data_52322 ####################### # Entry information # ####################### save_entry_information_1 _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information_1 _Entry.ID 52322 _Entry.Title ; An extended interaction site determines binding between AP180 and AP2 in clathrin mediated endocytosis ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2024-02-16 _Entry.Accession_date 2024-02-16 _Entry.Last_release_date 2024-02-16 _Entry.Original_release_date 2024-02-16 _Entry.Origination author _Entry.Format_name . _Entry.NMR_STAR_version 3.2.14.0 _Entry.NMR_STAR_dict_location . _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Source_data_format . _Entry.Source_data_format_version . _Entry.Generated_software_name . _Entry.Generated_software_version . _Entry.Generated_software_ID 1 _Entry.Generated_software_label $software_1 _Entry.Generated_date . _Entry.DOI . _Entry.UUID . _Entry.Related_coordinate_file_name . _Entry.Details 'Monomeric clathrin assembly protein AP180, residues 281-500' _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 Samuel Naudi-Fabra . . . 0000-0003-1080-649X 52322 2 Carlos Elena-Real . A. . 0000-0001-8244-5676 52322 3 Ida Vedel . M. . 0000-0002-3465-4796 52322 4 Maud Tengo . . . . 52322 5 Kathrin Motzny . . . . 52322 6 Pin-Lian Jiang . . . . 52322 7 Peter Schmieder . . . 0000-0001-9968-9327 52322 8 Fan Liu . . . 0000-0002-2358-549X 52322 9 Sigrid Milles . . . 0000-0001-9362-9606 52322 stop_ loop_ _Entry_src.ID _Entry_src.Project_name _Entry_src.Organization_full_name _Entry_src.Organization_initials _Entry_src.Entry_ID 1 . 'Milles group; Institute for Structural Biology, Grenoble, France.' . 52322 2 . 'Milles group; Leibniz Research Institute for Molecular Pharmacology, Berlin, Germany' . 52322 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 52322 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 479 52322 '15N chemical shifts' 172 52322 '1H chemical shifts' 172 52322 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 . . 2024-07-18 2024-02-16 update BMRB 'update entry citation' 52322 1 . . 2024-06-25 2024-02-16 original author 'original release' 52322 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID BMRB 52320 'AP2B2, Beta-2 subunit of the heterotetrameric AP2 adaptor' 52322 BMRB 52323 'Monomeric clathrin assembly protein AP180, residues 399-598' 52322 BMRB 52324 'Monomeric clathrin assembly protein AP180, residues 471-700' 52322 BMRB 52325 'Monomeric clathrin assembly protein AP180, residues 540-740' 52322 BMRB 52326 'Monomeric clathrin assembly protein AP180, residues 720-898' 52322 stop_ save_ ############### # Citations # ############### save_citations_1 _Citation.Sf_category citations _Citation.Sf_framecode citations_1 _Citation.Entry_ID 52322 _Citation.ID 1 _Citation.Name . _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.PubMed_ID 39003270 _Citation.DOI . _Citation.Full_citation . _Citation.Title ; An extended interaction site determines binding between AP180 and AP2 in clathrin mediated endocytosis ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Nat. Commun.' _Citation.Journal_name_full 'Nature communications' _Citation.Journal_volume 15 _Citation.Journal_issue 1 _Citation.Journal_ASTM . _Citation.Journal_ISSN 2041-1723 _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 5884 _Citation.Page_last 5884 _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 Samuel Naudi-Fabra . . . . 52322 1 2 Carlos Elena-Real . A. . . 52322 1 3 Ida Vedel . M. . . 52322 1 4 Maud Tengo . . . . 52322 1 5 Kathrin Motzny . . . . 52322 1 6 Pin-Lian Jiang . . . . 52322 1 7 Peter Schmieder . . . . 52322 1 8 Fan Liu . . . . 52322 1 9 Sigrid Milles . . . . 52322 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID 'Clathrin Mediated Endocytosis' 52322 1 'Intrinsically Disordered Proteins' 52322 1 'Nuclear Magnetic Resonance' 52322 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly_1 _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly_1 _Assembly.Entry_ID 52322 _Assembly.ID 1 _Assembly.Name 'AP180 281-500' _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 21261.19 _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 'AP180 281-500' 1 $entity_1 . . yes native no no . . . 52322 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 52322 _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 ; MHLNTLEGKKPGNNEGSGAP SPLSKSSPATTVTSPNSTPA KTIETSPPVDIFATASAAAP VSSAKPSSDLLDLQPDFSGA AAGAAAPVPPPTGGATAWGD LLGEDSLAALSSVPSEAPIS DPFAPEPSPPTTTTEPASAS ASATTAVTAATTEVDLFGDA FAASPGEAPAASEGATAPAT PAPVAAALDACSGNDPFAPS EGSAEAAPELDLFAMKPPET SAP ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states yes _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 223 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method . _Entity.Parent_entity_ID 1 _Entity.Fragment 'AP180 281-500' _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 21261.19 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details 'The molecule does not exist in a specific conformational state, as it is an intrinsically disordered protein.' _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_biological_function.Biological_function _Entity_biological_function.Entry_ID _Entity_biological_function.Entity_ID 'clathrin-mediated endocytosis' 52322 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 0 MET . 52322 1 2 1 HIS . 52322 1 3 2 LEU . 52322 1 4 3 ASN . 52322 1 5 4 THR . 52322 1 6 5 LEU . 52322 1 7 6 GLU . 52322 1 8 7 GLY . 52322 1 9 8 LYS . 52322 1 10 9 LYS . 52322 1 11 10 PRO . 52322 1 12 11 GLY . 52322 1 13 12 ASN . 52322 1 14 13 ASN . 52322 1 15 14 GLU . 52322 1 16 15 GLY . 52322 1 17 16 SER . 52322 1 18 17 GLY . 52322 1 19 18 ALA . 52322 1 20 19 PRO . 52322 1 21 20 SER . 52322 1 22 21 PRO . 52322 1 23 22 LEU . 52322 1 24 23 SER . 52322 1 25 24 LYS . 52322 1 26 25 SER . 52322 1 27 26 SER . 52322 1 28 27 PRO . 52322 1 29 28 ALA . 52322 1 30 29 THR . 52322 1 31 30 THR . 52322 1 32 31 VAL . 52322 1 33 32 THR . 52322 1 34 33 SER . 52322 1 35 34 PRO . 52322 1 36 35 ASN . 52322 1 37 36 SER . 52322 1 38 37 THR . 52322 1 39 38 PRO . 52322 1 40 39 ALA . 52322 1 41 40 LYS . 52322 1 42 41 THR . 52322 1 43 42 ILE . 52322 1 44 43 GLU . 52322 1 45 44 THR . 52322 1 46 45 SER . 52322 1 47 46 PRO . 52322 1 48 47 PRO . 52322 1 49 48 VAL . 52322 1 50 49 ASP . 52322 1 51 50 ILE . 52322 1 52 51 PHE . 52322 1 53 52 ALA . 52322 1 54 53 THR . 52322 1 55 54 ALA . 52322 1 56 55 SER . 52322 1 57 56 ALA . 52322 1 58 57 ALA . 52322 1 59 58 ALA . 52322 1 60 59 PRO . 52322 1 61 60 VAL . 52322 1 62 61 SER . 52322 1 63 62 SER . 52322 1 64 63 ALA . 52322 1 65 64 LYS . 52322 1 66 65 PRO . 52322 1 67 66 SER . 52322 1 68 67 SER . 52322 1 69 68 ASP . 52322 1 70 69 LEU . 52322 1 71 70 LEU . 52322 1 72 71 ASP . 52322 1 73 72 LEU . 52322 1 74 73 GLN . 52322 1 75 74 PRO . 52322 1 76 75 ASP . 52322 1 77 76 PHE . 52322 1 78 77 SER . 52322 1 79 78 GLY . 52322 1 80 79 ALA . 52322 1 81 80 ALA . 52322 1 82 81 ALA . 52322 1 83 82 GLY . 52322 1 84 83 ALA . 52322 1 85 84 ALA . 52322 1 86 85 ALA . 52322 1 87 86 PRO . 52322 1 88 87 VAL . 52322 1 89 88 PRO . 52322 1 90 89 PRO . 52322 1 91 90 PRO . 52322 1 92 91 THR . 52322 1 93 92 GLY . 52322 1 94 93 GLY . 52322 1 95 94 ALA . 52322 1 96 95 THR . 52322 1 97 96 ALA . 52322 1 98 97 TRP . 52322 1 99 98 GLY . 52322 1 100 99 ASP . 52322 1 101 100 LEU . 52322 1 102 101 LEU . 52322 1 103 102 GLY . 52322 1 104 103 GLU . 52322 1 105 104 ASP . 52322 1 106 105 SER . 52322 1 107 106 LEU . 52322 1 108 107 ALA . 52322 1 109 108 ALA . 52322 1 110 109 LEU . 52322 1 111 110 SER . 52322 1 112 111 SER . 52322 1 113 112 VAL . 52322 1 114 113 PRO . 52322 1 115 114 SER . 52322 1 116 115 GLU . 52322 1 117 116 ALA . 52322 1 118 117 PRO . 52322 1 119 118 ILE . 52322 1 120 119 SER . 52322 1 121 120 ASP . 52322 1 122 121 PRO . 52322 1 123 122 PHE . 52322 1 124 123 ALA . 52322 1 125 124 PRO . 52322 1 126 125 GLU . 52322 1 127 126 PRO . 52322 1 128 127 SER . 52322 1 129 128 PRO . 52322 1 130 129 PRO . 52322 1 131 130 THR . 52322 1 132 131 THR . 52322 1 133 132 THR . 52322 1 134 133 THR . 52322 1 135 134 GLU . 52322 1 136 135 PRO . 52322 1 137 136 ALA . 52322 1 138 137 SER . 52322 1 139 138 ALA . 52322 1 140 139 SER . 52322 1 141 140 ALA . 52322 1 142 141 SER . 