13 177.662 0.3 . 1 . . . . . 78 GLU C . 52475 1 302 . 1 . 1 78 78 GLU CA C 13 58.702 0.3 . 1 . . . . . 78 GLU CA . 52475 1 303 . 1 . 1 78 78 GLU CB C 13 27.298 0.3 . 1 . . . . . 78 GLU CB . 52475 1 304 . 1 . 1 78 78 GLU N N 15 119.149 0.3 . 1 . . . . . 78 GLU N . 52475 1 305 . 1 . 1 79 79 THR H H 1 7.113 0.020 . 1 . . . . . 79 THR H . 52475 1 306 . 1 . 1 79 79 THR C C 13 177.665 0.3 . 1 . . . . . 79 THR C . 52475 1 307 . 1 . 1 79 79 THR CA C 13 65.286 0.3 . 1 . . . . . 79 THR CA . 52475 1 308 . 1 . 1 79 79 THR CB C 13 66.620 0.3 . 1 . . . . . 79 THR CB . 52475 1 309 . 1 . 1 79 79 THR N N 15 115.929 0.3 . 1 . . . . . 79 THR N . 52475 1 310 . 1 . 1 80 80 CYS H H 1 7.506 0.020 . 1 . . . . . 80 CYS H . 52475 1 311 . 1 . 1 80 80 CYS C C 13 176.640 0.3 . 1 . . . . . 80 CYS C . 52475 1 312 . 1 . 1 80 80 CYS CA C 13 57.190 0.3 . 1 . . . . . 80 CYS CA . 52475 1 313 . 1 . 1 80 80 CYS CB C 13 27.387 0.3 . 1 . . . . . 80 CYS CB . 52475 1 314 . 1 . 1 80 80 CYS N N 15 120.011 0.3 . 1 . . . . . 80 CYS N . 52475 1 315 . 1 . 1 81 81 ARG H H 1 8.640 0.020 . 1 . . . . . 81 ARG H . 52475 1 316 . 1 . 1 81 81 ARG C C 13 179.042 0.3 . 1 . . . . . 81 ARG C . 52475 1 317 . 1 . 1 81 81 ARG CA C 13 59.681 0.3 . 1 . . . . . 81 ARG CA . 52475 1 318 . 1 . 1 81 81 ARG CB C 13 28.454 0.3 . 1 . . . . . 81 ARG CB . 52475 1 319 . 1 . 1 81 81 ARG N N 15 122.384 0.3 . 1 . . . . . 81 ARG N . 52475 1 320 . 1 . 1 82 82 LEU H H 1 7.631 0.020 . 1 . . . . . 82 LEU H . 52475 1 321 . 1 . 1 82 82 LEU C C 13 178.134 0.3 . 1 . . . . . 82 LEU C . 52475 1 322 . 1 . 1 82 82 LEU CA C 13 57.190 0.3 . 1 . . . . . 82 LEU CA . 52475 1 323 . 1 . 1 82 82 LEU CB C 13 40.731 0.3 . 1 . . . . . 82 LEU CB . 52475 1 324 . 1 . 1 82 82 LEU N N 15 120.276 0.3 . 1 . . . . . 82 LEU N . 52475 1 325 . 1 . 1 83 83 MET H H 1 7.367 0.020 . 1 . . . . . 83 MET H . 52475 1 326 . 1 . 1 83 83 MET C C 13 177.081 0.3 . 1 . . . . . 83 MET C . 52475 1 327 . 1 . 1 83 83 MET CA C 13 59.419 0.3 . 1 . . . . . 83 MET CA . 52475 1 328 . 1 . 1 83 83 MET CB C 13 31.390 0.3 . 1 . . . . . 83 MET CB . 52475 1 329 . 1 . 1 83 83 MET N N 15 118.040 0.3 . 1 . . . . . 83 MET N . 52475 1 330 . 1 . 1 84 84 VAL H H 1 7.449 0.020 . 1 . . . . . 84 VAL H . 52475 1 331 . 1 . 1 84 84 VAL C C 13 178.533 0.3 . 1 . . . . . 84 VAL C . 52475 1 332 . 1 . 1 84 84 VAL CA C 13 66.442 0.3 . 1 . . . . . 84 VAL CA . 52475 1 333 . 1 . 1 84 84 VAL CB C 13 30.144 0.3 . 1 . . . . . 84 VAL CB . 52475 1 334 . 1 . 1 84 84 VAL N N 15 116.347 0.3 . 1 . . . . . 84 VAL N . 52475 1 335 . 1 . 1 85 85 SER H H 1 7.998 0.020 . 1 . . . . . 85 SER H . 52475 1 336 . 1 . 1 85 85 SER C C 13 176.317 0.3 . 1 . . . . . 85 SER C . 52475 1 337 . 1 . 1 85 85 SER CA C 13 60.660 0.3 . 1 . . . . . 85 SER CA . 52475 1 338 . 1 . 1 85 85 SER CB C 13 62.350 0.3 . 1 . . . . . 85 SER CB . 52475 1 339 . 1 . 1 85 85 SER N N 15 115.368 0.3 . 1 . . . . . 85 SER N . 52475 1 340 . 1 . 1 86 86 MET H H 1 8.086 0.020 . 1 . . . . . 86 MET H . 52475 1 341 . 1 . 1 86 86 MET C C 13 176.427 0.3 . 1 . . . . . 86 MET C . 52475 1 342 . 1 . 1 86 86 MET CA C 13 57.724 0.3 . 1 . . . . . 86 MET CA . 52475 1 343 . 1 . 1 86 86 MET CB C 13 31.479 0.3 . 1 . . . . . 86 MET CB . 52475 1 344 . 1 . 1 86 86 MET N N 15 119.593 0.3 . 1 . . . . . 86 MET N . 52475 1 345 . 1 . 1 87 87 LEU H H 1 6.997 0.020 . 1 . . . . . 87 LEU H . 52475 1 346 . 1 . 1 87 87 LEU C C 13 175.900 0.3 . 1 . . . . . 87 LEU C . 52475 1 347 . 1 . 1 87 87 LEU CA C 13 53.631 0.3 . 1 . . . . . 87 LEU CA . 52475 1 348 . 1 . 1 87 87 LEU CB C 13 41.799 0.3 . 1 . . . . . 87 LEU CB . 52475 1 349 . 1 . 1 87 87 LEU N N 15 117.196 0.3 . 1 . . . . . 87 LEU N . 52475 1 350 . 1 . 1 88 88 ASP H H 1 7.593 0.020 . 1 . . . . . 88 ASP H . 52475 1 351 . 1 . 1 88 88 ASP C C 13 177.190 0.3 . 1 . . . . . 88 ASP C . 52475 1 352 . 1 . 1 88 88 ASP CA C 13 53.631 0.3 . 1 . . . . . 88 ASP CA . 52475 1 353 . 1 . 1 88 88 ASP CB C 13 39.575 0.3 . 1 . . . . . 88 ASP CB . 52475 1 354 . 1 . 1 88 88 ASP N N 15 121.681 0.3 . 1 . . . . . 88 ASP N . 52475 1 355 . 1 . 1 89 89 ARG H H 1 8.517 0.020 . 1 . . . . . 89 ARG H . 52475 1 356 . 1 . 1 89 89 ARG C C 13 177.077 0.3 . 1 . . . . . 89 ARG C . 52475 1 357 . 1 . 1 89 89 ARG CA C 13 56.656 0.3 . 1 . . . . . 89 ARG CA . 52475 1 358 . 1 . 1 89 89 ARG CB C 13 29.611 0.3 . 1 . . . . . 89 ARG CB . 52475 1 359 . 1 . 1 89 89 ARG N N 15 126.031 0.3 . 1 . . . . . 89 ARG N . 52475 1 360 . 1 . 1 90 90 ASP H H 1 8.380 0.020 . 1 . . . . . 90 ASP H . 52475 1 361 . 1 . 1 90 90 ASP C C 13 175.292 0.3 . 1 . . . . . 90 ASP C . 52475 1 362 . 1 . 1 90 90 ASP CA C 13 53.009 0.3 . 1 . . . . . 90 ASP CA . 52475 1 363 . 1 . 1 90 90 ASP CB C 13 40.020 0.3 . 1 . . . . . 90 ASP CB . 52475 1 364 . 1 . 1 90 90 ASP N N 15 118.049 0.3 . 1 . . . . . 90 ASP N . 52475 1 365 . 1 . 1 91 91 MET H H 1 7.949 0.020 . 1 . . . . . 91 MET H . 52475 1 366 . 1 . 1 91 91 MET C C 13 175.653 0.3 . 1 . . . . . 91 MET C . 52475 1 367 . 1 . 1 91 91 MET CA C 13 55.855 0.3 . 1 . . . . . 91 MET CA . 52475 1 368 . 1 . 1 91 91 MET CB C 13 28.365 0.3 . 1 . . . . . 91 MET CB . 52475 1 369 . 1 . 1 91 91 MET N N 15 118.471 0.3 . 1 . . . . . 91 MET N . 52475 1 370 . 1 . 1 92 92 SER H H 1 9.536 0.020 . 1 . . . . . 92 SER H . 52475 1 371 . 1 . 1 92 92 SER C C 13 176.906 0.3 . 1 . . . . . 92 SER C . 52475 1 372 . 1 . 1 92 92 SER CA C 13 59.503 0.3 . 1 . . . . . 92 SER CA . 52475 1 373 . 1 . 1 92 92 SER CB C 13 64.663 0.3 . 1 . . . . . 92 SER CB . 52475 1 374 . 1 . 1 92 92 SER N N 15 117.756 0.3 . 1 . . . . . 92 SER N . 52475 1 375 . 1 . 1 94 94 THR H H 1 7.586 0.020 . 1 . . . . . 94 THR H . 52475 1 376 . 1 . 1 94 94 THR C C 13 172.179 0.3 . 1 . . . . . 94 THR C . 52475 1 377 . 1 . 1 94 94 THR CA C 13 58.892 0.3 . 1 . . . . . 94 THR CA . 52475 1 378 . 1 . 1 94 94 THR CB C 13 72.378 0.3 . 1 . . . . . 94 THR CB . 52475 1 379 . 