52322 1 143 142 ALA . 52322 1 144 143 THR . 52322 1 145 144 THR . 52322 1 146 145 ALA . 52322 1 147 146 VAL . 52322 1 148 147 THR . 52322 1 149 148 ALA . 52322 1 150 149 ALA . 52322 1 151 150 THR . 52322 1 152 151 THR . 52322 1 153 152 GLU . 52322 1 154 153 VAL . 52322 1 155 154 ASP . 52322 1 156 155 LEU . 52322 1 157 156 PHE . 52322 1 158 157 GLY . 52322 1 159 158 ASP . 52322 1 160 159 ALA . 52322 1 161 160 PHE . 52322 1 162 161 ALA . 52322 1 163 162 ALA . 52322 1 164 163 SER . 52322 1 165 164 PRO . 52322 1 166 165 GLY . 52322 1 167 166 GLU . 52322 1 168 167 ALA . 52322 1 169 168 PRO . 52322 1 170 169 ALA . 52322 1 171 170 ALA . 52322 1 172 171 SER . 52322 1 173 172 GLU . 52322 1 174 173 GLY . 52322 1 175 174 ALA . 52322 1 176 175 THR . 52322 1 177 176 ALA . 52322 1 178 177 PRO . 52322 1 179 178 ALA . 52322 1 180 179 THR . 52322 1 181 180 PRO . 52322 1 182 181 ALA . 52322 1 183 182 PRO . 52322 1 184 183 VAL . 52322 1 185 184 ALA . 52322 1 186 185 ALA . 52322 1 187 186 ALA . 52322 1 188 187 LEU . 52322 1 189 188 ASP . 52322 1 190 189 ALA . 52322 1 191 190 CYS . 52322 1 192 191 SER . 52322 1 193 192 GLY . 52322 1 194 193 ASN . 52322 1 195 194 ASP . 52322 1 196 195 PRO . 52322 1 197 196 PHE . 52322 1 198 197 ALA . 52322 1 199 198 PRO . 52322 1 200 199 SER . 52322 1 201 200 GLU . 52322 1 202 201 GLY . 52322 1 203 202 SER . 52322 1 204 203 ALA . 52322 1 205 204 GLU . 52322 1 206 205 ALA . 52322 1 207 206 ALA . 52322 1 208 207 PRO . 52322 1 209 208 GLU . 52322 1 210 209 LEU . 52322 1 211 210 ASP . 52322 1 212 211 LEU . 52322 1 213 212 PHE . 52322 1 214 213 ALA . 52322 1 215 214 MET . 52322 1 216 215 LYS . 52322 1 217 216 PRO . 52322 1 218 217 PRO . 52322 1 219 218 GLU . 52322 1 220 219 THR . 52322 1 221 220 SER . 52322 1 222 221 ALA . 52322 1 223 222 PRO . 52322 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . MET 1 1 52322 1 . HIS 2 2 52322 1 . LEU 3 3 52322 1 . ASN 4 4 52322 1 . THR 5 5 52322 1 . LEU 6 6 52322 1 . GLU 7 7 52322 1 . GLY 8 8 52322 1 . LYS 9 9 52322 1 . LYS 10 10 52322 1 . PRO 11 11 52322 1 . GLY 12 12 52322 1 . ASN 13 13 52322 1 . ASN 14 14 52322 1 . GLU 15 15 52322 1 . GLY 16 16 52322 1 . SER 17 17 52322 1 . GLY 18 18 52322 1 . ALA 19 19 52322 1 . PRO 20 20 52322 1 . SER 21 21 52322 1 . PRO 22 22 52322 1 . LEU 23 23 52322 1 . SER 24 24 52322 1 . LYS 25 25 52322 1 . SER 26 26 52322 1 . SER 27 27 52322 1 . PRO 28 28 52322 1 . ALA 29 29 52322 1 . THR 30 30 52322 1 . THR 31 31 52322 1 . VAL 32 32 52322 1 . THR 33 33 52322 1 . SER 34 34 52322 1 . PRO 35 35 52322 1 . ASN 36 36 52322 1 . SER 37 37 52322 1 . THR 38 38 52322 1 . PRO 39 39 52322 1 . ALA 40 40 52322 1 . LYS 41 41 52322 1 . THR 42 42 52322 1 . ILE 43 43 52322 1 . GLU 44 44 52322 1 . THR 45 45 52322 1 . SER 46 46 52322 1 . PRO 47 47 52322 1 . PRO 48 48 52322 1 . VAL 49 49 52322 1 . ASP 50 50 52322 1 . ILE 51 51 52322 1 . PHE 52 52 52322 1 . ALA 53 53 52322 1 . THR 54 54 52322 1 . ALA 55 55 52322 1 . SER 56 56 52322 1 . ALA 57 57 52322 1 . ALA 58 58 52322 1 . ALA 59 59 52322 1 . PRO 60 60 52322 1 . VAL 61 61 52322 1 . SER 62 62 52322 1 . SER 63 63 52322 1 . ALA 64 64 52322 1 . LYS 65 65 52322 1 . PRO 66 66 52322 1 . SER 67 67 52322 1 . SER 68 68 52322 1 . ASP 69 69 52322 1 . LEU 70 70 52322 1 . LEU 71 71 52322 1 . ASP 72 72 52322 1 . LEU 73 73 52322 1 . GLN 74 74 52322 1 . PRO 75 75 52322 1 . ASP 76 76 52322 1 . PHE 77 77 52322 1 . SER 78 78 52322 1 . GLY 79 79 52322 1 . ALA 80 80 52322 1 . ALA 81 81 52322 1 . ALA 82 82 52322 1 . GLY 83 83 52322 1 . ALA 84 84 52322 1 . ALA 85 85 52322 1 . ALA 86 86 52322 1 . PRO 87 87 52322 1 . VAL 88 88 52322 1 . PRO 89 89 52322 1 . PRO 90 90 52322 1 . PRO 91 91 52322 1 . THR 92 92 52322 1 . GLY 93 93 52322 1 . GLY 94 94 52322 1 . ALA 95 95 52322 1 . THR 96 96 52322 1 . ALA 97 97 52322 1 . TRP 98 98 52322 1 . GLY 99 99 52322 1 . ASP 100 100 52322 1 . LEU 101 101 52322 1 . LEU 102 102 52322 1 . GLY 103 103 52322 1 . GLU 104 104 52322 1 . ASP 105 105 52322 1 . SER 106 106 52322 1 . LEU 107 107 52322 1 . ALA 108 108 52322 1 . ALA 109 109 52322 1 . LEU 110 110 52322 1 . SER 111 111 52322 1 . SER 112 112 52322 1 . VAL 113 113 52322 1 . PRO 114 114 52322 1 . SER 115 115 52322 1 . GLU 116 116 52322 1 . ALA 117 117 52322 1 . PRO 118 118 52322 1 . ILE 119 119 52322 1 . SER 120 120 52322 1 . ASP 121 121 52322 1 . PRO 122 122 52322 1 . PHE 123 123 52322 1 . ALA 124 124 52322 1 . PRO 125 125 52322 1 . GLU 126 126 52322 1 . PRO 127 127 52322 1 . SER 128 128 52322 1 . PRO 129 129 52322 1 . PRO 130 130 52322 1 . THR 131 131 52322 1 . THR 132 132 52322 1 . THR 133 133 52322 1 . THR 134 134 52322 1 . GLU 135 135 52322 1 . PRO 136 136 52322 1 . ALA 137 137 52322 1 . SER 138 138 52322 1 . ALA 139 139 52322 1 . SER 140 140 52322 1 . ALA 141 141 52322 1 . SER 142 142 52322 1 . ALA 143 143 52322 1 . THR 144 144 52322 1 . THR 145 145 52322 1 . ALA 146 146 52322 1 . VAL 147 147 52322 1 . THR 148 148 52322 1 . ALA 149 149 52322 1 . ALA 150 150 52322 1 . THR 151 151 52322 1 . THR 152 152 52322 1 . GLU 153 153 52322 1 . VAL 154 154 52322 1 . ASP 155 155 52322 1 . LEU 156 156 52322 1 . PHE 157 157 52322 1 . GLY 158 158 52322 1 . ASP 159 159 52322 1 . ALA 160 160 52322 1 . PHE 161 161 52322 1 . ALA 162 162 52322 1 . ALA 163 163 52322 1 . SER 164 164 52322 1 . PRO 165 165 52322 1 . GLY 166 166 52322 1 . GLU 167 167 52322 1 . ALA 168 168 52322 1 . PRO 169 169 52322 1 . ALA 170 170 52322 1 . ALA 171 171 52322 1 . SER 172 172 52322 1 . GLU 173 173 52322 1 . GLY 174 174 52322 1 . ALA 175 175 52322 1 . THR 176 176 52322 1 . ALA 177 177 52322 1 . PRO 178 178 52322 1 . ALA 179 179 52322 1 . THR 180 180 52322 1 . PRO 181 181 52322 1 . ALA 182 182 52322 1 . PRO 183 183 52322 1 . VAL 184 184 52322 1 . ALA 185 185 52322 1 . ALA 186 186 52322 1 . ALA 187 187 52322 1 . LEU 188 188 52322 1 . ASP 189 189 52322 1 . ALA 190 190 52322 1 . CYS 191 191 52322 1 . SER 192 192 52322 1 . GLY 193 193 52322 1 . ASN 194 194 52322 1 . ASP 195 195 52322 1 . PRO 196 196 52322 1 . PHE 197 197 52322 1 . ALA 198 198 52322 1 . PRO 199 199 52322 1 . SER 200 200 52322 1 . GLU 201 201 52322 1 . GLY 202 202 52322 1 . SER 203 203 52322 1 . ALA 204 204 52322 1 . GLU 205 205 52322 1 . ALA 206 206 52322 1 . ALA 207 207 52322 1 . PRO 208 208 52322 1 . GLU 209 209 52322 1 . LEU 210 210 52322 1 . ASP 211 211 52322 1 . LEU 212 212 52322 1 . PHE 213 213 52322 1 . ALA 214 214 52322 1 . MET 215 215 52322 1 . LYS 216 216 52322 1 . PRO 217 217 52322 1 . PRO 218 218 52322 1 . GLU 219 219 52322 1 . THR 220 220 52322 1 . SER 221 221 52322 1 . ALA 222 222 52322 1 . PRO 223 223 52322 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 52322 _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 . 10116 organism . 'Rattus norvegicus' Rat . . Eukaryota Metazoa Rattus norvegicus . . . . . . . . . . . . . 52322 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 52322 _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 TM (DE3)' . . plasmid . . pET-28 . . . 52322 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 52322 _Sample.ID 1 _Sample.Name 'AP180 281-500' _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 'Monomeric Clathrin Assembly Protein AP180, residues 281-500' '[U-100% 13C; U-100% 15N]' . . 1 $entity_1 . . 100 . . uM . . . . 52322 1 2 Na-phosphate 'natural abundance' . . . . . . 50 . . mM . . . . 52322 1 3 NaCl 'natural abundance' . . . . . . 150 . . mM . . . . 52322 1 4 DTT 'natural abundance' . . . . . . 2 . . mM . . . . 52322 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 52322 _Sample_condition_list.ID 1 _Sample_condition_list.Name 'pH6, 25C' _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' 0.375 . M 52322 1 pH 6 . pH 52322 1 pressure 1 . atm 52322 1 temperature 298.15 . K 52322 1 stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID 52322 _Software.ID 1 _Software.Type . _Software.Name MARS _Software.Version . _Software.DOI . _Software.Details . loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' . 52322 1 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_NMR_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_1 _NMR_spectrometer.Entry_ID 52322 _NMR_spectrometer.ID 1 _NMR_spectrometer.Name 'Bruker 600' _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 52322 _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 HSQC' no no no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 52322 1 2 '3D HNCO' no no no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 52322 1 3 '3D HN(CA)CO' no no no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 52322 1 4 '3D iHNCA' no no no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 52322 1 5 '3D HN(CO)CA' no no no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 52322 1 6 '3D iHNCACB' no no no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 'optimized CB transfer' 52322 1 7 '3D HN(CO)CACB' no no no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 'optimized CB transfer' 52322 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 52322 _Chem_shift_reference.ID 1 _Chem_shift_reference.Name '1H-15N-13C AP180 281-500' _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 water protons . . . . ppm 4.7 internal indirect 0.25144953 . . . . . 52322 1 H 1 water protons . . . . ppm 4.7 internal direct 1 . . . . . 52322 1 N 15 water protons . . . . ppm 4.7 internal indirect 0.101329118 . . . . . 52322 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 52322 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name 'AP180 281-500' _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' . . . 52322 1 2 '3D HNCO' . . . 52322 1 3 '3D HN(CA)CO' . . . 52322 1 4 '3D iHNCA' . . . 52322 1 5 '3D HN(CO)CA' . . . 52322 1 6 '3D iHNCACB' . . . 52322 1 7 '3D HN(CO)CACB' . . . 52322 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 . . 52322 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 3 3 LEU H H 1 8.318 . . . . . . . . 2 L HN . 52322 1 2 . 1 . 1 3 3 LEU CA C 13 55.320 . . . . . . . . 2 L CA . 52322 1 3 . 1 . 1 3 3 LEU CB C 13 42.468 . . . . . . . . 2 L CB . 52322 1 4 . 1 . 1 3 3 LEU N N 15 123.935 . . . . . . . . 2 L N . 52322 1 5 . 1 . 1 4 4 ASN H H 1 8.600 . . . . . . . . 3 N HN . 52322 1 6 . 1 . 1 4 4 ASN CA C 13 53.444 . . . . . . . . 3 N CA . 52322 1 7 . 1 . 1 4 4 ASN CB C 13 38.830 . . . . . . . . 3 N CB . 52322 1 8 . 1 . 1 4 4 ASN N N 15 119.945 . . . . . . . . 3 N N . 52322 1 9 . 1 . 1 5 5 THR H H 1 8.094 . . . . . . . . 4 T HN . 52322 1 10 . 1 . 1 5 5 THR C C 13 174.800 . . . . . . . . 4 T CO . 52322 1 11 . 1 . 1 5 5 THR CA C 13 62.144 . . . . . . . . 4 T CA . 52322 1 12 . 1 . 1 5 5 THR CB C 13 69.863 . . . . . . . . 4 T CB . 52322 1 13 . 1 . 1 5 5 THR N N 15 114.397 . . . . . . . . 4 T N . 52322 1 14 . 1 . 1 6 6 LEU H H 1 8.261 . . . . . . . . 5 L HN . 52322 1 15 . 1 . 1 6 6 LEU C C 13 177.699 . . . . . . . . 5 L CO . 52322 1 16 . 1 . 1 6 6 LEU CA C 13 55.587 . . . . . . . . 5 L CA . 52322 1 17 . 1 . 1 6 6 LEU CB C 13 42.412 . . . . . . . . 5 L CB . 52322 1 18 . 1 . 1 6 6 LEU N N 15 123.766 . . . . . . . . 5 L N . 52322 1 19 . 1 . 1 7 7 GLU H H 1 8.281 . . . . . . . . 6 E HN . 52322 1 20 . 1 . 1 7 7 GLU C C 13 177.126 . . . . . . . . 6 E CO . 52322 1 21 . 1 . 1 7 7 GLU CA C 13 57.017 . . . . . . . . 6 E CA . 52322 1 22 . 1 . 1 7 7 GLU CB C 13 30.339 . . . . . . . . 6 E CB . 52322 1 23 . 1 . 1 7 7 GLU N N 15 121.367 . . . . . . . . 6 E N . 52322 1 24 . 1 . 1 8 8 GLY H H 1 8.365 . . . . . . . . 7 G HN . 52322 1 25 . 1 . 1 8 8 GLY C C 13 174.096 . . . . . . . . 7 G CO . 52322 1 26 . 1 . 1 8 8 GLY CA C 13 45.398 . . . . . . . . 7 G CA . 52322 1 27 . 1 . 1 8 8 GLY N N 15 109.850 . . . . . . . . 7 G N . 52322 1 28 . 1 . 1 9 9 LYS H H 1 8.054 . . . . . . . . 8 K HN . 52322 1 29 . 1 . 1 9 9 LYS C C 13 176.556 . . . . . . . . 8 K CO . 52322 1 30 . 1 . 1 9 9 LYS CA C 13 56.090 . . . . . . . . 8 K CA . 52322 1 31 . 1 . 1 9 9 LYS CB C 13 33.190 . . . . . . . . 8 K CB . 52322 1 32 . 1 . 1 9 9 LYS N N 15 120.735 . . . . . . . . 8 K N . 52322 1 33 . 1 . 1 10 10 LYS H H 1 8.415 . . . . . . . . 9 K HN . 52322 1 34 . 1 . 1 10 10 LYS C C 13 174.737 . . . . . . . . 9 K CO . 52322 1 35 . 1 . 1 10 10 LYS CA C 13 54.373 . . . . . . . . 9 K CA . 52322 1 36 . 1 . 1 10 10 LYS CB C 13 32.624 . . . . . . . . 9 K CB . 52322 1 37 . 1 . 1 10 10 LYS N N 15 124.442 . . . . . . . . 9 K N . 52322 1 38 . 1 . 1 12 12 GLY H H 1 8.494 . . . . . . . . 11 G HN . 52322 1 39 . 1 . 1 12 12 GLY C C 13 174.059 . . . . . . . . 11 G CO . 52322 1 40 . 1 . 1 12 12 GLY CA C 13 45.295 . . . . . . . . 11 G CA . 52322 1 41 . 1 . 1 12 12 GLY N N 15 109.345 . . . . . . . . 11 G N . 52322 1 42 . 1 . 1 13 13 ASN H H 1 8.338 . . . . . . . . 12 N HN . 52322 1 43 . 1 . 1 13 13 ASN C C 13 175.294 . . . . . . . . 12 N CO . 52322 1 44 . 1 . 1 13 13 ASN CA C 13 53.421 . . . . . . . . 12 N CA . 52322 1 45 . 1 . 1 13 13 ASN CB C 13 39.138 . . . . . . . . 12 N CB . 52322 1 46 . 1 . 1 13 13 ASN N N 15 118.541 . . . . . . . . 12 N N . 52322 1 47 . 1 . 1 14 14 ASN H H 1 8.572 . . . . . . . . 13 N HN . 52322 1 48 . 1 . 1 14 14 ASN C C 13 175.557 . . . . . . . . 13 N CO . 52322 1 49 . 1 . 1 14 14 ASN CA C 13 53.567 . . . . . . . . 13 N CA . 52322 1 50 . 1 . 1 14 14 ASN CB C 13 38.991 . . . . . . . . 13 N CB . 52322 1 51 . 1 . 1 14 14 ASN N N 15 119.282 . . . . . . . . 13 N N . 52322 1 52 . 1 . 1 15 15 GLU H H 1 8.429 . . . . . . . . 14 E HN . 52322 1 53 . 1 . 1 15 15 GLU C C 13 177.284 . . . . . . . . 14 E CO . 52322 1 54 . 1 . 1 15 15 GLU CA C 13 57.177 . . . . . . . . 14 E CA . 52322 1 55 . 1 . 1 15 15 GLU CB C 13 30.248 . . . . . . . . 14 E CB . 52322 1 56 . 1 . 1 15 15 GLU N N 15 121.024 . . . . . . . . 14 E N . 52322 1 57 . 1 . 1 16 16 GLY H H 1 8.458 . . . . . . . . 15 G HN . 52322 1 58 . 1 . 1 16 16 GLY C C 13 174.646 . . . . . . . . 15 G CO . 52322 1 59 . 1 . 1 16 16 GLY CA C 13 45.487 . . . . . . . . 15 G CA . 52322 1 60 . 1 . 1 16 16 GLY N N 15 109.839 . . . . . . . . 15 G N . 52322 1 61 . 1 . 1 17 17 SER H H 1 8.261 . . . . . . . . 16 S HN . 52322 1 62 . 1 . 1 17 17 SER C C 13 175.266 . . . . . . . . 16 S CO . 52322 1 63 . 1 . 1 17 17 SER CA C 13 58.520 . . . . . . . . 16 S CA . 52322 1 64 . 1 . 1 17 17 SER CB C 13 63.819 . . . . . . . . 16 S CB . 52322 1 65 . 1 . 1 17 17 SER N N 15 115.723 . . . . . . . . 16 S N . 52322 1 66 . 1 . 1 18 18 GLY H H 1 8.456 . . . . . . . . 17 G HN . 52322 1 67 . 1 . 1 18 18 GLY C C 13 173.582 . . . . . . . . 17 G CO . 52322 1 68 . 1 . 1 18 18 GLY CA C 13 45.262 . . . . . . . . 17 G CA . 52322 1 69 . 1 . 1 18 18 GLY N N 15 110.974 . . . . . . . . 17 G N . 52322 1 70 . 1 . 1 19 19 ALA H H 1 8.087 . . . . . . . . 18 A HN . 52322 1 71 . 1 . 1 19 19 ALA C C 13 175.667 . . . . . . . . 18 A CO . 52322 1 72 . 1 . 1 19 19 ALA CA C 13 50.598 . . . . . . . . 18 A CA . 52322 1 73 . 1 . 1 19 19 ALA CB C 13 18.290 . . . . . . . . 18 A CB . 52322 1 74 . 1 . 1 19 19 ALA N N 15 124.924 . . . . . . . . 18 A N . 52322 1 75 . 1 . 1 21 21 SER H H 1 8.393 . . . . . . . . 20 S HN . 52322 1 76 . 1 . 1 21 21 SER C C 13 177.144 . . . . . . . . 20 S CO . 52322 1 77 . 1 . 1 21 21 SER CA C 13 58.548 . . . . . . . . 20 S CA . 52322 1 78 . 1 . 1 21 21 SER CB C 13 63.979 . . . . . . . . 20 S CB . 52322 1 79 . 1 . 1 21 21 SER N N 15 116.300 . . . . . . . . 20 S N . 52322 1 80 . 1 . 1 23 23 LEU H H 1 8.445 . . . . . . . . 22 L HN . 52322 1 81 . 1 . 1 23 23 LEU C C 13 175.340 . . . . . . . . 22 L CO . 52322 1 82 . 1 . 1 23 23 LEU N N 15 118.094 . . . . . . . . 22 L N . 52322 1 83 . 1 . 1 24 24 SER H H 1 8.172 . . . . . . . . 23 S HN . 52322 1 84 . 1 . 1 24 24 SER C C 13 174.686 . . . . . . . . 23 S CO . 52322 1 85 . 1 . 1 24 24 SER CA C 13 58.406 . . . . . . . . 23 S CA . 52322 1 86 . 1 . 1 24 24 SER CB C 13 64.048 . . . . . . . . 23 S CB . 52322 1 87 . 1 . 1 24 24 SER N N 15 116.030 . . . . . . . . 23 S N . 52322 1 88 . 1 . 1 25 25 LYS H H 1 8.322 . . . . . . . . 24 K HN . 52322 1 89 . 1 . 1 25 25 LYS C C 13 176.671 . . . . . . . . 24 K CO . 52322 1 90 . 1 . 1 25 25 LYS CA C 13 56.458 . . . . . . . . 24 K CA . 52322 1 91 . 1 . 1 25 25 LYS N N 15 123.282 . . . . . . . . 24 K N . 52322 1 92 . 1 . 1 26 26 SER H H 1 8.272 . . . . . . . . 25 S HN . 52322 1 93 . 1 . 1 26 26 SER C C 13 174.298 . . . . . . . . 25 S CO . 52322 1 94 . 1 . 1 26 26 SER CA C 13 58.300 . . . . . . . . 25 S CA . 52322 1 95 . 1 . 1 26 26 SER CB C 13 64.114 . . . . . . . . 25 S CB . 52322 1 96 . 1 . 1 26 26 SER N N 15 116.713 . . . . . . . . 25 S N . 52322 1 97 . 1 . 1 27 27 SER H H 1 8.315 . . . . . . . . 26 S HN . 52322 1 98 . 1 . 1 27 27 SER C C 13 172.774 . . . . . . . . 26 S CO . 