1 . 1 94 94 THR N N 15 110.863 0.3 . 1 . . . . . 94 THR N . 52475 1 380 . 1 . 1 95 95 MET H H 1 9.080 0.020 . 1 . . . . . 95 MET H . 52475 1 381 . 1 . 1 95 95 MET C C 13 174.412 0.3 . 1 . . . . . 95 MET C . 52475 1 382 . 1 . 1 95 95 MET CA C 13 54.076 0.3 . 1 . . . . . 95 MET CA . 52475 1 383 . 1 . 1 95 95 MET CB C 13 36.639 0.3 . 1 . . . . . 95 MET CB . 52475 1 384 . 1 . 1 95 95 MET N N 15 117.447 0.3 . 1 . . . . . 95 MET N . 52475 1 385 . 1 . 1 96 96 GLY H H 1 8.066 0.020 . 1 . . . . . 96 GLY H . 52475 1 386 . 1 . 1 96 96 GLY C C 13 174.533 0.3 . 1 . . . . . 96 GLY C . 52475 1 387 . 1 . 1 96 96 GLY CA C 13 43.044 0.3 . 1 . . . . . 96 GLY CA . 52475 1 388 . 1 . 1 96 96 GLY N N 15 110.305 0.3 . 1 . . . . . 96 GLY N . 52475 1 389 . 1 . 1 97 97 PHE H H 1 8.948 0.020 . 1 . . . . . 97 PHE H . 52475 1 390 . 1 . 1 97 97 PHE C C 13 176.925 0.3 . 1 . . . . . 97 PHE C . 52475 1 391 . 1 . 1 97 97 PHE CA C 13 59.948 0.3 . 1 . . . . . 97 PHE CA . 52475 1 392 . 1 . 1 97 97 PHE CB C 13 37.351 0.3 . 1 . . . . . 97 PHE CB . 52475 1 393 . 1 . 1 97 97 PHE N N 15 121.533 0.3 . 1 . . . . . 97 PHE N . 52475 1 394 . 1 . 1 98 98 ASN H H 1 8.702 0.020 . 1 . . . . . 98 ASN H . 52475 1 395 . 1 . 1 98 98 ASN C C 13 178.406 0.3 . 1 . . . . . 98 ASN C . 52475 1 396 . 1 . 1 98 98 ASN CA C 13 55.855 0.3 . 1 . . . . . 98 ASN CA . 52475 1 397 . 1 . 1 98 98 ASN CB C 13 36.639 0.3 . 1 . . . . . 98 ASN CB . 52475 1 398 . 1 . 1 98 98 ASN N N 15 116.474 0.3 . 1 . . . . . 98 ASN N . 52475 1 399 . 1 . 1 99 99 GLU H H 1 7.665 0.020 . 1 . . . . . 99 GLU H . 52475 1 400 . 1 . 1 99 99 GLU C C 13 177.039 0.3 . 1 . . . . . 99 GLU C . 52475 1 401 . 1 . 1 99 99 GLU CA C 13 60.393 0.3 . 1 . . . . . 99 GLU CA . 52475 1 402 . 1 . 1 99 99 GLU CB C 13 28.365 0.3 . 1 . . . . . 99 GLU CB . 52475 1 403 . 1 . 1 99 99 GLU N N 15 119.702 0.3 . 1 . . . . . 99 GLU N . 52475 1 404 . 1 . 1 100 100 PHE H H 1 8.250 0.020 . 1 . . . . . 100 PHE H . 52475 1 405 . 1 . 1 100 100 PHE C C 13 176.185 0.3 . 1 . . . . . 100 PHE C . 52475 1 406 . 1 . 1 100 100 PHE CA C 13 60.660 0.3 . 1 . . . . . 100 PHE CA . 52475 1 407 . 1 . 1 100 100 PHE CB C 13 38.596 0.3 . 1 . . . . . 100 PHE CB . 52475 1 408 . 1 . 1 100 100 PHE N N 15 122.539 0.3 . 1 . . . . . 100 PHE N . 52475 1 409 . 1 . 1 101 101 LYS H H 1 8.035 0.020 . 1 . . . . . 101 LYS H . 52475 1 410 . 1 . 1 101 101 LYS C C 13 179.278 0.3 . 1 . . . . . 101 LYS C . 52475 1 411 . 1 . 1 101 101 LYS CA C 13 59.503 0.3 . 1 . . . . . 101 LYS CA . 52475 1 412 . 1 . 1 101 101 LYS CB C 13 30.322 0.3 . 1 . . . . . 101 LYS CB . 52475 1 413 . 1 . 1 101 101 LYS N N 15 118.714 0.3 . 1 . . . . . 101 LYS N . 52475 1 414 . 1 . 1 102 102 GLU H H 1 7.105 0.020 . 1 . . . . . 102 GLU H . 52475 1 415 . 1 . 1 102 102 GLU C C 13 178.387 0.3 . 1 . . . . . 102 GLU C . 52475 1 416 . 1 . 1 102 102 GLU CA C 13 58.524 0.3 . 1 . . . . . 102 GLU CA . 52475 1 417 . 1 . 1 102 102 GLU CB C 13 27.920 0.3 . 1 . . . . . 102 GLU CB . 52475 1 418 . 1 . 1 102 102 GLU N N 15 121.265 0.3 . 1 . . . . . 102 GLU N . 52475 1 419 . 1 . 1 103 103 LEU H H 1 8.391 0.020 . 1 . . . . . 103 LEU H . 52475 1 420 . 1 . 1 103 103 LEU C C 13 177.267 0.3 . 1 . . . . . 103 LEU C . 52475 1 421 . 1 . 1 103 103 LEU CA C 13 56.033 0.3 . 1 . . . . . 103 LEU CA . 52475 1 422 . 1 . 1 103 103 LEU CB C 13 39.575 0.3 . 1 . . . . . 103 LEU CB . 52475 1 423 . 1 . 1 103 103 LEU N N 15 120.852 0.3 . 1 . . . . . 103 LEU N . 52475 1 424 . 1 . 1 104 104 TRP H H 1 8.564 0.020 . 1 . . . . . 104 TRP H . 52475 1 425 . 1 . 1 104 104 TRP C C 13 178.292 0.3 . 1 . . . . . 104 TRP C . 52475 1 426 . 1 . 1 104 104 TRP CA C 13 60.749 0.3 . 1 . . . . . 104 TRP CA . 52475 1 427 . 1 . 1 104 104 TRP CB C 13 27.920 0.3 . 1 . . . . . 104 TRP CB . 52475 1 428 . 1 . 1 104 104 TRP N N 15 119.588 0.3 . 1 . . . . . 104 TRP N . 52475 1 429 . 1 . 1 105 105 ALA H H 1 7.215 0.020 . 1 . . . . . 105 ALA H . 52475 1 430 . 1 . 1 105 105 ALA C C 13 181.159 0.3 . 1 . . . . . 105 ALA C . 52475 1 431 . 1 . 1 105 105 ALA CA C 13 54.254 0.3 . 1 . . . . . 105 ALA CA . 52475 1 432 . 1 . 1 105 105 ALA CB C 13 17.156 0.3 . 1 . . . . . 105 ALA CB . 52475 1 433 . 1 . 1 105 105 ALA N N 15 119.608 0.3 . 1 . . . . . 105 ALA N . 52475 1 434 . 1 . 1 106 106 VAL H H 1 7.717 0.020 . 1 . . . . . 106 VAL H . 52475 1 435 . 1 . 1 106 106 VAL C C 13 178.026 0.3 . 1 . . . . . 106 VAL C . 52475 1 436 . 1 . 1 106 106 VAL CA C 13 64.663 0.3 . 1 . . . . . 106 VAL CA . 52475 1 437 . 1 . 1 106 106 VAL CB C 13 29.611 0.3 . 1 . . . . . 106 VAL CB . 52475 1 438 . 1 . 1 106 106 VAL N N 15 120.143 0.3 . 1 . . . . . 106 VAL N . 52475 1 439 . 1 . 1 107 107 LEU H H 1 8.594 0.020 . 1 . . . . . 107 LEU H . 52475 1 440 . 1 . 1 107 107 LEU C C 13 179.423 0.3 . 1 . . . . . 107 LEU C . 52475 1 441 . 1 . 1 107 107 LEU CA C 13 56.656 0.3 . 1 . . . . . 107 LEU CA . 52475 1 442 . 1 . 1 107 107 LEU CB C 13 41.265 0.3 . 1 . . . . . 107 LEU CB . 52475 1 443 . 1 . 1 107 107 LEU N N 15 119.299 0.3 . 1 . . . . . 107 LEU N . 52475 1 444 . 1 . 1 108 108 ASN H H 1 7.849 0.020 . 1 . . . . . 108 ASN H . 52475 1 445 . 1 . 1 108 108 ASN C C 13 177.789 0.3 . 1 . . . . . 108 ASN C . 52475 1 446 . 1 . 1 108 108 ASN CA C 13 56.478 0.3 . 1 . . . . . 108 ASN CA . 52475 1 447 . 1 . 1 108 108 ASN CB C 13 37.796 0.3 . 1 . . . . . 108 ASN CB . 52475 1 448 . 1 . 1 108 108 ASN N N 15 117.203 0.3 . 1 . . . . . 108 ASN N . 52475 1 449 . 1 . 1 109 109 GLY H H 1 7.537 0.020 . 1 . . . . . 109 GLY H . 52475 1 450 . 1 . 1 109 109 GLY C C 13 176.785 0.3 . 1 . . . . . 109 GLY C . 52475 1 451 . 1 . 1 109 109 GLY CA C 13 46.514 0.3 . 1 . . . . . 109 GLY CA . 52475 1 452 . 1 . 1 109 109 GLY N N 15 107.633 0.3 . 1 . . . . . 109 GLY N . 52475 1 453 . 1 . 1 110 110 TRP H H 1 8.343 0.020 . 1 . . . . . 110 TRP H . 52475 1 454 . 1 . 1 110 110 TRP C C 13 180.419 0.3 . 1 . . . . . 