52322 1 99 . 1 . 1 27 27 SER CA C 13 56.602 . . . . . . . . 26 S CA . 52322 1 100 . 1 . 1 27 27 SER CB C 13 63.593 . . . . . . . . 26 S CB . 52322 1 101 . 1 . 1 27 27 SER N N 15 118.962 . . . . . . . . 26 S N . 52322 1 102 . 1 . 1 29 29 ALA H H 1 8.395 . . . . . . . . 28 A HN . 52322 1 103 . 1 . 1 29 29 ALA C C 13 178.190 . . . . . . . . 28 A CO . 52322 1 104 . 1 . 1 29 29 ALA CA C 13 52.763 . . . . . . . . 28 A CA . 52322 1 105 . 1 . 1 29 29 ALA CB C 13 19.423 . . . . . . . . 28 A CB . 52322 1 106 . 1 . 1 29 29 ALA N N 15 124.059 . . . . . . . . 28 A N . 52322 1 107 . 1 . 1 30 30 THR H H 1 8.120 . . . . . . . . 29 T HN . 52322 1 108 . 1 . 1 30 30 THR C C 13 174.797 . . . . . . . . 29 T CO . 52322 1 109 . 1 . 1 30 30 THR CA C 13 61.847 . . . . . . . . 29 T CA . 52322 1 110 . 1 . 1 30 30 THR CB C 13 70.202 . . . . . . . . 29 T CB . 52322 1 111 . 1 . 1 30 30 THR N N 15 113.204 . . . . . . . . 29 T N . 52322 1 112 . 1 . 1 31 31 THR H H 1 8.142 . . . . . . . . 30 T HN . 52322 1 113 . 1 . 1 31 31 THR C C 13 174.508 . . . . . . . . 30 T CO . 52322 1 114 . 1 . 1 31 31 THR CA C 13 61.988 . . . . . . . . 30 T CA . 52322 1 115 . 1 . 1 31 31 THR CB C 13 69.976 . . . . . . . . 30 T CB . 52322 1 116 . 1 . 1 31 31 THR N N 15 116.997 . . . . . . . . 30 T N . 52322 1 117 . 1 . 1 32 32 VAL H H 1 8.242 . . . . . . . . 31 V HN . 52322 1 118 . 1 . 1 32 32 VAL C C 13 176.391 . . . . . . . . 31 V CO . 52322 1 119 . 1 . 1 32 32 VAL CA C 13 62.402 . . . . . . . . 31 V CA . 52322 1 120 . 1 . 1 32 32 VAL CB C 13 32.918 . . . . . . . . 31 V CB . 52322 1 121 . 1 . 1 32 32 VAL N N 15 123.081 . . . . . . . . 31 V N . 52322 1 122 . 1 . 1 33 33 THR H H 1 8.269 . . . . . . . . 32 T HN . 52322 1 123 . 1 . 1 33 33 THR C C 13 174.391 . . . . . . . . 32 T CO . 52322 1 124 . 1 . 1 33 33 THR CA C 13 61.784 . . . . . . . . 32 T CA . 52322 1 125 . 1 . 1 33 33 THR CB C 13 69.999 . . . . . . . . 32 T CB . 52322 1 126 . 1 . 1 33 33 THR N N 15 118.599 . . . . . . . . 32 T N . 52322 1 127 . 1 . 1 36 36 ASN H H 1 8.423 . . . . . . . . 35 N HN . 52322 1 128 . 1 . 1 36 36 ASN C C 13 176.631 . . . . . . . . 35 N CO . 52322 1 129 . 1 . 1 36 36 ASN N N 15 124.734 . . . . . . . . 35 N N . 52322 1 130 . 1 . 1 37 37 SER H H 1 8.139 . . . . . . . . 36 S HN . 52322 1 131 . 1 . 1 37 37 SER C C 13 174.696 . . . . . . . . 36 S CO . 52322 1 132 . 1 . 1 37 37 SER N N 15 114.574 . . . . . . . . 36 S N . 52322 1 133 . 1 . 1 38 38 THR H H 1 8.332 . . . . . . . . 37 T HN . 52322 1 134 . 1 . 1 38 38 THR C C 13 179.041 . . . . . . . . 37 T CO . 52322 1 135 . 1 . 1 38 38 THR CA C 13 56.998 . . . . . . . . 37 T CA . 52322 1 136 . 1 . 1 38 38 THR N N 15 120.054 . . . . . . . . 37 T N . 52322 1 137 . 1 . 1 40 40 ALA H H 1 8.396 . . . . . . . . 39 A HN . 52322 1 138 . 1 . 1 40 40 ALA C C 13 177.872 . . . . . . . . 39 A CO . 52322 1 139 . 1 . 1 40 40 ALA CA C 13 52.763 . . . . . . . . 39 A CA . 52322 1 140 . 1 . 1 40 40 ALA CB C 13 18.802 . . . . . . . . 39 A CB . 52322 1 141 . 1 . 1 40 40 ALA N N 15 124.561 . . . . . . . . 39 A N . 52322 1 142 . 1 . 1 41 41 LYS H H 1 8.306 . . . . . . . . 40 K HN . 52322 1 143 . 1 . 1 41 41 LYS C C 13 176.802 . . . . . . . . 40 K CO . 52322 1 144 . 1 . 1 41 41 LYS CA C 13 56.321 . . . . . . . . 40 K CA . 52322 1 145 . 1 . 1 41 41 LYS CB C 13 33.286 . . . . . . . . 40 K CB . 52322 1 146 . 1 . 1 41 41 LYS N N 15 120.886 . . . . . . . . 40 K N . 52322 1 147 . 1 . 1 42 42 THR H H 1 8.217 . . . . . . . . 41 T HN . 52322 1 148 . 1 . 1 42 42 THR C C 13 174.505 . . . . . . . . 41 T CO . 52322 1 149 . 1 . 1 42 42 THR CA C 13 61.875 . . . . . . . . 41 T CA . 52322 1 150 . 1 . 1 42 42 THR CB C 13 70.046 . . . . . . . . 41 T CB . 52322 1 151 . 1 . 1 42 42 THR N N 15 116.473 . . . . . . . . 41 T N . 52322 1 152 . 1 . 1 43 43 ILE H H 1 8.215 . . . . . . . . 42 I HN . 52322 1 153 . 1 . 1 43 43 ILE C C 13 175.836 . . . . . . . . 42 I CO . 52322 1 154 . 1 . 1 43 43 ILE CA C 13 61.131 . . . . . . . . 42 I CA . 52322 1 155 . 1 . 1 43 43 ILE CB C 13 39.112 . . . . . . . . 42 I CB . 52322 1 156 . 1 . 1 43 43 ILE N N 15 122.943 . . . . . . . . 42 I N . 52322 1 157 . 1 . 1 44 44 GLU H H 1 8.419 . . . . . . . . 43 E HN . 52322 1 158 . 1 . 1 44 44 GLU C C 13 177.868 . . . . . . . . 43 E CO . 52322 1 159 . 1 . 1 44 44 GLU N N 15 124.634 . . . . . . . . 43 E N . 52322 1 160 . 1 . 1 45 45 THR H H 1 8.180 . . . . . . . . 44 T HN . 52322 1 161 . 1 . 1 45 45 THR C C 13 172.893 . . . . . . . . 44 T CO . 52322 1 162 . 1 . 1 45 45 THR N N 15 116.329 . . . . . . . . 44 T N . 52322 1 163 . 1 . 1 49 49 VAL H H 1 8.174 . . . . . . . . 48 V HN . 52322 1 164 . 1 . 1 49 49 VAL C C 13 175.975 . . . . . . . . 48 V CO . 52322 1 165 . 1 . 1 49 49 VAL CA C 13 62.214 . . . . . . . . 48 V CA . 52322 1 166 . 1 . 1 49 49 VAL CB C 13 33.488 . . . . . . . . 48 V CB . 52322 1 167 . 1 . 1 49 49 VAL N N 15 119.872 . . . . . . . . 48 V N . 52322 1 168 . 1 . 1 50 50 ASP H H 1 8.355 . . . . . . . . 49 D HN . 52322 1 169 . 1 . 1 50 50 ASP C C 13 176.697 . . . . . . . . 49 D CO . 52322 1 170 . 1 . 1 50 50 ASP CA C 13 53.952 . . . . . . . . 49 D CA . 52322 1 171 . 1 . 1 50 50 ASP CB C 13 41.000 . . . . . . . . 49 D CB . 52322 1 172 . 1 . 1 50 50 ASP N N 15 123.951 . . . . . . . . 49 D N . 52322 1 173 . 1 . 1 51 51 ILE H H 1 8.008 . . . . . . . . 50 I HN . 52322 1 174 . 1 . 1 51 51 ILE C C 13 176.364 . . . . . . . . 50 I CO . 52322 1 175 . 1 . 1 51 51 ILE CA C 13 62.027 . . . . . . . . 50 I CA . 52322 1 176 . 1 . 1 51 51 ILE CB C 13 38.546 . . . . . . . . 50 I CB . 52322 1 177 . 1 . 1 51 51 ILE N N 15 120.990 . . . . . . . . 50 I N . 52322 1 178 . 1 . 1 52 52 PHE H H 1 8.192 . . . . . . . . 51 F HN . 52322 1 179 . 1 . 1 52 52 PHE C C 13 176.026 . . . . . . . . 51 F CO . 52322 1 180 . 1 . 1 52 52 PHE CA C 13 57.966 . . . . . . . . 51 F CA . 52322 1 181 . 1 . 1 52 52 PHE CB C 13 39.079 . . . . . . . . 51 F CB . 52322 1 182 . 1 . 1 52 52 PHE N N 15 122.243 . . . . . . . . 51 F N . 52322 1 183 . 1 . 1 53 53 ALA H H 1 7.968 . . . . . . . . 52 A HN . 52322 1 184 . 1 . 1 53 53 ALA C C 13 178.078 . . . . . . . . 52 A CO . 52322 1 185 . 1 . 1 53 53 ALA CA C 13 52.962 . . . . . . . . 52 A CA . 52322 1 186 . 1 . 1 53 53 ALA CB C 13 19.311 . . . . . . . . 52 A CB . 52322 1 187 . 1 . 1 53 53 ALA N N 15 124.675 . . . . . . . . 52 A N . 52322 1 188 . 1 . 1 54 54 THR H H 1 8.027 . . . . . . . . 53 T HN . 52322 1 189 . 1 . 1 54 54 THR C C 13 174.756 . . . . . . . . 53 T CO . 52322 1 190 . 1 . 1 54 54 THR CA C 13 62.067 . . . . . . . . 53 T CA . 52322 1 191 . 1 . 1 54 54 THR CB C 13 69.989 . . . . . . . . 53 T CB . 52322 1 192 . 1 . 1 54 54 THR N N 15 112.983 . . . . . . . . 53 T N . 52322 1 193 . 1 . 1 55 55 ALA H H 1 8.276 . . . . . . . . 54 A HN . 52322 1 194 . 1 . 1 55 55 ALA C C 13 178.008 . . . . . . . . 54 A CO . 52322 1 195 . 1 . 1 55 55 ALA CA C 13 53.135 . . . . . . . . 54 A CA . 52322 1 196 . 1 . 1 55 55 ALA CB C 13 18.632 . . . . . . . . 54 A CB . 52322 1 197 . 1 . 1 55 55 ALA N N 15 126.320 . . . . . . . . 54 A N . 52322 1 198 . 1 . 1 56 56 SER H H 1 8.230 . . . . . . . . 55 S HN . 52322 1 199 . 1 . 1 56 56 SER C C 13 174.528 . . . . . . . . 55 S CO . 52322 1 200 . 1 . 1 56 56 SER CA C 13 58.436 . . . . . . . . 55 S CA . 52322 1 201 . 1 . 1 56 56 SER CB C 13 63.876 . . . . . . . . 55 S CB . 52322 1 202 . 1 . 1 56 56 SER N N 15 114.999 . . . . . . . . 55 S N . 52322 1 203 . 1 . 1 57 57 ALA H H 1 8.213 . . . . . . . . 56 A HN . 52322 1 204 . 1 . 1 57 57 ALA C C 13 177.424 . . . . . . . . 56 A CO . 52322 1 205 . 1 . 1 57 57 ALA CA C 13 52.539 . . . . . . . . 56 A CA . 52322 1 206 . 1 . 1 57 57 ALA CB C 13 19.326 . . . . . . . . 56 A CB . 52322 1 207 . 1 . 1 57 57 ALA N N 15 125.935 . . . . . . . . 56 A N . 52322 1 208 . 1 . 1 58 58 ALA H H 1 8.208 . . . . . . . . 57 A HN . 52322 1 209 . 1 . 1 58 58 ALA C C 13 177.174 . . . . . . . . 57 A CO . 52322 1 210 . 1 . 1 58 58 ALA CA C 13 52.150 . . . . . . . . 57 A CA . 52322 1 211 . 1 . 1 58 58 ALA CB C 13 19.367 . . . . . . . . 57 A CB . 52322 1 212 . 1 . 1 58 58 ALA N N 15 123.332 . . . . . . . . 57 A N . 52322 1 213 . 1 . 1 59 59 ALA H H 1 8.171 . . . . . . . . 58 A HN . 52322 1 214 . 1 . 1 59 59 ALA C C 13 175.648 . . . . . . . . 58 A CO . 52322 1 215 . 1 . 1 59 59 ALA CA C 13 50.509 . . . . . . . . 58 A CA . 52322 1 216 . 1 . 