110 TRP C . 52475 1 455 . 1 . 1 110 110 TRP CA C 13 57.724 0.3 . 1 . . . . . 110 TRP CA . 52475 1 456 . 1 . 1 110 110 TRP CB C 13 28.098 0.3 . 1 . . . . . 110 TRP CB . 52475 1 457 . 1 . 1 110 110 TRP N N 15 123.537 0.3 . 1 . . . . . 110 TRP N . 52475 1 458 . 1 . 1 111 111 ARG H H 1 9.186 0.020 . 1 . . . . . 111 ARG H . 52475 1 459 . 1 . 1 111 111 ARG C C 13 177.039 0.3 . 1 . . . . . 111 ARG C . 52475 1 460 . 1 . 1 111 111 ARG CA C 13 59.770 0.3 . 1 . . . . . 111 ARG CA . 52475 1 461 . 1 . 1 111 111 ARG CB C 13 28.454 0.3 . 1 . . . . . 111 ARG CB . 52475 1 462 . 1 . 1 111 111 ARG N N 15 122.912 0.3 . 1 . . . . . 111 ARG N . 52475 1 463 . 1 . 1 112 112 GLN H H 1 7.833 0.020 . 1 . . . . . 112 GLN H . 52475 1 464 . 1 . 1 112 112 GLN C C 13 178.660 0.3 . 1 . . . . . 112 GLN C . 52475 1 465 . 1 . 1 112 112 GLN CA C 13 57.813 0.3 . 1 . . . . . 112 GLN CA . 52475 1 466 . 1 . 1 112 112 GLN CB C 13 27.653 0.3 . 1 . . . . . 112 GLN CB . 52475 1 467 . 1 . 1 112 112 GLN N N 15 118.043 0.3 . 1 . . . . . 112 GLN N . 52475 1 468 . 1 . 1 113 113 HIS H H 1 7.617 0.020 . 1 . . . . . 113 HIS H . 52475 1 469 . 1 . 1 113 113 HIS C C 13 177.551 0.3 . 1 . . . . . 113 HIS C . 52475 1 470 . 1 . 1 113 113 HIS CA C 13 58.791 0.3 . 1 . . . . . 113 HIS CA . 52475 1 471 . 1 . 1 113 113 HIS CB C 13 30.144 0.3 . 1 . . . . . 113 HIS CB . 52475 1 472 . 1 . 1 113 113 HIS N N 15 118.182 0.3 . 1 . . . . . 113 HIS N . 52475 1 473 . 1 . 1 114 114 PHE H H 1 8.078 0.020 . 1 . . . . . 114 PHE H . 52475 1 474 . 1 . 1 114 114 PHE C C 13 177.760 0.3 . 1 . . . . . 114 PHE C . 52475 1 475 . 1 . 1 114 114 PHE CA C 13 61.816 0.3 . 1 . . . . . 114 PHE CA . 52475 1 476 . 1 . 1 114 114 PHE CB C 13 38.952 0.3 . 1 . . . . . 114 PHE CB . 52475 1 477 . 1 . 1 114 114 PHE N N 15 121.519 0.3 . 1 . . . . . 114 PHE N . 52475 1 478 . 1 . 1 115 115 ILE H H 1 8.511 0.020 . 1 . . . . . 115 ILE H . 52475 1 479 . 1 . 1 115 115 ILE C C 13 177.535 0.3 . 1 . . . . . 115 ILE C . 52475 1 480 . 1 . 1 115 115 ILE CA C 13 64.129 0.3 . 1 . . . . . 115 ILE CA . 52475 1 481 . 1 . 1 115 115 ILE CB C 13 36.639 0.3 . 1 . . . . . 115 ILE CB . 52475 1 482 . 1 . 1 115 115 ILE N N 15 116.220 0.3 . 1 . . . . . 115 ILE N . 52475 1 483 . 1 . 1 116 116 SER H H 1 7.305 0.020 . 1 . . . . . 116 SER H . 52475 1 484 . 1 . 1 116 116 SER C C 13 177.513 0.3 . 1 . . . . . 116 SER C . 52475 1 485 . 1 . 1 116 116 SER CA C 13 60.571 0.3 . 1 . . . . . 116 SER CA . 52475 1 486 . 1 . 1 116 116 SER CB C 13 61.905 0.3 . 1 . . . . . 116 SER CB . 52475 1 487 . 1 . 1 116 116 SER N N 15 115.643 0.3 . 1 . . . . . 116 SER N . 52475 1 488 . 1 . 1 117 117 PHE H H 1 7.126 0.020 . 1 . . . . . 117 PHE H . 52475 1 489 . 1 . 1 117 117 PHE C C 13 175.919 0.3 . 1 . . . . . 117 PHE C . 52475 1 490 . 1 . 1 117 117 PHE CA C 13 58.257 0.3 . 1 . . . . . 117 PHE CA . 52475 1 491 . 1 . 1 117 117 PHE CB C 13 39.041 0.3 . 1 . . . . . 117 PHE CB . 52475 1 492 . 1 . 1 117 117 PHE N N 15 118.607 0.3 . 1 . . . . . 117 PHE N . 52475 1 493 . 1 . 1 118 118 ASP H H 1 7.798 0.020 . 1 . . . . . 118 ASP H . 52475 1 494 . 1 . 1 118 118 ASP C C 13 178.007 0.3 . 1 . . . . . 118 ASP C . 52475 1 495 . 1 . 1 118 118 ASP CA C 13 51.763 0.3 . 1 . . . . . 118 ASP CA . 52475 1 496 . 1 . 1 118 118 ASP CB C 13 38.863 0.3 . 1 . . . . . 118 ASP CB . 52475 1 497 . 1 . 1 118 118 ASP N N 15 122.549 0.3 . 1 . . . . . 118 ASP N . 52475 1 498 . 1 . 1 119 119 THR H H 1 7.963 0.020 . 1 . . . . . 119 THR H . 52475 1 499 . 1 . 1 119 119 THR C C 13 175.881 0.3 . 1 . . . . . 119 THR C . 52475 1 500 . 1 . 1 119 119 THR CA C 13 64.663 0.3 . 1 . . . . . 119 THR CA . 52475 1 501 . 1 . 1 119 119 THR CB C 13 68.044 0.3 . 1 . . . . . 119 THR CB . 52475 1 502 . 1 . 1 119 119 THR N N 15 117.063 0.3 . 1 . . . . . 119 THR N . 52475 1 503 . 1 . 1 120 120 ASP H H 1 8.469 0.020 . 1 . . . . . 120 ASP H . 52475 1 504 . 1 . 1 120 120 ASP C C 13 175.387 0.3 . 1 . . . . . 120 ASP C . 52475 1 505 . 1 . 1 120 120 ASP CA C 13 52.920 0.3 . 1 . . . . . 120 ASP CA . 52475 1 506 . 1 . 1 120 120 ASP CB C 13 39.041 0.3 . 1 . . . . . 120 ASP CB . 52475 1 507 . 1 . 1 120 120 ASP N N 15 119.427 0.3 . 1 . . . . . 120 ASP N . 52475 1 508 . 1 . 1 121 121 ARG H H 1 7.937 0.020 . 1 . . . . . 121 ARG H . 52475 1 509 . 1 . 1 121 121 ARG C C 13 176.279 0.3 . 1 . . . . . 121 ARG C . 52475 1 510 . 1 . 1 121 121 ARG CA C 13 55.855 0.3 . 1 . . . . . 121 ARG CA . 52475 1 511 . 1 . 1 121 121 ARG CB C 13 25.518 0.3 . 1 . . . . . 121 ARG CB . 52475 1 512 . 1 . 1 121 121 ARG N N 15 118.048 0.3 . 1 . . . . . 121 ARG N . 52475 1 513 . 1 . 1 122 122 SER H H 1 9.870 0.020 . 1 . . . . . 122 SER H . 52475 1 514 . 1 . 1 122 122 SER C C 13 175.786 0.3 . 1 . . . . . 122 SER C . 52475 1 515 . 1 . 1 122 122 SER CA C 13 58.969 0.3 . 1 . . . . . 122 SER CA . 52475 1 516 . 1 . 1 122 122 SER CB C 13 64.752 0.3 . 1 . . . . . 122 SER CB . 52475 1 517 . 1 . 1 122 122 SER N N 15 118.449 0.3 . 1 . . . . . 122 SER N . 52475 1 518 . 1 . 1 123 123 GLY H H 1 7.635 0.020 . 1 . . . . . 123 GLY H . 52475 1 519 . 1 . 1 123 123 GLY C C 13 173.668 0.3 . 1 . . . . . 123 GLY C . 52475 1 520 . 1 . 1 123 123 GLY CA C 13 44.913 0.3 . 1 . . . . . 123 GLY CA . 52475 1 521 . 1 . 1 123 123 GLY N N 15 115.227 0.3 . 1 . . . . . 123 GLY N . 52475 1 522 . 1 . 1 124 124 THR H H 1 7.545 0.020 . 1 . . . . . 124 THR H . 52475 1 523 . 1 . 1 124 124 THR C C 13 172.236 0.3 . 1 . . . . . 124 THR C . 52475 1 524 . 1 . 1 124 124 THR CA C 13 58.791 0.3 . 1 . . . . . 124 THR CA . 52475 1 525 . 1 . 1 124 124 THR CB C 13 72.403 0.3 . 1 . . . . . 124 THR CB . 52475 1 526 . 1 . 1 124 124 THR N N 15 109.477 0.3 . 1 . . . . . 124 THR N . 52475 1 527 . 1 . 1 125 125 VAL H H 1 8.565 0.020 . 1 . . . . . 125 VAL H . 52475 1 528 . 1 . 1 125 125 VAL C C 13 174.647 0.3 . 1 . . . . . 125 VAL C . 52475 1 529 . 1 . 1 125 125 VAL CA C 13 58.302 0.3 . 1 . . . . . 125 VAL CA . 52475 1 530 . 1 . 1 125 125 VAL CB C 13 34.237 0.3 . 1 . . . . . 125 VAL CB . 52475 1 531 . 1 . 1 125 125 VAL N N 15 111.713 0.3 . 1 . . . . . 125 VAL N . 52475 1 532 . 1 . 1 126 126 ASP H H 1 8.675 0.020 . 1 . . . . . 126 ASP H . 52475 1 533 . 1 . 1 126 126 ASP C C 13 175.881 0.3 . 1 . . . . . 126 ASP C . 52475 1 534 . 1 . 1 126 126 ASP CA C 13 51.852 0.3 . 1 . . . . . 126 ASP CA . 52475 1 535 . 1 . 1 126 126 ASP CB C 13 41.265 0.3 . 1 . . . . . 126 ASP CB . 52475 1 536 . 1 . 1 126 126 ASP N N 15 123.941 0.3 . 1 . . . . . 126 ASP N . 52475 1 537 . 1 . 1 128 128 GLN H H 1 8.832 0.020 . 1 . . . . . 128 GLN H . 52475 1 538 . 1 . 1 128 128 GLN C C 13 178.406 0.3 . 1 . . . . . 128 GLN C . 52475 1 539 . 1 . 1 128 128 GLN CA C 13 57.635 0.3 . 1 . . . . . 128 GLN CA . 52475 1 540 . 1 . 1 128 128 GLN CB C 13 27.298 0.3 . 1 . . . . . 128 GLN CB . 52475 1 541 . 1 . 1 128 128 GLN N N 15 117.033 0.3 . 1 . . . . . 128 GLN N . 52475 1 542 . 1 . 1 129 129 GLU H H 1 7.875 0.020 . 1 . . . . . 129 GLU H . 52475 1 543 . 1 . 1 129 129 GLU C C 13 176.863 0.3 . 1 . . . . . 129 GLU C . 52475 1 544 . 1 . 1 129 129 GLU CA C 13 56.656 0.3 . 1 . . . . . 129 GLU CA . 52475 1 545 . 1 . 1 129 129 GLU CB C 13 27.742 0.3 . 1 . . . . . 129 GLU CB . 52475 1 546 . 1 . 1 129 129 GLU N N 15 119.928 0.3 . 1 . . . . . 129 GLU N . 52475 1 547 . 1 . 1 130 130 LEU H H 1 7.528 0.020 . 1 . . . . . 130 LEU H . 52475 1 548 . 1 . 1 130 130 LEU C C 13 177.532 0.3 . 1 . . . . . 130 LEU C . 52475 1 549 . 1 . 1 130 130 LEU CA C 13 57.101 0.3 . 1 . . . . . 130 LEU CA . 52475 1 550 . 1 . 1 130 130 LEU CB C 13 40.731 0.3 . 1 . . . . . 130 LEU CB . 52475 1 551 . 1 . 1 130 130 LEU N N 15 119.861 0.3 . 1 . . . . . 130 LEU N . 52475 1 552 . 1 . 1 131 131 GLN H H 1 7.946 0.020 . 1 . . . . . 131 GLN H . 52475 1 553 . 1 . 1 131 131 GLN C C 13 178.188 0.3 . 1 . . . . . 131 GLN C . 52475 1 554 . 1 . 1 131 131 GLN CA C 13 59.414 0.3 . 1 . . . . . 131 GLN CA . 52475 1 555 . 1 . 1 131 131 GLN CB C 13 26.586 0.3 . 1 . . . . . 131 GLN CB . 52475 1 556 . 1 . 1 131 131 GLN N N 15 117.419 0.3 . 1 . . . . . 131 GLN N . 52475 1 557 . 1 . 1 132 132 LYS H H 1 7.552 0.020 . 1 . . . . . 132 LYS H . 52475 1 558 . 1 . 1 132 132 LYS C C 13 179.051 0.3 . 1 . . . . . 132 LYS C . 52475 1 559 . 1 . 1 132 132 LYS CA C 13 58.880 0.3 . 1 . . . . . 132 LYS CA . 52475 1 560 . 1 . 1 132 132 LYS CB C 13 31.390 0.3 . 1 . . . . . 132 LYS CB . 52475 1 561 . 1 . 1 132 132 LYS N N 15 120.871 0.3 . 1 . . . . . 132 LYS N . 52475 1 562 . 1 . 1 133 133 ALA H H 1 8.219 0.020 . 1 . . . . . 133 ALA H . 52475 1 563 . 1 . 1 133 133 ALA C C 13 179.298 0.3 . 1 . . . . . 133 ALA C . 52475 1 564 . 1 . 1 133 133 ALA CA C 13 54.788 0.3 . 1 . . . . . 133 ALA CA . 52475 1 565 . 1 . 1 133 133 ALA CB C 13 16.266 0.3 . 1 . . . . . 133 ALA CB . 52475 1 566 . 1 . 1 133 133 ALA N N 15 124.345 0.3 . 1 . . . . . 133 ALA N . 52475 1 567 . 1 . 1 134 134 LEU H H 1 8.492 0.020 . 1 . . . . . 134 LEU H . 52475 1 568 . 1 . 1 134 134 LEU C C 13 179.532 0.3 . 1 . . . . . 134 LEU C . 52475 1 569 . 1 . 1 134 134 LEU CA C 13 57.635 0.3 . 1 . . . . . 134 LEU CA . 52475 1 570 . 1 . 1 134 134 LEU CB C 13 40.020 0.3 . 1 . . . . . 134 LEU CB . 52475 1 571 . 1 . 1 134 134 LEU N N 15 116.173 0.3 . 1 . . . . . 134 LEU N . 52475 1 572 . 1 . 1 135 135 THR H H 1 7.889 0.020 . 1 . . . . . 135 THR H . 52475 1 573 . 1 . 1 135 135 THR C C 13 178.880 0.3 . 1 . . . . . 135 THR C . 52475 1 574 . 1 . 1 135 135 THR CA C 13 65.731 0.3 . 1 . . . . . 135 THR CA . 52475 1 575 . 1 . 1 135 135 THR CB C 13 68.222 0.3 . 1 . . . . . 135 THR CB . 52475 1 576 . 1 . 1 135 135 THR N N 15 114.652 0.3 . 1 . . . . . 135 THR N . 52475 1 577 . 1 . 1 136 136 THR H H 1 8.177 0.020 . 1 . . . . . 136 THR H . 52475 1 578 . 1 . 1 136 136 THR C C 13 175.672 0.3 . 1 . . . . . 136 THR C . 52475 1 579 . 1 . 1 136 136 THR CA C 13 65.375 0.3 . 1 . . . . . 136 THR CA . 52475 1 580 . 1 . 1 136 136 THR CB C 13 68.222 0.3 . 1 . . . . . 136 THR CB . 52475 1 581 . 1 . 1 136 136 THR N N 15 119.593 0.3 . 1 . . . . . 136 THR N . 52475 1 582 . 1 . 1 137 137 MET H H 1 7.573 0.020 . 1 . . . . . 137 MET H . 52475 1 583 . 1 . 1 137 137 MET C C 13 175.646 0.3 . 1 . . . . . 137 MET C . 52475 1 584 . 1 . 1 137 137 MET CA C 13 55.944 0.3 . 1 . . . . . 137 MET CA . 52475 1 585 . 1 . 1 137 137 MET CB C 13 33.080 0.3 . 1 . . . . . 137 MET CB . 52475 1 586 . 1 . 1 137 137 MET N N 15 118.609 0.3 . 1 . . . . . 137 MET N . 52475 1 587 . 1 . 1 138 138 GLY H H 1 7.517 0.020 . 1 . . . . . 138 GLY H . 52475 1 588 . 1 . 1 138 138 GLY C C 13 174.286 0.3 . 1 . . . . . 138 GLY C . 52475 1 589 . 1 . 1 138 138 GLY CA C 13 44.254 0.3 . 1 . . . . . 138 GLY CA . 52475 1 590 . 1 . 1 138 138 GLY N N 15 105.948 0.3 . 1 . . . . . 138 GLY N . 52475 1 591 . 1 . 1 139 139 PHE H H 1 7.710 0.020 . 1 . . . . . 139 PHE H . 52475 1 592 . 1 . 1 139 139 PHE C C 13 175.406 0.3 . 1 . . . . . 139 PHE C . 52475 1 593 . 1 . 1 139 139 PHE CA C 13 57.190 0.3 . 1 . . . . . 139 PHE CA . 52475 1 594 . 1 . 1 139 139 PHE CB C 13 37.884 0.3 . 1 . . . . . 139 PHE CB . 52475 1 595 . 1 . 1 139 139 PHE N N 15 119.866 0.3 . 1 . . . . . 139 PHE N . 52475 1 596 . 1 . 1 140 140 ARG H H 1 8.771 0.020 . 1 . . . . . 140 ARG H . 52475 1 597 . 1 . 1 140 140 ARG C C 13 174.552 0.3 . 1 . . . . . 140 ARG C . 52475 1 598 . 1 . 1 140 140 ARG CA C 13 54.076 0.3 . 1 . . . . . 140 ARG CA . 52475 1 599 . 1 . 1 140 140 ARG CB C 13 28.454 0.3 . 1 . . . . . 140 ARG CB . 52475 1 600 . 1 . 1 140 140 ARG N N 15 126.325 0.3 . 1 . . . . . 140 ARG N . 52475 1 601 . 1 . 1 141 141 LEU H H 1 7.982 0.020 . 1 . . . . . 141 LEU H . 52475 1 602 . 1 . 1 141 141 LEU C C 13 176.147 0.3 . 1 . . . . . 141 LEU C . 52475 1 603 . 1 . 1 141 141 LEU CA C 13 51.941 0.3 . 1 . . . . . 141 LEU CA . 52475 1 604 . 1 . 