1 59 59 ALA CB C 13 18.576 . . . . . . . . 58 A CB . 52322 1 217 . 1 . 1 59 59 ALA N N 15 124.871 . . . . . . . . 58 A N . 52322 1 218 . 1 . 1 61 61 VAL H H 1 8.263 . . . . . . . . 60 V HN . 52322 1 219 . 1 . 1 61 61 VAL C C 13 176.608 . . . . . . . . 60 V CO . 52322 1 220 . 1 . 1 61 61 VAL CA C 13 62.410 . . . . . . . . 60 V CA . 52322 1 221 . 1 . 1 61 61 VAL CB C 13 32.933 . . . . . . . . 60 V CB . 52322 1 222 . 1 . 1 61 61 VAL N N 15 120.429 . . . . . . . . 60 V N . 52322 1 223 . 1 . 1 62 62 SER H H 1 8.411 . . . . . . . . 61 S HN . 52322 1 224 . 1 . 1 62 62 SER C C 13 174.708 . . . . . . . . 61 S CO . 52322 1 225 . 1 . 1 62 62 SER CA C 13 58.271 . . . . . . . . 61 S CA . 52322 1 226 . 1 . 1 62 62 SER CB C 13 63.949 . . . . . . . . 61 S CB . 52322 1 227 . 1 . 1 62 62 SER N N 15 119.377 . . . . . . . . 61 S N . 52322 1 228 . 1 . 1 63 63 SER H H 1 8.189 . . . . . . . . 62 S HN . 52322 1 229 . 1 . 1 63 63 SER C C 13 174.187 . . . . . . . . 62 S CO . 52322 1 230 . 1 . 1 63 63 SER CA C 13 58.313 . . . . . . . . 62 S CA . 52322 1 231 . 1 . 1 63 63 SER CB C 13 64.042 . . . . . . . . 62 S CB . 52322 1 232 . 1 . 1 63 63 SER N N 15 117.642 . . . . . . . . 62 S N . 52322 1 233 . 1 . 1 64 64 ALA H H 1 8.253 . . . . . . . . 63 A HN . 52322 1 234 . 1 . 1 64 64 ALA C C 13 177.478 . . . . . . . . 63 A CO . 52322 1 235 . 1 . 1 64 64 ALA CA C 13 52.565 . . . . . . . . 63 A CA . 52322 1 236 . 1 . 1 64 64 ALA CB C 13 19.423 . . . . . . . . 63 A CB . 52322 1 237 . 1 . 1 64 64 ALA N N 15 125.930 . . . . . . . . 63 A N . 52322 1 238 . 1 . 1 65 65 LYS H H 1 8.276 . . . . . . . . 64 K HN . 52322 1 239 . 1 . 1 65 65 LYS C C 13 174.682 . . . . . . . . 64 K CO . 52322 1 240 . 1 . 1 65 65 LYS CA C 13 54.255 . . . . . . . . 64 K CA . 52322 1 241 . 1 . 1 65 65 LYS CB C 13 32.709 . . . . . . . . 64 K CB . 52322 1 242 . 1 . 1 65 65 LYS N N 15 122.229 . . . . . . . . 64 K N . 52322 1 243 . 1 . 1 67 67 SER H H 1 8.442 . . . . . . . . 66 S HN . 52322 1 244 . 1 . 1 67 67 SER C C 13 175.053 . . . . . . . . 66 S CO . 52322 1 245 . 1 . 1 67 67 SER CA C 13 58.295 . . . . . . . . 66 S CA . 52322 1 246 . 1 . 1 67 67 SER CB C 13 63.424 . . . . . . . . 66 S CB . 52322 1 247 . 1 . 1 67 67 SER N N 15 116.311 . . . . . . . . 66 S N . 52322 1 248 . 1 . 1 68 68 SER H H 1 8.377 . . . . . . . . 67 S HN . 52322 1 249 . 1 . 1 68 68 SER C C 13 174.478 . . . . . . . . 67 S CO . 52322 1 250 . 1 . 1 68 68 SER CA C 13 58.802 . . . . . . . . 67 S CA . 52322 1 251 . 1 . 1 68 68 SER CB C 13 63.932 . . . . . . . . 67 S CB . 52322 1 252 . 1 . 1 68 68 SER N N 15 117.615 . . . . . . . . 67 S N . 52322 1 253 . 1 . 1 69 69 ASP H H 1 8.355 . . . . . . . . 68 D HN . 52322 1 254 . 1 . 1 69 69 ASP C C 13 176.396 . . . . . . . . 68 D CO . 52322 1 255 . 1 . 1 69 69 ASP CA C 13 54.791 . . . . . . . . 68 D CA . 52322 1 256 . 1 . 1 69 69 ASP CB C 13 41.174 . . . . . . . . 68 D CB . 52322 1 257 . 1 . 1 69 69 ASP N N 15 122.247 . . . . . . . . 68 D N . 52322 1 258 . 1 . 1 70 70 LEU H H 1 8.034 . . . . . . . . 69 L HN . 52322 1 259 . 1 . 1 70 70 LEU C C 13 177.642 . . . . . . . . 69 L CO . 52322 1 260 . 1 . 1 70 70 LEU CA C 13 55.614 . . . . . . . . 69 L CA . 52322 1 261 . 1 . 1 70 70 LEU CB C 13 42.175 . . . . . . . . 69 L CB . 52322 1 262 . 1 . 1 70 70 LEU N N 15 121.505 . . . . . . . . 69 L N . 52322 1 263 . 1 . 1 71 71 LEU H H 1 8.071 . . . . . . . . 70 L HN . 52322 1 264 . 1 . 1 71 71 LEU C C 13 177.273 . . . . . . . . 70 L CO . 52322 1 265 . 1 . 1 71 71 LEU CA C 13 55.547 . . . . . . . . 70 L CA . 52322 1 266 . 1 . 1 71 71 LEU CB C 13 42.377 . . . . . . . . 70 L CB . 52322 1 267 . 1 . 1 71 71 LEU N N 15 121.813 . . . . . . . . 70 L N . 52322 1 268 . 1 . 1 72 72 ASP H H 1 8.176 . . . . . . . . 71 D HN . 52322 1 269 . 1 . 1 72 72 ASP C C 13 176.030 . . . . . . . . 71 D CO . 52322 1 270 . 1 . 1 72 72 ASP CA C 13 54.427 . . . . . . . . 71 D CA . 52322 1 271 . 1 . 1 72 72 ASP CB C 13 41.087 . . . . . . . . 71 D CB . 52322 1 272 . 1 . 1 72 72 ASP N N 15 120.596 . . . . . . . . 71 D N . 52322 1 273 . 1 . 1 73 73 LEU H H 1 7.966 . . . . . . . . 72 L HN . 52322 1 274 . 1 . 1 73 73 LEU C C 13 177.299 . . . . . . . . 72 L CO . 52322 1 275 . 1 . 1 73 73 LEU CA C 13 55.103 . . . . . . . . 72 L CA . 52322 1 276 . 1 . 1 73 73 LEU CB C 13 42.513 . . . . . . . . 72 L CB . 52322 1 277 . 1 . 1 73 73 LEU N N 15 121.862 . . . . . . . . 72 L N . 52322 1 278 . 1 . 1 74 74 GLN H H 1 8.332 . . . . . . . . 73 Q HN . 52322 1 279 . 1 . 1 74 74 GLN C C 13 174.165 . . . . . . . . 73 Q CO . 52322 1 280 . 1 . 1 74 74 GLN CA C 13 53.727 . . . . . . . . 73 Q CA . 52322 1 281 . 1 . 1 74 74 GLN CB C 13 29.020 . . . . . . . . 73 Q CB . 52322 1 282 . 1 . 1 74 74 GLN N N 15 122.090 . . . . . . . . 73 Q N . 52322 1 283 . 1 . 1 76 76 ASP H H 1 8.314 . . . . . . . . 75 D HN . 52322 1 284 . 1 . 1 76 76 ASP C C 13 176.432 . . . . . . . . 75 D CO . 52322 1 285 . 1 . 1 76 76 ASP CA C 13 54.069 . . . . . . . . 75 D CA . 52322 1 286 . 1 . 1 76 76 ASP CB C 13 41.221 . . . . . . . . 75 D CB . 52322 1 287 . 1 . 1 76 76 ASP N N 15 119.598 . . . . . . . . 75 D N . 52322 1 288 . 1 . 1 77 77 PHE H H 1 8.253 . . . . . . . . 76 F HN . 52322 1 289 . 1 . 1 77 77 PHE C C 13 176.396 . . . . . . . . 76 F CO . 52322 1 290 . 1 . 1 77 77 PHE CA C 13 57.993 . . . . . . . . 76 F CA . 52322 1 291 . 1 . 1 77 77 PHE CB C 13 39.305 . . . . . . . . 76 F CB . 52322 1 292 . 1 . 1 77 77 PHE N N 15 121.702 . . . . . . . . 76 F N . 52322 1 293 . 1 . 1 78 78 SER H H 1 8.351 . . . . . . . . 77 S HN . 52322 1 294 . 1 . 1 78 78 SER C C 13 175.209 . . . . . . . . 77 S CO . 52322 1 295 . 1 . 1 78 78 SER CA C 13 59.090 . . . . . . . . 77 S CA . 52322 1 296 . 1 . 1 78 78 SER CB C 13 63.989 . . . . . . . . 77 S CB . 52322 1 297 . 1 . 1 78 78 SER N N 15 117.754 . . . . . . . . 77 S N . 52322 1 298 . 1 . 1 79 79 GLY H H 1 8.021 . . . . . . . . 78 G HN . 52322 1 299 . 1 . 1 79 79 GLY C C 13 174.220 . . . . . . . . 78 G CO . 52322 1 300 . 1 . 1 79 79 GLY CA C 13 45.551 . . . . . . . . 78 G CA . 52322 1 301 . 1 . 1 79 79 GLY N N 15 110.617 . . . . . . . . 78 G N . 52322 1 302 . 1 . 1 80 80 ALA H H 1 8.062 . . . . . . . . 79 A HN . 52322 1 303 . 1 . 1 80 80 ALA C C 13 177.917 . . . . . . . . 79 A CO . 52322 1 304 . 1 . 1 80 80 ALA CA C 13 52.808 . . . . . . . . 79 A CA . 52322 1 305 . 1 . 1 80 80 ALA CB C 13 19.159 . . . . . . . . 79 A CB . 52322 1 306 . 1 . 1 80 80 ALA N N 15 123.844 . . . . . . . . 79 A N . 52322 1 307 . 1 . 1 81 81 ALA H H 1 8.254 . . . . . . . . 80 A HN . 52322 1 308 . 1 . 1 81 81 ALA C C 13 177.886 . . . . . . . . 80 A CO . 52322 1 309 . 1 . 1 81 81 ALA CA C 13 52.614 . . . . . . . . 80 A CA . 52322 1 310 . 1 . 1 81 81 ALA CB C 13 19.141 . . . . . . . . 80 A CB . 52322 1 311 . 1 . 1 81 81 ALA N N 15 123.077 . . . . . . . . 80 A N . 52322 1 312 . 1 . 1 82 82 ALA H H 1 8.177 . . . . . . . . 81 A HN . 52322 1 313 . 1 . 1 82 82 ALA C C 13 178.567 . . . . . . . . 81 A CO . 52322 1 314 . 1 . 1 82 82 ALA CA C 13 52.916 . . . . . . . . 81 A CA . 52322 1 315 . 1 . 1 82 82 ALA CB C 13 19.423 . . . . . . . . 81 A CB . 52322 1 316 . 1 . 1 82 82 ALA N N 15 123.096 . . . . . . . . 81 A N . 52322 1 317 . 1 . 1 83 83 GLY H H 1 8.276 . . . . . . . . 82 G HN . 52322 1 318 . 1 . 1 83 83 GLY C C 13 174.089 . . . . . . . . 82 G CO . 52322 1 319 . 1 . 1 83 83 GLY CA C 13 45.318 . . . . . . . . 82 G CA . 52322 1 320 . 1 . 1 83 83 GLY N N 15 108.081 . . . . . . . . 82 G N . 52322 1 321 . 1 . 1 84 84 ALA H H 1 8.026 . . . . . . . . 83 A HN . 52322 1 322 . 1 . 1 84 84 ALA C C 13 177.496 . . . . . . . . 83 A CO . 52322 1 323 . 1 . 1 84 84 ALA CA C 13 52.435 . . . . . . . . 83 A CA . 52322 1 324 . 1 . 1 84 84 ALA CB C 13 19.875 . . . . . . . . 83 A CB . 52322 1 325 . 1 . 1 84 84 ALA N N 15 123.698 . . . . . . . . 83 A N . 52322 1 326 . 1 . 1 85 85 ALA H H 1 8.196 . . . . . . . . 84 A HN . 52322 1 327 . 1 . 1 85 85 ALA C C 13 177.183 . . . . . . . . 84 A CO . 52322 1 328 . 1 . 1 85 85 ALA CA C 13 52.119 . . . . . . . . 84 A CA . 52322 1 329 . 1 . 1 85 85 ALA CB C 13 19.423 . . . . . . . . 84 A CB . 52322 1 330 . 1 . 1 85 85 ALA N N 15 123.321 . . . . . . . . 84 A N . 52322 1 331 . 1 . 1 86 86 ALA H H 1 8.154 . . . . . . . . 85 A HN . 52322 1 332 . 1 . 1 86 86 ALA C C 13 175.655 . . . . . . . . 85 A CO . 52322 1 333 . 1 . 1 86 86 ALA CA C 13 50.534 . . . . . . . . 85 A CA . 52322 1 334 . 1 . 1 86 86 ALA CB C 13 17.785 . . . . . . . . 85 A CB . 52322 1 335 . 1 . 1 86 86 ALA N N 15 124.806 . . . . . . . . 85 A N . 52322 1 336 . 1 . 1 88 88 VAL H H 1 8.213 . . . . . . . . 87 V HN . 52322 1 337 . 1 . 1 88 88 VAL C C 13 174.431 . . . . . . . . 87 V CO . 52322 1 338 . 1 . 1 88 88 VAL CA C 13 59.840 . . . . . . . . 87 V CA . 52322 1 339 . 1 . 1 88 88 VAL CB C 13 32.790 . . . . . . . . 87 V CB . 52322 1 340 . 1 . 1 88 88 VAL N N 15 122.070 . . . . . . . . 87 V N . 52322 1 341 . 1 . 1 92 92 THR H H 1 8.191 . . . . . . . . 91 T HN . 52322 1 342 . 1 . 1 92 92 THR C C 13 175.472 . . . . . . . . 91 T CO . 52322 1 343 . 1 . 1 92 92 THR CA C 13 61.967 . . . . . . . . 91 T CA . 52322 1 344 . 1 . 1 92 92 THR CB C 13 70.089 . . . . . . . . 91 T CB . 52322 1 345 . 1 . 1 92 92 THR N N 15 113.787 . . . . . . . . 91 T N . 52322 1 346 . 1 . 1 93 93 GLY H H 1 8.419 . . . . . . . . 92 G HN . 52322 1 347 . 1 . 1 93 93 GLY C C 13 174.769 . . . . . . . . 92 G CO . 52322 1 348 . 1 . 1 93 93 GLY CA C 13 45.572 . . . . . . . . 92 G CA . 52322 1 349 . 1 . 1 93 93 GLY N N 15 111.084 . . . . . . . . 92 G N . 52322 1 350 . 1 . 1 94 94 GLY H H 1 8.271 . . . . . . . . 93 G HN . 52322 1 351 . 1 . 1 94 94 GLY C C 13 174.021 . . . . . . . . 93 G CO . 52322 1 352 . 1 . 1 94 94 GLY CA C 13 45.346 . . . . . . . . 93 G CA . 52322 1 353 . 1 . 1 94 94 GLY N N 15 108.827 . . . . . . . . 93 G N . 52322 1 354 . 1 . 1 95 95 ALA H H 1 8.231 . . . . . . . . 94 A HN . 52322 1 355 . 1 . 1 95 95 ALA C C 13 178.138 . . . . . . . . 94 A CO . 52322 1 356 . 1 . 1 95 95 ALA CA C 13 52.630 . . . . . . . . 94 A CA . 52322 1 357 . 1 . 1 95 95 ALA CB C 13 19.320 . . . . . . . . 94 A CB . 52322 1 358 . 1 . 1 95 95 ALA N N 15 123.677 . . . . . . . . 94 A N . 52322 1 359 . 1 . 1 96 96 THR H H 1 8.108 . . . . . . . . 95 T HN . 52322 1 360 . 1 . 1 96 96 THR C C 13 174.474 . . . . . . . . 95 T CO . 52322 1 361 . 1 . 1 96 96 THR CA C 13 61.831 . . . . . . . . 95 T CA . 52322 1 362 . 1 . 1 96 96 THR CB C 13 70.091 . . . . . . . . 95 T CB . 52322 1 363 . 1 . 1 96 96 THR N N 15 113.129 . . . . . . . . 95 T N . 52322 1 364 . 1 . 1 97 97 ALA H H 1 8.226 . . . . . . . . 96 A HN . 52322 1 365 . 1 . 1 97 97 ALA C C 13 177.320 . . . . . . . . 96 A CO . 52322 1 366 . 1 . 1 97 97 ALA CA C 13 52.342 . . . . . . . . 96 A CA . 52322 1 367 . 1 . 1 97 97 ALA CB C 13 19.875 . . . . . . . . 96 A CB . 52322 1 368 . 1 . 1 97 97 ALA N N 15 126.177 . . . . . . . . 96 A N . 52322 1 369 . 1 . 1 98 98 TRP H H 1 8.017 . . . . . . . . 97 W HN . 52322 1 370 . 1 . 1 98 98 TRP C C 13 177.042 . . . . . . . . 97 W CO . 52322 1 371 . 1 . 1 98 98 TRP CA C 13 57.681 . . . . . . . . 97 W CA . 52322 1 372 . 1 . 1 98 98 TRP CB C 13 29.678 . . . . . . . . 97 W CB . 52322 1 373 . 1 . 1 98 98 TRP N N 15 119.955 . . . . . . . . 97 W N . 52322 1 374 . 1 . 1 99 99 GLY H H 1 8.146 . . . . . . . . 98 G HN . 52322 1 375 . 1 . 1 99 99 GLY C C 13 174.094 . . . . . . . . 98 G CO . 52322 1 376 . 1 . 1 99 99 GLY CA C 13 45.695 . . . . . . . . 98 G CA . 52322 1 377 . 1 . 1 99 99 GLY N N 15 109.886 . . . . . . . . 98 G N . 52322 1 378 . 1 . 1 100 100 ASP H H 1 8.085 . . . . . . . . 99 D HN . 52322 1 379 . 1 . 1 100 100 ASP C C 13 176.539 . . . . . . . . 99 D CO . 52322 1 380 . 1 . 1 100 100 ASP CA C 13 54.660 . . . . . . . . 99 D CA . 52322 1 381 . 1 . 1 100 100 ASP CB C 13 41.265 . . . . . . . . 99 D CB . 52322 1 382 . 1 . 1 100 100 ASP N N 15 120.405 . . . . . . . . 99 D N . 52322 1 383 . 1 . 1 101 101 LEU H H 1 8.127 . . . . . . . . 100 L HN . 52322 1 384 . 1 . 1 101 101 LEU C C 13 177.593 . . . . . . . . 100 L CO . 52322 1 385 . 1 . 1 101 101 LEU CA C 13 55.584 . . . . . . . . 100 L CA . 52322 1 386 . 1 . 1 101 101 LEU CB C 13 42.227 . . . . . . . . 100 L CB . 52322 1 387 . 1 . 1 101 101 LEU N N 15 121.760 . . . . . . . . 100 L N . 52322 1 388 . 1 . 1 102 102 LEU H H 1 8.159 . . . . . . . . 101 L HN . 52322 1 389 . 1 . 1 102 102 LEU C C 13 178.024 . . . . . . . . 101 L CO . 52322 1 390 . 1 . 1 102 102 LEU CA C 13 55.339 . . . . . . . . 101 L CA . 52322 1 391 . 1 . 1 102 102 LEU CB C 13 42.299 . . . . . . . . 101 L CB . 52322 1 392 . 1 . 1 102 102 LEU N N 15 121.806 . . . . . . . . 101 L N . 52322 1 393 . 1 . 1 103 103 GLY H H 1 8.253 . . . . . . . . 102 G HN . 52322 1 394 . 1 . 1 103 103 GLY C C 13 174.600 . . . . . . . . 102 G CO . 52322 1 395 . 1 . 1 103 103 GLY CA C 13 45.459 . . . . . . . . 102 G CA . 52322 1 396 . 1 . 1 103 103 GLY N N 15 109.136 . . . . . . . . 102 G N . 52322 1 397 . 1 . 1 104 104 GLU H H 1 8.354 . . . . . . . . 103 E HN . 52322 1 398 . 1 . 1 104 104 GLU C C 13 176.866 . . . . . . . . 103 E CO . 52322 1 399 . 1 . 1 104 104 GLU CA C 13 57.180 . . . . . . . . 103 E CA . 52322 1 400 . 1 . 1 104 104 GLU CB C 13 30.290 . . . . . . . . 103 E CB . 52322 1 401 . 1 . 1 104 104 GLU N N 15 120.709 . . . . . . . . 103 E N . 52322 1 402 . 1 . 1 105 105 ASP H H 1 8.475 . . . . . . . . 104 D HN . 52322 1 403 . 1 . 1 105 105 ASP C C 13 176.947 . . . . . . . . 104 D CO . 52322 1 404 . 1 . 1 105 105 ASP CA C 13 54.777 . . . . . . . . 104 D CA . 52322 1 405 . 1 . 1 105 105 ASP CB C 13 41.012 . . . . . . . . 104 D CB . 52322 1 406 . 1 . 1 105 105 ASP N N 15 120.736 . . . . . . . . 104 D N . 52322 1 407 . 1 . 1 106 106 SER H H 1 8.174 . . . . . . . . 105 S HN . 52322 1 408 . 1 . 1 106 106 SER C C 13 175.296 . . . . . . . . 105 S CO . 52322 1 409 . 1 . 1 106 106 SER CA C 13 59.557 . . . . . . . . 105 S CA . 52322 1 410 . 1 . 1 106 106 SER CB C 13 63.763 . . . . . . . . 105 S CB . 52322 1 411 . 1 . 1 106 106 SER N N 15 116.522 . . . . . . . . 105 S N . 52322 1 412 . 1 . 1 107 107 LEU H H 1 8.159 . . . . . . . . 106 L HN . 52322 1 413 . 1 . 1 107 107 LEU C C 13 178.136 . . . . . . . . 106 L CO . 52322 1 414 . 1 . 1 107 107 LEU CA C 13 55.926 . . . . . . . . 106 L CA . 52322 1 415 . 1 . 1 107 107 LEU CB C 13 42.350 . . . . . . . . 106 L CB . 52322 1 416 . 1 . 1 107 107 LEU N N 15 123.221 . . . . . . . . 106 L N . 52322 1 417 . 1 . 1 108 108 ALA H H 1 8.039 . . . . . . . . 107 A HN . 52322 1 418 . 1 . 1 108 108 ALA C C 13 178.198 . . . . . . . . 107 A CO . 52322 1 419 . 1 . 1 108 108 ALA CA C 13 53.309 . . . . . . . . 107 A CA . 52322 1 420 . 1 . 1 108 108 ALA CB C 13 18.632 . . . . . . . . 107 A CB . 52322 1 421 . 1 . 1 108 108 ALA N N 15 123.683 . . . . . . . . 107 A N . 52322 1 422 . 1 . 1 109 109 ALA H H 1 8.004 . . . . . . . . 108 A HN . 52322 1 423 . 1 . 1 109 109 ALA C C 13 178.305 . . . . . . . . 108 A CO . 52322 1 424 . 1 . 1 109 109 ALA CA C 13 52.933 . . . . . . . . 108 A CA . 52322 1 425 . 1 . 1 109 109 ALA CB C 13 19.009 . . . . . . . . 108 A CB . 52322 1 426 . 1 . 1 109 109 ALA N N 15 121.877 . . . . . . . . 108 A N . 52322 1 427 . 1 . 1 110 110 LEU H H 1 8.005 . . . . . . . . 109 L HN . 52322 1 428 . 1 . 1 110 110 LEU C C 13 177.887 . . . . . . . . 109 L CO . 52322 1 429 . 1 . 1 110 110 LEU CA C 13 55.558 . . . . . . . . 109 L CA . 52322 1 430 . 1 . 1 110 110 LEU CB C 13 42.368 . . . . . . . . 109 L CB . 52322 1 431 . 1 . 1 110 110 LEU N N 15 120.325 . . . . . . . . 109 L N . 52322 1 432 . 1 . 1 111 111 SER H H 1 8.127 . . . . . . . . 110 S HN . 52322 1 433 . 1 . 1 111 111 SER CA C 13 58.524 . . . . . . . . 110 S CA . 52322 1 434 . 1 . 1 111 111 SER CB C 13 63.984 . . . . . . . . 110 S CB . 52322 1 435 . 1 . 1 111 111 SER N N 15 115.572 . . . . . . . . 110 S N . 52322 1 436 . 1 . 1 112 112 SER H H 1 8.355 . . . . . . . . 111 S HN . 52322 1 437 . 1 . 1 112 112 SER C C 13 174.178 . . . . . . . . 111 S CO . 52322 1 438 . 1 . 1 112 112 SER CA C 13 58.322 . . . . . . . . 111 S CA . 52322 1 439 . 1 . 1 112 112 SER CB C 13 63.933 . . . . . . . . 111 S CB . 52322 1 440 . 1 . 1 112 112 SER N N 15 118.206 . . . . . . . . 111 S N . 52322 1 441 . 1 . 1 113 113 VAL H H 1 8.088 . . . . . . . . 112 V HN . 52322 1 442 . 1 . 1 113 113 VAL C C 13 177.524 . . . . . . . . 112 V CO . 52322 1 443 . 1 . 1 113 113 VAL CA C 13 55.661 . . . . . . . . 112 V CA . 52322 1 444 . 1 . 1 113 113 VAL CB C 13 32.923 . . . . . . . . 112 V CB . 52322 1 445 . 1 . 1 113 113 VAL N N 15 123.048 . . . . . . . . 112 V N . 52322 1 446 . 1 . 1 115 115 SER H H 1 8.172 . . . . . . . . 114 S HN . 52322 1 447 . 1 . 1 115 115 SER C C 13 174.722 . . . . . . . . 