1 141 141 LEU CB C 13 44.824 0.3 . 1 . . . . . 141 LEU CB . 52475 1 605 . 1 . 1 141 141 LEU N N 15 125.192 0.3 . 1 . . . . . 141 LEU N . 52475 1 606 . 1 . 1 142 142 SER H H 1 9.319 0.020 . 1 . . . . . 142 SER H . 52475 1 607 . 1 . 1 142 142 SER C C 13 172.938 0.3 . 1 . . . . . 142 SER C . 52475 1 608 . 1 . 1 142 142 SER CA C 13 56.478 0.3 . 1 . . . . . 142 SER CA . 52475 1 609 . 1 . 1 142 142 SER CB C 13 61.460 0.3 . 1 . . . . . 142 SER CB . 52475 1 610 . 1 . 1 142 142 SER N N 15 121.240 0.3 . 1 . . . . . 142 SER N . 52475 1 611 . 1 . 1 144 144 GLN H H 1 8.112 0.020 . 1 . . . . . 144 GLN H . 52475 1 612 . 1 . 1 144 144 GLN C C 13 178.558 0.3 . 1 . . . . . 144 GLN C . 52475 1 613 . 1 . 1 144 144 GLN CA C 13 58.524 0.3 . 1 . . . . . 144 GLN CA . 52475 1 614 . 1 . 1 144 144 GLN CB C 13 26.586 0.3 . 1 . . . . . 144 GLN CB . 52475 1 615 . 1 . 1 144 144 GLN N N 15 116.344 0.3 . 1 . . . . . 144 GLN N . 52475 1 616 . 1 . 1 145 145 ALA H H 1 8.033 0.020 . 1 . . . . . 145 ALA H . 52475 1 617 . 1 . 1 145 145 ALA C C 13 179.507 0.3 . 1 . . . . . 145 ALA C . 52475 1 618 . 1 . 1 145 145 ALA CA C 13 54.877 0.3 . 1 . . . . . 145 ALA CA . 52475 1 619 . 1 . 1 145 145 ALA CB C 13 17.334 0.3 . 1 . . . . . 145 ALA CB . 52475 1 620 . 1 . 1 145 145 ALA N N 15 124.782 0.3 . 1 . . . . . 145 ALA N . 52475 1 621 . 1 . 1 146 146 VAL H H 1 8.120 0.020 . 1 . . . . . 146 VAL H . 52475 1 622 . 1 . 1 146 146 VAL C C 13 177.153 0.3 . 1 . . . . . 146 VAL C . 52475 1 623 . 1 . 1 146 146 VAL CA C 13 66.531 0.3 . 1 . . . . . 146 VAL CA . 52475 1 624 . 1 . 1 146 146 VAL CB C 13 29.611 0.3 . 1 . . . . . 146 VAL CB . 52475 1 625 . 1 . 1 146 146 VAL N N 15 116.909 0.3 . 1 . . . . . 146 VAL N . 52475 1 626 . 1 . 1 147 147 ASN H H 1 8.161 0.020 . 1 . . . . . 147 ASN H . 52475 1 627 . 1 . 1 147 147 ASN C C 13 177.513 0.3 . 1 . . . . . 147 ASN C . 52475 1 628 . 1 . 1 147 147 ASN CA C 13 55.855 0.3 . 1 . . . . . 147 ASN CA . 52475 1 629 . 1 . 1 147 147 ASN CB C 13 37.796 0.3 . 1 . . . . . 147 ASN CB . 52475 1 630 . 1 . 1 147 147 ASN N N 15 119.023 0.3 . 1 . . . . . 147 ASN N . 52475 1 631 . 1 . 1 148 148 SER H H 1 7.615 0.020 . 1 . . . . . 148 SER H . 52475 1 632 . 1 . 1 148 148 SER C C 13 175.881 0.3 . 1 . . . . . 148 SER C . 52475 1 633 . 1 . 1 148 148 SER CA C 13 61.193 0.3 . 1 . . . . . 148 SER CA . 52475 1 634 . 1 . 1 148 148 SER CB C 13 62.973 0.3 . 1 . . . . . 148 SER CB . 52475 1 635 . 1 . 1 148 148 SER N N 15 115.831 0.3 . 1 . . . . . 148 SER N . 52475 1 636 . 1 . 1 149 149 ILE H H 1 7.663 0.020 . 1 . . . . . 149 ILE H . 52475 1 637 . 1 . 1 149 149 ILE C C 13 176.906 0.3 . 1 . . . . . 149 ILE C . 52475 1 638 . 1 . 1 149 149 ILE CA C 13 64.752 0.3 . 1 . . . . . 149 ILE CA . 52475 1 639 . 1 . 1 149 149 ILE CB C 13 37.440 0.3 . 1 . . . . . 149 ILE CB . 52475 1 640 . 1 . 1 149 149 ILE N N 15 122.959 0.3 . 1 . . . . . 149 ILE N . 52475 1 641 . 1 . 1 150 150 ALA H H 1 8.516 0.020 . 1 . . . . . 150 ALA H . 52475 1 642 . 1 . 1 150 150 ALA C C 13 179.768 0.3 . 1 . . . . . 150 ALA C . 52475 1 643 . 1 . 1 150 150 ALA CA C 13 54.254 0.3 . 1 . . . . . 150 ALA CA . 52475 1 644 . 1 . 1 150 150 ALA CB C 13 16.800 0.3 . 1 . . . . . 150 ALA CB . 52475 1 645 . 1 . 1 150 150 ALA N N 15 120.686 0.3 . 1 . . . . . 150 ALA N . 52475 1 646 . 1 . 1 151 151 LYS H H 1 7.616 0.020 . 1 . . . . . 151 LYS H . 52475 1 647 . 1 . 1 151 151 LYS C C 13 178.569 0.3 . 1 . . . . . 151 LYS C . 52475 1 648 . 1 . 1 151 151 LYS CA C 13 57.635 0.3 . 1 . . . . . 151 LYS CA . 52475 1 649 . 1 . 1 151 151 LYS CB C 13 30.767 0.3 . 1 . . . . . 151 LYS CB . 52475 1 650 . 1 . 1 151 151 LYS N N 15 116.190 0.3 . 1 . . . . . 151 LYS N . 52475 1 651 . 1 . 1 152 152 ARG H H 1 7.443 0.020 . 1 . . . . . 152 ARG H . 52475 1 652 . 1 . 1 152 152 ARG C C 13 177.408 0.3 . 1 . . . . . 152 ARG C . 52475 1 653 . 1 . 1 152 152 ARG CA C 13 57.012 0.3 . 1 . . . . . 152 ARG CA . 52475 1 654 . 1 . 1 152 152 ARG CB C 13 28.454 0.3 . 1 . . . . . 152 ARG CB . 52475 1 655 . 1 . 1 152 152 ARG N N 15 120.856 0.3 . 1 . . . . . 152 ARG N . 52475 1 656 . 1 . 1 153 153 TYR H H 1 7.505 0.020 . 1 . . . . . 153 TYR H . 52475 1 657 . 1 . 1 153 153 TYR C C 13 173.904 0.3 . 1 . . . . . 153 TYR C . 52475 1 658 . 1 . 1 153 153 TYR CA C 13 58.346 0.3 . 1 . . . . . 153 TYR CA . 52475 1 659 . 1 . 1 153 153 TYR CB C 13 37.173 0.3 . 1 . . . . . 153 TYR CB . 52475 1 660 . 1 . 1 153 153 TYR N N 15 114.535 0.3 . 1 . . . . . 153 TYR N . 52475 1 661 . 1 . 1 154 154 SER H H 1 7.077 0.020 . 1 . . . . . 154 SER H . 52475 1 662 . 1 . 1 154 154 SER C C 13 174.666 0.3 . 1 . . . . . 154 SER C . 52475 1 663 . 1 . 1 154 154 SER CA C 13 58.346 0.3 . 1 . . . . . 154 SER CA . 52475 1 664 . 1 . 1 154 154 SER CB C 13 64.752 0.3 . 1 . . . . . 154 SER CB . 52475 1 665 . 1 . 1 154 154 SER N N 15 114.072 0.3 . 1 . . . . . 154 SER N . 52475 1 666 . 1 . 1 155 155 THR H H 1 9.593 0.020 . 1 . . . . . 155 THR H . 52475 1 667 . 1 . 1 155 155 THR C C 13 175.591 0.3 . 1 . . . . . 155 THR C . 52475 1 668 . 1 . 1 155 155 THR CA C 13 61.193 0.3 . 1 . . . . . 155 THR CA . 52475 1 669 . 1 . 1 155 155 THR CB C 13 69.378 0.3 . 1 . . . . . 155 THR CB . 52475 1 670 . 1 . 1 155 155 THR N N 15 121.123 0.3 . 1 . . . . . 155 THR N . 52475 1 671 . 1 . 1 156 156 ASN H H 1 9.671 0.020 . 1 . . . . . 156 ASN H . 52475 1 672 . 1 . 1 156 156 ASN C C 13 175.392 0.3 . 1 . . . . . 156 ASN C . 52475 1 673 . 1 . 1 156 156 ASN CA C 13 54.076 0.3 . 1 . . . . . 156 ASN CA . 52475 1 674 . 1 . 1 156 156 ASN CB C 13 37.173 0.3 . 1 . . . . . 156 ASN CB . 52475 1 675 . 1 . 1 156 156 ASN N N 15 127.197 0.3 . 1 . . . . . 156 ASN N . 52475 1 676 . 1 . 1 157 157 GLY H H 1 8.483 0.020 . 1 . . . . . 157 GLY H . 52475 1 677 . 1 . 1 157 157 GLY C C 13 173.177 0.3 . 1 . . . . . 157 GLY C . 52475 1 678 . 1 . 1 157 157 GLY CA C 13 44.811 0.3 . 1 . . . . . 157 GLY CA . 