114 S CO . 52322 1 448 . 1 . 1 115 115 SER CA C 13 58.481 . . . . . . . . 114 S CA . 52322 1 449 . 1 . 1 115 115 SER CB C 13 63.894 . . . . . . . . 114 S CB . 52322 1 450 . 1 . 1 115 115 SER N N 15 116.348 . . . . . . . . 114 S N . 52322 1 451 . 1 . 1 116 116 GLU H H 1 8.373 . . . . . . . . 115 E HN . 52322 1 452 . 1 . 1 116 116 GLU C C 13 175.849 . . . . . . . . 115 E CO . 52322 1 453 . 1 . 1 116 116 GLU CA C 13 56.230 . . . . . . . . 115 E CA . 52322 1 454 . 1 . 1 116 116 GLU CB C 13 30.654 . . . . . . . . 115 E CB . 52322 1 455 . 1 . 1 116 116 GLU N N 15 122.693 . . . . . . . . 115 E N . 52322 1 456 . 1 . 1 117 117 ALA H H 1 8.283 . . . . . . . . 116 A HN . 52322 1 457 . 1 . 1 117 117 ALA C C 13 175.542 . . . . . . . . 116 A CO . 52322 1 458 . 1 . 1 117 117 ALA CA C 13 50.625 . . . . . . . . 116 A CA . 52322 1 459 . 1 . 1 117 117 ALA CB C 13 18.971 . . . . . . . . 116 A CB . 52322 1 460 . 1 . 1 117 117 ALA N N 15 126.648 . . . . . . . . 116 A N . 52322 1 461 . 1 . 1 119 119 ILE H H 1 8.262 . . . . . . . . 118 I HN . 52322 1 462 . 1 . 1 119 119 ILE CA C 13 61.206 . . . . . . . . 118 I CA . 52322 1 463 . 1 . 1 119 119 ILE CB C 13 38.741 . . . . . . . . 118 I CB . 52322 1 464 . 1 . 1 119 119 ILE N N 15 121.204 . . . . . . . . 118 I N . 52322 1 465 . 1 . 1 120 120 SER H H 1 8.322 . . . . . . . . 119 S HN . 52322 1 466 . 1 . 1 120 120 SER C C 13 173.789 . . . . . . . . 119 S CO . 52322 1 467 . 1 . 1 120 120 SER CA C 13 57.066 . . . . . . . . 119 S CA . 52322 1 468 . 1 . 1 120 120 SER CB C 13 64.161 . . . . . . . . 119 S CB . 52322 1 469 . 1 . 1 120 120 SER N N 15 120.072 . . . . . . . . 119 S N . 52322 1 470 . 1 . 1 123 123 PHE H H 1 8.225 . . . . . . . . 122 F HN . 52322 1 471 . 1 . 1 123 123 PHE C C 13 175.383 . . . . . . . . 122 F CO . 52322 1 472 . 1 . 1 123 123 PHE CA C 13 57.370 . . . . . . . . 122 F CA . 52322 1 473 . 1 . 1 123 123 PHE CB C 13 39.305 . . . . . . . . 122 F CB . 52322 1 474 . 1 . 1 123 123 PHE N N 15 118.822 . . . . . . . . 122 F N . 52322 1 475 . 1 . 1 124 124 ALA H H 1 7.775 . . . . . . . . 123 A HN . 52322 1 476 . 1 . 1 124 124 ALA C C 13 175.051 . . . . . . . . 123 A CO . 52322 1 477 . 1 . 1 124 124 ALA CA C 13 50.444 . . . . . . . . 123 A CA . 52322 1 478 . 1 . 1 124 124 ALA CB C 13 18.407 . . . . . . . . 123 A CB . 52322 1 479 . 1 . 1 124 124 ALA N N 15 126.384 . . . . . . . . 123 A N . 52322 1 480 . 1 . 1 126 126 GLU H H 1 8.442 . . . . . . . . 125 E HN . 52322 1 481 . 1 . 1 126 126 GLU C C 13 174.856 . . . . . . . . 125 E CO . 52322 1 482 . 1 . 1 126 126 GLU CA C 13 54.467 . . . . . . . . 125 E CA . 52322 1 483 . 1 . 1 126 126 GLU CB C 13 29.929 . . . . . . . . 125 E CB . 52322 1 484 . 1 . 1 126 126 GLU N N 15 122.489 . . . . . . . . 125 E N . 52322 1 485 . 1 . 1 128 128 SER H H 1 8.462 . . . . . . . . 127 S HN . 52322 1 486 . 1 . 1 128 128 SER C C 13 173.317 . . . . . . . . 127 S CO . 52322 1 487 . 1 . 1 128 128 SER CA C 13 56.296 . . . . . . . . 127 S CA . 52322 1 488 . 1 . 1 128 128 SER CB C 13 63.449 . . . . . . . . 127 S CB . 52322 1 489 . 1 . 1 128 128 SER N N 15 117.561 . . . . . . . . 127 S N . 52322 1 490 . 1 . 1 131 131 THR H H 1 8.310 . . . . . . . . 130 T HN . 52322 1 491 . 1 . 1 131 131 THR C C 13 174.972 . . . . . . . . 130 T CO . 52322 1 492 . 1 . 1 131 131 THR CA C 13 61.908 . . . . . . . . 130 T CA . 52322 1 493 . 1 . 1 131 131 THR CB C 13 70.053 . . . . . . . . 130 T CB . 52322 1 494 . 1 . 1 131 131 THR N N 15 114.497 . . . . . . . . 130 T N . 52322 1 495 . 1 . 1 132 132 THR H H 1 8.190 . . . . . . . . 131 T HN . 52322 1 496 . 1 . 1 132 132 THR C C 13 174.702 . . . . . . . . 131 T CO . 52322 1 497 . 1 . 1 132 132 THR CA C 13 61.622 . . . . . . . . 131 T CA . 52322 1 498 . 1 . 1 132 132 THR CB C 13 69.919 . . . . . . . . 131 T CB . 52322 1 499 . 1 . 1 132 132 THR N N 15 116.342 . . . . . . . . 131 T N . 52322 1 500 . 1 . 1 133 133 THR H H 1 8.211 . . . . . . . . 132 T HN . 52322 1 501 . 1 . 1 133 133 THR C C 13 174.447 . . . . . . . . 132 T CO . 52322 1 502 . 1 . 1 133 133 THR CA C 13 61.837 . . . . . . . . 132 T CA . 52322 1 503 . 1 . 1 133 133 THR CB C 13 69.976 . . . . . . . . 132 T CB . 52322 1 504 . 1 . 1 133 133 THR N N 15 116.754 . . . . . . . . 132 T N . 52322 1 505 . 1 . 1 134 134 THR H H 1 8.385 . . . . . . . . 133 T HN . 52322 1 506 . 1 . 1 134 134 THR C C 13 173.146 . . . . . . . . 133 T CO . 52322 1 507 . 1 . 1 134 134 THR N N 15 119.717 . . . . . . . . 133 T N . 52322 1 508 . 1 . 1 137 137 ALA H H 1 8.476 . . . . . . . . 136 A HN . 52322 1 509 . 1 . 1 137 137 ALA C C 13 178.238 . . . . . . . . 136 A CO . 52322 1 510 . 1 . 1 137 137 ALA CA C 13 52.828 . . . . . . . . 136 A CA . 52322 1 511 . 1 . 1 137 137 ALA CB C 13 19.139 . . . . . . . . 136 A CB . 52322 1 512 . 1 . 1 137 137 ALA N N 15 124.408 . . . . . . . . 136 A N . 52322 1 513 . 1 . 1 138 138 SER H H 1 8.250 . . . . . . . . 137 S HN . 52322 1 514 . 1 . 1 138 138 SER C C 13 174.785 . . . . . . . . 137 S CO . 52322 1 515 . 1 . 1 138 138 SER CA C 13 58.379 . . . . . . . . 137 S CA . 52322 1 516 . 1 . 1 138 138 SER CB C 13 63.989 . . . . . . . . 137 S CB . 52322 1 517 . 1 . 1 138 138 SER N N 15 114.788 . . . . . . . . 137 S N . 52322 1 518 . 1 . 1 139 139 ALA H H 1 8.357 . . . . . . . . 138 A HN . 52322 1 519 . 1 . 1 139 139 ALA C C 13 178.121 . . . . . . . . 138 A CO . 52322 1 520 . 1 . 1 139 139 ALA CA C 13 52.959 . . . . . . . . 138 A CA . 52322 1 521 . 1 . 1 139 139 ALA CB C 13 19.254 . . . . . . . . 138 A CB . 52322 1 522 . 1 . 1 139 139 ALA N N 15 126.201 . . . . . . . . 138 A N . 52322 1 523 . 1 . 1 140 140 SER H H 1 8.214 . . . . . . . . 139 S HN . 52322 1 524 . 1 . 1 140 140 SER C C 13 174.611 . . . . . . . . 139 S CO . 52322 1 525 . 1 . 1 140 140 SER CA C 13 58.464 . . . . . . . . 139 S CA . 52322 1 526 . 1 . 1 140 140 SER CB C 13 63.932 . . . . . . . . 139 S CB . 52322 1 527 . 1 . 1 140 140 SER N N 15 114.718 . . . . . . . . 139 S N . 52322 1 528 . 1 . 1 141 141 ALA H H 1 8.275 . . . . . . . . 140 A HN . 52322 1 529 . 1 . 1 141 141 ALA C C 13 178.061 . . . . . . . . 140 A CO . 52322 1 530 . 1 . 1 141 141 ALA CA C 13 52.887 . . . . . . . . 140 A CA . 52322 1 531 . 1 . 1 141 141 ALA CB C 13 19.141 . . . . . . . . 140 A CB . 52322 1 532 . 1 . 1 141 141 ALA N N 15 125.930 . . . . . . . . 140 A N . 52322 1 533 . 1 . 1 142 142 SER H H 1 8.268 . . . . . . . . 141 S HN . 52322 1 534 . 1 . 1 142 142 SER C C 13 174.674 . . . . . . . . 141 S CO . 52322 1 535 . 1 . 1 142 142 SER CA C 13 58.329 . . . . . . . . 141 S CA . 52322 1 536 . 1 . 1 142 142 SER CB C 13 64.024 . . . . . . . . 141 S CB . 52322 1 537 . 1 . 1 142 142 SER N N 15 115.043 . . . . . . . . 141 S N . 52322 1 538 . 1 . 1 143 143 ALA H H 1 8.279 . . . . . . . . 142 A HN . 52322 1 539 . 1 . 1 143 143 ALA C C 13 178.100 . . . . . . . . 142 A CO . 52322 1 540 . 1 . 1 143 143 ALA CA C 13 52.917 . . . . . . . . 142 A CA . 52322 1 541 . 1 . 1 143 143 ALA CB C 13 19.634 . . . . . . . . 142 A CB . 52322 1 542 . 1 . 1 143 143 ALA N N 15 126.142 . . . . . . . . 142 A N . 52322 1 543 . 1 . 1 144 144 THR H H 1 8.152 . . . . . . . . 143 T HN . 52322 1 544 . 1 . 1 144 144 THR C C 13 174.861 . . . . . . . . 143 T CO . 52322 1 545 . 1 . 1 144 144 THR CA C 13 61.594 . . . . . . . . 143 T CA . 52322 1 546 . 1 . 1 144 144 THR CB C 13 70.032 . . . . . . . . 143 T CB . 52322 1 547 . 1 . 1 144 144 THR N N 15 113.115 . . . . . . . . 143 T N . 52322 1 548 . 1 . 1 145 145 THR H H 1 8.078 . . . . . . . . 144 T HN . 52322 1 549 . 1 . 1 145 145 THR C C 13 174.288 . . . . . . . . 144 T CO . 52322 1 550 . 1 . 1 145 145 THR CA C 13 61.963 . . . . . . . . 144 T CA . 52322 1 551 . 1 . 1 145 145 THR CB C 13 69.975 . . . . . . . . 144 T CB . 52322 1 552 . 1 . 1 145 145 THR N N 15 116.561 . . . . . . . . 144 T N . 52322 1 553 . 1 . 1 146 146 ALA H H 1 8.298 . . . . . . . . 145 A HN . 52322 1 554 . 1 . 1 146 146 ALA C C 13 177.802 . . . . . . . . 145 A CO . 52322 1 555 . 1 . 1 146 146 ALA CA C 13 52.837 . . . . . . . . 145 A CA . 52322 1 556 . 1 . 1 146 146 ALA CB C 13 19.254 . . . . . . . . 145 A CB . 52322 1 557 . 1 . 1 146 146 ALA N N 15 126.920 . . . . . . . . 145 A N . 52322 1 558 . 1 . 1 147 147 VAL H H 1 8.159 . . . . . . . . 146 V HN . 52322 1 559 . 1 . 1 147 147 VAL C C 13 176.644 . . . . . . . . 146 V CO . 