52475 1 679 . 1 . 1 157 157 GLY N N 15 102.847 0.3 . 1 . . . . . 157 GLY N . 52475 1 680 . 1 . 1 158 158 LYS H H 1 7.525 0.020 . 1 . . . . . 158 LYS H . 52475 1 681 . 1 . 1 158 158 LYS C C 13 174.058 0.3 . 1 . . . . . 158 LYS C . 52475 1 682 . 1 . 1 158 158 LYS CA C 13 53.542 0.3 . 1 . . . . . 158 LYS CA . 52475 1 683 . 1 . 1 158 158 LYS CB C 13 35.482 0.3 . 1 . . . . . 158 LYS CB . 52475 1 684 . 1 . 1 158 158 LYS N N 15 117.755 0.3 . 1 . . . . . 158 LYS N . 52475 1 685 . 1 . 1 159 159 ILE H H 1 8.908 0.020 . 1 . . . . . 159 ILE H . 52475 1 686 . 1 . 1 159 159 ILE C C 13 176.526 0.3 . 1 . . . . . 159 ILE C . 52475 1 687 . 1 . 1 159 159 ILE CA C 13 59.147 0.3 . 1 . . . . . 159 ILE CA . 52475 1 688 . 1 . 1 159 159 ILE CB C 13 37.262 0.3 . 1 . . . . . 159 ILE CB . 52475 1 689 . 1 . 1 159 159 ILE N N 15 120.584 0.3 . 1 . . . . . 159 ILE N . 52475 1 690 . 1 . 1 160 160 THR H H 1 9.208 0.020 . 1 . . . . . 160 THR H . 52475 1 691 . 1 . 1 160 160 THR C C 13 174.932 0.3 . 1 . . . . . 160 THR C . 52475 1 692 . 1 . 1 160 160 THR CA C 13 61.104 0.3 . 1 . . . . . 160 THR CA . 52475 1 693 . 1 . 1 160 160 THR CB C 13 70.624 0.3 . 1 . . . . . 160 THR CB . 52475 1 694 . 1 . 1 160 160 THR N N 15 118.486 0.3 . 1 . . . . . 160 THR N . 52475 1 695 . 1 . 1 161 161 PHE H H 1 7.408 0.020 . 1 . . . . . 161 PHE H . 52475 1 696 . 1 . 1 161 161 PHE C C 13 175.539 0.3 . 1 . . . . . 161 PHE C . 52475 1 697 . 1 . 1 161 161 PHE CA C 13 60.660 0.3 . 1 . . . . . 161 PHE CA . 52475 1 698 . 1 . 1 161 161 PHE CB C 13 37.262 0.3 . 1 . . . . . 161 PHE CB . 52475 1 699 . 1 . 1 161 161 PHE N N 15 120.003 0.3 . 1 . . . . . 161 PHE N . 52475 1 700 . 1 . 1 162 162 ASP H H 1 8.174 0.020 . 1 . . . . . 162 ASP H . 52475 1 701 . 1 . 1 162 162 ASP C C 13 176.602 0.3 . 1 . . . . . 162 ASP C . 52475 1 702 . 1 . 1 162 162 ASP CA C 13 57.635 0.3 . 1 . . . . . 162 ASP CA . 52475 1 703 . 1 . 1 162 162 ASP CB C 13 41.977 0.3 . 1 . . . . . 162 ASP CB . 52475 1 704 . 1 . 1 162 162 ASP N N 15 117.051 0.3 . 1 . . . . . 162 ASP N . 52475 1 705 . 1 . 1 163 163 ASP H H 1 7.230 0.020 . 1 . . . . . 163 ASP H . 52475 1 706 . 1 . 1 163 163 ASP C C 13 177.020 0.3 . 1 . . . . . 163 ASP C . 52475 1 707 . 1 . 1 163 163 ASP CA C 13 57.012 0.3 . 1 . . . . . 163 ASP CA . 52475 1 708 . 1 . 1 163 163 ASP CB C 13 40.020 0.3 . 1 . . . . . 163 ASP CB . 52475 1 709 . 1 . 1 163 163 ASP N N 15 116.768 0.3 . 1 . . . . . 163 ASP N . 52475 1 710 . 1 . 1 164 164 TYR H H 1 8.649 0.020 . 1 . . . . . 164 TYR H . 52475 1 711 . 1 . 1 164 164 TYR C C 13 176.412 0.3 . 1 . . . . . 164 TYR C . 52475 1 712 . 1 . 1 164 164 TYR CA C 13 60.126 0.3 . 1 . . . . . 164 TYR CA . 52475 1 713 . 1 . 1 164 164 TYR CB C 13 37.351 0.3 . 1 . . . . . 164 TYR CB . 52475 1 714 . 1 . 1 164 164 TYR N N 15 121.825 0.3 . 1 . . . . . 164 TYR N . 52475 1 715 . 1 . 1 165 165 ILE H H 1 7.950 0.020 . 1 . . . . . 165 ILE H . 52475 1 716 . 1 . 1 165 165 ILE C C 13 173.925 0.3 . 1 . . . . . 165 ILE C . 52475 1 717 . 1 . 1 165 165 ILE CA C 13 60.126 0.3 . 1 . . . . . 165 ILE CA . 52475 1 718 . 1 . 1 165 165 ILE CB C 13 38.418 0.3 . 1 . . . . . 165 ILE CB . 52475 1 719 . 1 . 1 165 165 ILE N N 15 120.065 0.3 . 1 . . . . . 165 ILE N . 52475 1 720 . 1 . 1 166 166 ALA H H 1 8.277 0.020 . 1 . . . . . 166 ALA H . 52475 1 721 . 1 . 1 166 166 ALA C C 13 178.515 0.3 . 1 . . . . . 166 ALA C . 52475 1 722 . 1 . 1 166 166 ALA CA C 13 55.411 0.3 . 1 . . . . . 166 ALA CA . 52475 1 723 . 1 . 1 166 166 ALA CB C 13 17.296 0.3 . 1 . . . . . 166 ALA CB . 52475 1 724 . 1 . 1 166 166 ALA N N 15 122.595 0.3 . 1 . . . . . 166 ALA N . 52475 1 725 . 1 . 1 167 167 CYS H H 1 7.807 0.020 . 1 . . . . . 167 CYS H . 52475 1 726 . 1 . 1 167 167 CYS C C 13 175.410 0.3 . 1 . . . . . 167 CYS C . 52475 1 727 . 1 . 1 167 167 CYS CA C 13 56.033 0.3 . 1 . . . . . 167 CYS CA . 52475 1 728 . 1 . 1 167 167 CYS CB C 13 24.807 0.3 . 1 . . . . . 167 CYS CB . 52475 1 729 . 1 . 1 167 167 CYS N N 15 116.355 0.3 . 1 . . . . . 167 CYS N . 52475 1 730 . 1 . 1 168 168 CYS H H 1 7.242 0.020 . 1 . . . . . 168 CYS H . 52475 1 731 . 1 . 1 168 168 CYS C C 13 176.166 0.3 . 1 . . . . . 168 CYS C . 52475 1 732 . 1 . 1 168 168 CYS CA C 13 63.684 0.3 . 1 . . . . . 168 CYS CA . 52475 1 733 . 1 . 1 168 168 CYS CB C 13 24.807 0.3 . 1 . . . . . 168 CYS CB . 52475 1 734 . 1 . 1 168 168 CYS N N 15 117.755 0.3 . 1 . . . . . 168 CYS N . 52475 1 735 . 1 . 1 169 169 VAL H H 1 8.267 0.020 . 1 . . . . . 169 VAL H . 52475 1 736 . 1 . 1 169 169 VAL C C 13 177.305 0.3 . 1 . . . . . 169 VAL C . 52475 1 737 . 1 . 1 169 169 VAL CA C 13 64.752 0.3 . 1 . . . . . 169 VAL CA . 52475 1 738 . 1 . 1 169 169 VAL CB C 13 30.233 0.3 . 1 . . . . . 169 VAL CB . 52475 1 739 . 1 . 1 169 169 VAL N N 15 119.570 0.3 . 1 . . . . . 169 VAL N . 52475 1 740 . 1 . 1 170 170 LYS H H 1 8.104 0.020 . 1 . . . . . 170 LYS H . 52475 1 741 . 1 . 1 170 170 LYS C C 13 178.140 0.3 . 1 . . . . . 170 LYS C . 52475 1 742 . 1 . 1 170 170 LYS CA C 13 60.126 0.3 . 1 . . . . . 170 LYS CA . 52475 1 743 . 1 . 1 170 170 LYS CB C 13 31.924 0.3 . 1 . . . . . 170 LYS CB . 52475 1 744 . 1 . 1 170 170 LYS N N 15 120.134 0.3 . 1 . . . . . 170 LYS N . 52475 1 745 . 1 . 1 171 171 LEU H H 1 8.439 0.020 . 1 . . . . . 171 LEU H . 52475 1 746 . 1 . 1 171 171 LEU C C 13 180.912 0.3 . 1 . . . . . 171 LEU C . 52475 1 747 . 1 . 1 171 171 LEU CA C 13 57.190 0.3 . 1 . . . . . 171 LEU CA . 52475 1 748 . 1 . 1 171 171 LEU CB C 13 40.820 0.3 . 1 . . . . . 171 LEU CB . 52475 1 749 . 1 . 1 171 171 LEU N N 15 118.881 0.3 . 1 . . . . . 171 LEU N . 52475 1 750 . 1 . 1 172 172 ARG H H 1 8.348 0.020 . 1 . . . . . 172 ARG H . 52475 1 751 . 1 . 1 172 172 ARG C C 13 177.779 0.3 . 1 . . . . . 172 ARG C . 52475 1 752 . 1 . 1 172 172 ARG CA C 13 58.969 0.3 . 1 . . . . . 172 ARG CA . 52475 1 753 . 1 . 1 172 172 ARG CB C 13 28.543 0.3 . 1 . . . . . 172 ARG CB . 52475 1 754 . 1 . 1 172 172 ARG N N 15 124.083 0.3 . 1 . . . . . 172 ARG N . 52475 1 755 . 1 . 1 173 173 ALA H H 1 8.812 0.020 . 1 . . . . . 173 ALA H . 52475 1 756 . 1 . 1 173 173 ALA C C 13 181.671 0.3 . 1 . . . . . 173 ALA C . 52475 1 757 . 1 . 1 173 173 ALA CA C 13 54.165 0.3 . 1 . . . . . 173 ALA CA . 52475 1 758 . 1 . 1 173 173 ALA CB C 13 17.867 0.3 . 1 . . . . . 173 ALA CB . 52475 1 759 . 1 . 1 173 173 ALA N N 15 122.263 0.3 . 1 . . . . . 173 ALA N . 52475 1 760 . 1 . 1 174 174 LEU H H 1 9.147 0.020 . 1 . . . . . 174 LEU H . 52475 1 761 . 1 . 1 174 174 LEU C C 13 179.564 0.3 . 1 . . . . . 174 LEU C . 52475 1 762 . 1 . 1 174 174 LEU CA C 13 57.101 0.3 . 1 . . . . . 174 LEU CA . 52475 1 763 . 1 . 1 174 174 LEU CB C 13 40.731 0.3 . 1 . . . . . 174 LEU CB . 52475 1 764 . 1 . 1 174 174 LEU N N 15 118.580 0.3 . 1 . . . . . 174 LEU N . 52475 1 765 . 1 . 1 175 175 THR H H 1 8.233 0.020 . 1 . . . . . 175 THR H . 52475 1 766 . 1 . 1 175 175 THR C C 13 175.653 0.3 . 1 . . . . . 175 THR C . 52475 1 767 . 1 . 1 175 175 THR CA C 13 68.222 0.3 . 1 . . . . . 175 THR CA . 52475 1 768 . 1 . 1 175 175 THR N N 15 118.331 0.3 . 1 . . . . . 175 THR N . 52475 1 769 . 1 . 1 176 176 ASP H H 1 8.538 0.020 . 1 . . . . . 176 ASP H . 52475 1 770 . 1 . 1 176 176 ASP C C 13 178.880 0.3 . 1 . . . . . 176 ASP C . 52475 1 771 . 1 . 1 176 176 ASP CA C 13 57.457 0.3 . 1 . . . . . 176 ASP CA . 52475 1 772 . 1 . 1 176 176 ASP CB C 13 39.486 0.3 . 1 . . . . . 176 ASP CB . 52475 1 773 . 1 . 1 176 176 ASP N N 15 123.513 0.3 . 1 . . . . . 176 ASP N . 52475 1 774 . 1 . 1 177 177 SER H H 1 8.156 0.020 . 1 . . . . . 177 SER H . 52475 1 775 . 1 . 1 177 177 SER C C 13 177.172 0.3 . 1 . . . . . 177 SER C . 52475 1 776 . 1 . 1 177 177 SER CA C 13 57.724 0.3 . 1 . . . . . 177 SER CA . 52475 1 777 . 1 . 1 177 177 SER CB C 13 63.062 0.3 . 1 . . . . . 177 SER CB . 52475 1 778 . 1 . 1 177 177 SER N N 15 116.543 0.3 . 1 . . . . . 177 SER N . 52475 1 779 . 1 . 1 178 178 PHE H H 1 8.367 0.020 . 1 . . . . . 178 PHE H . 52475 1 780 . 1 . 1 178 178 PHE C C 13 176.963 0.3 . 1 . . . . . 178 PHE C . 52475 1 781 . 1 . 1 178 178 PHE CA C 13 61.549 0.3 . 1 . . . . . 178 PHE CA . 52475 1 782 . 1 . 1 178 178 PHE CB C 13 38.507 0.3 . 1 . . . . . 178 PHE CB . 52475 1 783 . 1 . 1 178 178 PHE N N 15 123.656 0.3 . 1 . . . . . 178 PHE N . 52475 1 784 . 1 . 1 179 179 ARG H H 1 8.831 0.020 . 1 . . . . . 179 ARG H . 52475 1 785 . 1 . 1 179 179 ARG C C 13 179.423 0.3 . 1 . . . . . 179 ARG C . 52475 1 786 . 1 . 1 179 179 ARG CA C 13 58.969 0.3 . 1 . . . . . 179 ARG CA . 52475 1 787 . 1 . 1 179 179 ARG CB C 13 28.810 0.3 . 1 . . . . . 179 ARG CB . 52475 1 788 . 1 . 1 179 179 ARG N N 15 118.201 0.3 . 1 . . . . . 179 ARG N . 52475 1 789 . 1 . 1 180 180 ARG H H 1 7.849 0.020 . 1 . . . . . 180 ARG H . 52475 1 790 . 1 . 1 180 180 ARG C C 13 177.789 0.3 . 1 . . . . . 180 ARG C . 52475 1 791 . 1 . 1 180 180 ARG CA C 13 58.346 0.3 . 1 . . . . . 180 ARG CA . 52475 1 792 . 1 . 1 180 180 ARG CB C 13 28.988 0.3 . 1 . . . . . 180 ARG CB . 52475 1 793 . 1 . 1 180 180 ARG N N 15 117.460 0.3 . 1 . . . . . 180 ARG N . 52475 1 794 . 1 . 1 181 181 ARG H H 1 6.878 0.020 . 1 . . . . . 181 ARG H . 52475 1 795 . 1 . 1 181 181 ARG C C 13 175.919 0.3 . 1 . . . . . 181 ARG C . 52475 1 796 . 1 . 1 181 181 ARG CA C 13 55.855 0.3 . 1 . . . . . 181 ARG CA . 52475 1 797 . 1 . 1 181 181 ARG CB C 13 29.611 0.3 . 1 . . . . . 181 ARG CB . 52475 1 798 . 1 . 1 181 181 ARG N N 15 116.639 0.3 . 1 . . . . . 181 ARG N . 52475 1 799 . 1 . 1 182 182 ASP H H 1 7.440 0.020 . 1 . . . . . 182 ASP H . 52475 1 800 . 1 . 1 182 182 ASP C C 13 177.553 0.3 . 1 . . . . . 182 ASP C . 52475 1 801 . 1 . 1 182 182 ASP CA C 13 51.407 0.3 . 1 . . . . . 182 ASP CA . 52475 1 802 . 1 . 1 182 182 ASP CB C 13 37.884 0.3 . 1 . . . . . 182 ASP CB . 52475 1 803 . 1 . 1 182 182 ASP N N 15 123.104 0.3 . 1 . . . . . 182 ASP N . 52475 1 804 . 1 . 1 183 183 THR H H 1 7.808 0.020 . 1 . . . . . 183 THR H . 52475 1 805 . 1 . 1 183 183 THR C C 13 175.691 0.3 . 1 . . . . . 183 THR C . 52475 1 806 . 1 . 1 183 183 THR CA C 13 64.129 0.3 . 1 . . . . . 183 THR CA . 52475 1 807 . 1 . 1 183 183 THR CB C 13 67.688 0.3 . 1 . . . . . 183 THR CB . 52475 1 808 . 1 . 1 183 183 THR N N 15 117.158 0.3 . 1 . . . . . 183 THR N . 52475 1 809 . 1 . 1 184 184 ALA H H 1 8.415 0.020 . 1 . . . . . 184 ALA H . 52475 1 810 . 1 . 1 184 184 ALA C C 13 176.260 0.3 . 1 . . . . . 184 ALA C . 52475 1 811 . 1 . 1 184 184 ALA CA C 13 50.873 0.3 . 1 . . . . . 184 ALA CA . 52475 1 812 . 1 . 1 184 184 ALA CB C 13 17.422 0.3 . 1 . . . . . 184 ALA CB . 52475 1 813 . 1 . 1 184 184 ALA N N 15 122.848 0.3 . 1 . . . . . 184 ALA N . 52475 1 814 . 1 . 1 185 185 GLN H H 1 7.819 0.020 . 1 . . . . . 185 GLN H . 52475 1 815 . 1 . 1 185 185 GLN C C 13 175.683 0.3 . 1 . . . . . 185 GLN C . 52475 1 816 . 1 . 1 185 185 GLN CA C 13 56.033 0.3 . 1 . . . . . 185 GLN CA . 52475 1 817 . 1 . 1 185 185 GLN CB C 13 24.807 0.3 . 1 . . . . . 185 GLN CB . 52475 1 818 . 1 . 1 185 185 GLN N N 15 117.060 0.3 . 1 . . . . . 185 GLN N . 52475 1 819 . 1 . 1 186 186 GLN H H 1 9.622 0.020 . 1 . . . . . 186 GLN H . 52475 1 820 . 1 . 1 186 186 GLN C C 13 177.825 0.3 . 1 . . . . . 186 GLN C . 52475 1 821 . 1 . 1 186 186 GLN CA C 13 55.322 0.3 . 1 . . . . . 186 GLN CA . 52475 1 822 . 1 . 1 186 186 GLN CB C 13 30.233 0.3 . 1 . . . . . 186 GLN CB . 52475 1 823 . 1 . 1 186 186 GLN N N 15 119.106 0.3 . 1 . . . . . 186 GLN N . 52475 1 824 . 1 . 1 187 187 GLY H H 1 8.277 0.020 . 1 . . . . . 187 GLY H . 52475 1 825 . 1 . 1 187 187 GLY C C 13 173.904 0.3 . 1 . . . . . 187 GLY C . 52475 1 826 . 1 . 1 187 187 GLY CA C 13 44.735 0.3 . 1 . . . . . 187 GLY CA . 52475 1 827 . 1 . 1 187 187 GLY N N 15 111.435 0.3 . 1 . . . . . 187 GLY N . 52475 1 828 . 1 . 1 188 188 VAL H H 1 7.058 0.020 . 1 . . . . . 188 VAL H . 52475 1 829 . 1 . 1 188 188 VAL C C 13 173.299 0.3 . 1 . . . . . 188 VAL C . 52475 1 830 . 1 . 1 188 188 VAL CA C 13 59.948 0.3 . 1 . . . . . 188 VAL CA . 52475 1 831 . 1 . 1 188 188 VAL CB C 13 34.415 0.3 . 1 . . . . . 188 VAL CB . 52475 1 832 . 1 . 1 188 188 VAL N N 15 119.471 0.3 . 1 . . . . . 188 VAL N . 52475 1 833 . 1 . 1 189 189 VAL H H 1 7.956 0.020 . 1 . . . . . 189 VAL H . 52475 1 834 . 1 . 1 189 189 VAL C C 13 174.172 0.3 . 1 . . . . . 189 VAL C . 52475 1 835 . 1 . 1 189 189 VAL CA C 13 59.503 0.3 . 1 . . . . . 189 VAL CA . 52475 1 836 . 1 . 1 189 189 VAL CB C 13 34.860 0.3 . 1 . . . . . 189 VAL CB . 52475 1 837 . 1 . 1 189 189 VAL N N 15 124.762 0.3 . 1 . . . . . 189 VAL N . 52475 1 838 . 1 . 1 190 190 ASN H H 1 8.408 0.020 . 1 . . . . . 190 ASN H . 52475 1 839 . 1 . 1 190 190 ASN C C 13 173.925 0.3 . 1 . . . . . 190 ASN C . 52475 1 840 . 1 . 1 190 190 ASN CA C 13 51.941 0.3 . 1 . . . . . 190 ASN CA . 52475 1 841 . 1 . 1 190 190 ASN CB C 13 38.418 0.3 . 1 . . . . . 190 ASN CB . 52475 1 842 . 1 . 1 190 190 ASN N N 15 126.055 0.3 . 1 . . . . . 190 ASN N . 52475 1 843 . 1 . 1 191 191 PHE H H 1 9.349 0.020 . 1 . . . . . 191 PHE H . 52475 1 844 . 1 . 1 191 191 PHE C C 13 173.906 0.3 . 1 . . . . . 191 PHE C . 52475 1 845 . 1 . 1 191 191 PHE CA C 13 55.855 0.3 . 1 . . . . . 191 PHE CA . 52475 1 846 . 1 . 1 191 191 PHE CB C 13 41.888 0.3 . 1 . . . . . 191 PHE CB . 52475 1 847 . 1 . 1 191 191 PHE N N 15 126.726 0.3 . 1 . . . . . 191 PHE N . 52475 1 848 . 1 . 1 193 193 TYR H H 1 7.943 0.020 . 1 . . . . . 193 TYR H . 52475 1 849 . 1 . 1 193 193 TYR C C 13 175.482 0.3 . 1 . . . . . 193 TYR C . 52475 1 850 . 1 . 1 193 193 TYR CA C 13 61.193 0.3 . 1 . . . . . 193 TYR CA . 52475 1 851 . 1 . 1 193 193 TYR CB C 13 37.262 0.3 . 1 . . . . . 193 TYR CB . 52475 1 852 . 1 . 1 193 193 TYR N N 15 124.086 0.3 . 1 . . . . . 193 TYR N . 52475 1 853 . 1 . 1 194 194 ASP H H 1 9.005 0.020 . 1 . . . . . 194 ASP H . 52475 1 854 . 1 . 1 194 194 ASP C C 13 177.662 0.3 . 1 . . . . . 194 ASP C . 52475 1 855 . 1 . 1 194 194 ASP CA C 13 57.724 0.3 . 1 . . . . . 194 ASP CA . 52475 1 856 . 1 . 1 194 194 ASP CB C 13 41.354 0.3 . 1 . . . . . 194 ASP CB . 52475 1 857 . 1 . 1 194 194 ASP N N 15 118.030 0.3 . 1 . . . . . 194 ASP N . 52475 1 858 . 1 . 1 195 195 ASP H H 1 6.921 0.020 . 1 . . . . . 195 ASP H . 52475 1 859 . 1 . 1 195 195 ASP C C 13 177.665 0.3 . 1 . . . . . 195 ASP C . 52475 1 860 . 1 . 1 195 195 ASP CA C 13 56.033 0.3 . 1 . . . . . 195 ASP CA . 52475 1 861 . 1 . 1 195 195 ASP CB C 13 41.354 0.3 . 1 . . . . . 195 ASP CB . 52475 1 862 . 1 . 1 195 195 ASP N N 15 115.656 0.3 . 1 . . . . . 195 ASP N . 52475 1 863 . 1 . 1 196 196 PHE H H 1 8.376 0.020 . 1 . . . . . 196 PHE H . 52475 1 864 . 1 . 1 196 196 PHE C C 13 175.634 0.3 . 1 . . . . . 196 PHE C . 52475 1 865 . 1 . 1 196 196 PHE CA C 13 61.104 0.3 . 1 . . . . . 196 PHE CA . 52475 1 866 . 1 . 1 196 196 PHE CB C 13 38.418 0.3 . 1 . . . . . 196 PHE CB . 52475 1 867 . 1 . 1 196 196 PHE N N 15 120.449 0.3 . 1 . . . . . 196 PHE N . 52475 1 868 . 1 . 1 197 197 ILE H H 1 7.920 0.020 . 1 . . . . . 197 ILE H . 52475 1 869 . 1 . 1 197 197 ILE C C 13 175.519 0.3 . 1 . . . . . 197 ILE C . 52475 1 870 . 1 . 1 197 197 ILE CA C 13 60.482 0.3 . 1 . . . . . 197 ILE CA . 52475 1 871 . 1 . 1 197 197 ILE CB C 13 33.258 0.3 . 1 . . . . . 197 ILE CB . 52475 1 872 . 1 . 1 197 197 ILE N N 15 117.971 0.3 . 1 . . . . . 197 ILE N . 52475 1 873 . 1 . 1 198 198 GLN H H 1 7.998 0.020 . 1 . . . . . 198 GLN H . 52475 1 874 . 1 . 1 198 198 GLN C C 13 177.172 0.3 . 1 . . . . . 198 GLN C . 52475 1 875 . 1 . 1 198 198 GLN CA C 13 59.592 0.3 . 1 . . . . . 198 GLN CA . 52475 1 876 . 1 . 1 198 198 GLN CB C 13 27.298 0.3 . 1 . . . . . 198 GLN CB . 52475 1 877 . 1 . 1 198 198 GLN N N 15 118.786 0.3 . 1 . . . . . 198 GLN N . 52475 1 878 . 1 . 1 199 199 CYS H H 1 8.277 0.020 . 1 . . . . . 199 CYS H . 52475 1 879 . 1 . 1 199 199 CYS C C 13 176.554 0.3 . 1 . . . . . 199 CYS C . 52475 1 880 . 1 . 1 199 199 CYS CA C 13 61.282 0.3 . 1 . . . . . 199 CYS CA . 52475 1 881 . 1 . 1 199 199 CYS CB C 13 26.675 0.3 . 1 . . . . . 199 CYS CB . 52475 1 882 . 1 . 1 199 199 CYS N N 15 118.187 0.3 . 1 . . . . . 199 CYS N . 52475 1 883 . 1 . 1 200 200 VAL H H 1 7.839 0.020 . 1 . . . . . 200 VAL H . 52475 1 884 . 1 . 1 200 200 VAL C C 13 178.653 0.3 . 1 . . . . . 200 VAL C . 52475 1 885 . 1 . 1 200 200 VAL CA C 13 64.751 0.3 . 1 . . . . . 200 VAL CA . 52475 1 886 . 1 . 1 200 200 VAL CB C 13 29.628 0.3 . 1 . . . . . 200 VAL CB . 52475 1 887 . 1 . 1 200 200 VAL N N 15 113.816 0.3 . 1 . . . . . 200 VAL N . 52475 1 888 . 1 . 1 201 201 MET H H 1 8.277 0.020 . 1 . . . . . 201 MET H . 52475 1 889 . 1 . 1 201 201 MET C C 13 176.990 0.3 . 1 . . . . . 201 MET C . 52475 1 890 . 1 . 1 201 201 MET CA C 13 54.699 0.3 . 1 . . . . . 201 MET CA . 52475 1 891 . 1 . 1 201 201 MET CB C 13 28.988 0.3 . 1 . . . . . 201 MET CB . 52475 1 892 . 1 . 1 201 201 MET N N 15 116.054 0.3 . 1 . . . . . 201 MET N . 52475 1 893 . 1 . 1 202 202 SER H H 1 6.802 0.020 . 1 . . . . . 202 SER H . 52475 1 894 . 1 . 1 202 202 SER C C 13 172.778 0.3 . 1 . . . . . 202 SER C . 52475 1 895 . 1 . 1 202 202 SER CA C 13 59.503 0.3 . 1 . . . . . 202 SER CA . 52475 1 896 . 1 . 1 202 202 SER CB C 13 62.973 0.3 . 1 . . . . . 202 SER CB . 52475 1 897 . 1 . 1 202 202 SER N N 15 110.294 0.3 . 1 . . . . . 202 SER N . 52475 1 898 . 1 . 1 203 203 VAL H H 1 6.600 0.020 . 1 . . . . . 203 VAL H . 52475 1 899 . 1 . 1 203 203 VAL C C 13 179.640 0.3 . 1 . . . . . 203 VAL C . 52475 1 900 . 1 . 1 203 203 VAL CA C 13 64.752 0.3 . 1 . . . . . 203 VAL CA . 52475 1 901 . 1 . 1 203 203 VAL CB C 13 30.767 0.3 . 1 . . . . . 203 VAL CB . 52475 1 902 . 1 . 1 203 203 VAL N N 15 125.210 0.3 . 1 . . . . . 203 VAL N . 52475 1 stop_ save_