52322 1 560 . 1 . 1 147 147 VAL CA C 13 62.552 . . . . . . . . 146 V CA . 52322 1 561 . 1 . 1 147 147 VAL CB C 13 32.301 . . . . . . . . 146 V CB . 52322 1 562 . 1 . 1 147 147 VAL N N 15 119.867 . . . . . . . . 146 V N . 52322 1 563 . 1 . 1 148 148 THR H H 1 8.199 . . . . . . . . 147 T HN . 52322 1 564 . 1 . 1 148 148 THR C C 13 174.300 . . . . . . . . 147 T CO . 52322 1 565 . 1 . 1 148 148 THR CA C 13 61.789 . . . . . . . . 147 T CA . 52322 1 566 . 1 . 1 148 148 THR CB C 13 70.089 . . . . . . . . 147 T CB . 52322 1 567 . 1 . 1 148 148 THR N N 15 118.423 . . . . . . . . 147 T N . 52322 1 568 . 1 . 1 149 149 ALA H H 1 8.322 . . . . . . . . 148 A HN . 52322 1 569 . 1 . 1 149 149 ALA C C 13 177.439 . . . . . . . . 148 A CO . 52322 1 570 . 1 . 1 149 149 ALA CA C 13 52.546 . . . . . . . . 148 A CA . 52322 1 571 . 1 . 1 149 149 ALA CB C 13 19.650 . . . . . . . . 148 A CB . 52322 1 572 . 1 . 1 149 149 ALA N N 15 126.956 . . . . . . . . 148 A N . 52322 1 573 . 1 . 1 150 150 ALA H H 1 8.306 . . . . . . . . 149 A HN . 52322 1 574 . 1 . 1 150 150 ALA C C 13 178.165 . . . . . . . . 149 A CO . 52322 1 575 . 1 . 1 150 150 ALA CA C 13 52.641 . . . . . . . . 149 A CA . 52322 1 576 . 1 . 1 150 150 ALA CB C 13 19.378 . . . . . . . . 149 A CB . 52322 1 577 . 1 . 1 150 150 ALA N N 15 123.638 . . . . . . . . 149 A N . 52322 1 578 . 1 . 1 151 151 THR H H 1 8.160 . . . . . . . . 150 T HN . 52322 1 579 . 1 . 1 151 151 THR C C 13 174.880 . . . . . . . . 150 T CO . 52322 1 580 . 1 . 1 151 151 THR CA C 13 61.837 . . . . . . . . 150 T CA . 52322 1 581 . 1 . 1 151 151 THR CB C 13 69.991 . . . . . . . . 150 T CB . 52322 1 582 . 1 . 1 151 151 THR N N 15 113.441 . . . . . . . . 150 T N . 52322 1 583 . 1 . 1 152 152 THR H H 1 8.267 . . . . . . . . 151 T HN . 52322 1 584 . 1 . 1 152 152 THR C C 13 174.622 . . . . . . . . 151 T CO . 52322 1 585 . 1 . 1 152 152 THR CA C 13 61.751 . . . . . . . . 151 T CA . 52322 1 586 . 1 . 1 152 152 THR CB C 13 69.988 . . . . . . . . 151 T CB . 52322 1 587 . 1 . 1 152 152 THR N N 15 116.683 . . . . . . . . 151 T N . 52322 1 588 . 1 . 1 153 153 GLU H H 1 8.450 . . . . . . . . 152 E HN . 52322 1 589 . 1 . 1 153 153 GLU C C 13 176.495 . . . . . . . . 152 E CO . 52322 1 590 . 1 . 1 153 153 GLU CA C 13 56.899 . . . . . . . . 152 E CA . 52322 1 591 . 1 . 1 153 153 GLU CB C 13 30.324 . . . . . . . . 152 E CB . 52322 1 592 . 1 . 1 153 153 GLU N N 15 123.580 . . . . . . . . 152 E N . 52322 1 593 . 1 . 1 154 154 VAL H H 1 8.070 . . . . . . . . 153 V HN . 52322 1 594 . 1 . 1 154 154 VAL C C 13 175.846 . . . . . . . . 153 V CO . 52322 1 595 . 1 . 1 154 154 VAL CA C 13 62.296 . . . . . . . . 153 V CA . 52322 1 596 . 1 . 1 154 154 VAL CB C 13 33.149 . . . . . . . . 153 V CB . 52322 1 597 . 1 . 1 154 154 VAL N N 15 120.386 . . . . . . . . 153 V N . 52322 1 598 . 1 . 1 155 155 ASP H H 1 8.345 . . . . . . . . 154 D HN . 52322 1 599 . 1 . 1 155 155 ASP C C 13 176.414 . . . . . . . . 154 D CO . 52322 1 600 . 1 . 1 155 155 ASP CA C 13 54.300 . . . . . . . . 154 D CA . 52322 1 601 . 1 . 1 155 155 ASP CB C 13 41.414 . . . . . . . . 154 D CB . 52322 1 602 . 1 . 1 155 155 ASP N N 15 123.863 . . . . . . . . 154 D N . 52322 1 603 . 1 . 1 157 157 PHE H H 1 8.194 . . . . . . . . 156 F HN . 52322 1 604 . 1 . 1 157 157 PHE C C 13 176.638 . . . . . . . . 156 F CO . 52322 1 605 . 1 . 1 157 157 PHE CA C 13 57.856 . . . . . . . . 156 F CA . 52322 1 606 . 1 . 1 157 157 PHE CB C 13 39.531 . . . . . . . . 156 F CB . 52322 1 607 . 1 . 1 157 157 PHE N N 15 119.139 . . . . . . . . 156 F N . 52322 1 608 . 1 . 1 158 158 GLY H H 1 8.173 . . . . . . . . 157 G HN . 52322 1 609 . 1 . 1 158 158 GLY C C 13 174.194 . . . . . . . . 157 G CO . 52322 1 610 . 1 . 1 158 158 GLY CA C 13 45.695 . . . . . . . . 157 G CA . 52322 1 611 . 1 . 1 158 158 GLY N N 15 109.723 . . . . . . . . 157 G N . 52322 1 612 . 1 . 1 159 159 ASP H H 1 8.234 . . . . . . . . 158 D HN . 52322 1 613 . 1 . 1 159 159 ASP C C 13 176.578 . . . . . . . . 158 D CO . 52322 1 614 . 1 . 1 159 159 ASP CA C 13 54.629 . . . . . . . . 158 D CA . 52322 1 615 . 1 . 1 159 159 ASP CB C 13 42.186 . . . . . . . . 158 D CB . 52322 1 616 . 1 . 1 159 159 ASP N N 15 120.682 . . . . . . . . 158 D N . 52322 1 617 . 1 . 1 160 160 ALA H H 1 8.232 . . . . . . . . 159 A HN . 52322 1 618 . 1 . 1 160 160 ALA C C 13 177.932 . . . . . . . . 159 A CO . 52322 1 619 . 1 . 1 160 160 ALA CA C 13 52.961 . . . . . . . . 159 A CA . 52322 1 620 . 1 . 1 160 160 ALA CB C 13 19.197 . . . . . . . . 159 A CB . 52322 1 621 . 1 . 1 160 160 ALA N N 15 123.952 . . . . . . . . 159 A N . 52322 1 622 . 1 . 1 161 161 PHE H H 1 8.086 . . . . . . . . 160 F HN . 52322 1 623 . 1 . 1 161 161 PHE C C 13 175.675 . . . . . . . . 160 F CO . 52322 1 624 . 1 . 1 161 161 PHE CA C 13 57.841 . . . . . . . . 160 F CA . 52322 1 625 . 1 . 1 161 161 PHE CB C 13 39.450 . . . . . . . . 160 F CB . 52322 1 626 . 1 . 1 161 161 PHE N N 15 118.430 . . . . . . . . 160 F N . 52322 1 627 . 1 . 1 162 162 ALA H H 1 7.912 . . . . . . . . 161 A HN . 52322 1 628 . 1 . 1 162 162 ALA C C 13 177.077 . . . . . . . . 161 A CO . 52322 1 629 . 1 . 1 162 162 ALA CA C 13 52.421 . . . . . . . . 161 A CA . 52322 1 630 . 1 . 1 162 162 ALA CB C 13 19.535 . . . . . . . . 161 A CB . 52322 1 631 . 1 . 1 162 162 ALA N N 15 125.145 . . . . . . . . 161 A N . 52322 1 632 . 1 . 1 163 163 ALA H H 1 8.117 . . . . . . . . 162 A HN . 52322 1 633 . 1 . 1 163 163 ALA C C 13 177.698 . . . . . . . . 162 A CO . 52322 1 634 . 1 . 1 163 163 ALA CA C 13 52.315 . . . . . . . . 162 A CA . 52322 1 635 . 1 . 1 163 163 ALA CB C 13 19.500 . . . . . . . . 162 A CB . 52322 1 636 . 1 . 1 163 163 ALA N N 15 123.259 . . . . . . . . 162 A N . 52322 1 637 . 1 . 1 164 164 SER H H 1 8.291 . . . . . . . . 163 S HN . 52322 1 638 . 1 . 1 164 164 SER C C 13 173.080 . . . . . . . . 163 S CO . 52322 1 639 . 1 . 1 164 164 SER CA C 13 56.411 . . . . . . . . 163 S CA . 52322 1 640 . 1 . 1 164 164 SER CB C 13 63.660 . . . . . . . . 163 S CB . 52322 1 641 . 1 . 1 164 164 SER N N 15 116.556 . . . . . . . . 163 S N . 52322 1 642 . 1 . 1 166 166 GLY H H 1 8.390 . . . . . . . . 165 G HN . 52322 1 643 . 1 . 1 166 166 GLY C C 13 174.075 . . . . . . . . 165 G CO . 52322 1 644 . 1 . 1 166 166 GLY CA C 13 45.262 . . . . . . . . 165 G CA . 52322 1 645 . 1 . 1 166 166 GLY N N 15 109.123 . . . . . . . . 165 G N . 52322 1 646 . 1 . 1 167 167 GLU H H 1 8.099 . . . . . . . . 166 E HN . 52322 1 647 . 1 . 1 167 167 GLU C C 13 176.077 . . . . . . . . 166 E CO . 52322 1 648 . 1 . 1 167 167 GLU CA C 13 56.151 . . . . . . . . 166 E CA . 52322 1 649 . 1 . 1 167 167 GLU CB C 13 30.793 . . . . . . . . 166 E CB . 52322 1 650 . 1 . 1 167 167 GLU N N 15 120.390 . . . . . . . . 166 E N . 52322 1 651 . 1 . 1 168 168 ALA H H 1 8.361 . . . . . . . . 167 A HN . 52322 1 652 . 1 . 1 168 168 ALA C C 13 175.577 . . . . . . . . 167 A CO . 52322 1 653 . 1 . 1 168 168 ALA CA C 13 50.655 . . . . . . . . 167 A CA . 52322 1 654 . 1 . 1 168 168 ALA CB C 13 18.441 . . . . . . . . 167 A CB . 52322 1 655 . 1 . 1 168 168 ALA N N 15 126.790 . . . . . . . . 167 A N . 52322 1 656 . 1 . 1 172 172 SER H H 1 8.453 . . . . . . . . 171 S HN . 52322 1 657 . 1 . 1 172 172 SER C C 13 175.097 . . . . . . . . 171 S CO . 52322 1 658 . 1 . 1 172 172 SER CA C 13 58.605 . . . . . . . . 171 S CA . 52322 1 659 . 1 . 1 172 172 SER CB C 13 64.441 . . . . . . . . 171 S CB . 52322 1 660 . 1 . 1 172 172 SER N N 15 116.379 . . . . . . . . 171 S N . 52322 1 661 . 1 . 1 173 173 GLU H H 1 8.525 . . . . . . . . 172 E HN . 52322 1 662 . 1 . 1 173 173 GLU C C 13 177.171 . . . . . . . . 172 E CO . 52322 1 663 . 1 . 1 173 173 GLU CA C 13 56.972 . . . . . . . . 172 E CA . 52322 1 664 . 1 . 1 173 173 GLU CB C 13 30.313 . . . . . . . . 172 E CB . 52322 1 665 . 1 . 1 173 173 GLU N N 15 123.086 . . . . . . . . 172 E N . 52322 1 666 . 1 . 1 174 174 GLY H H 1 8.406 . . . . . . . . 173 G HN . 52322 1 667 . 1 . 1 174 174 GLY C C 13 174.063 . . . . . . . . 173 G CO . 52322 1 668 . 1 . 1 174 174 GLY CA C 13 45.375 . . . . . . . . 173 G CA . 52322 1 669 . 1 . 1 174 174 GLY N N 15 109.932 . . . . . . . . 173 G N . 52322 1 670 . 1 . 1 175 175 ALA H H 1 8.133 . . . . . . . . 174 A HN . 52322 1 671 . 1 . 1 175 175 ALA C C 13 178.117 . . . . . . . . 174 A CO . 52322 1 672 . 1 . 1 175 175 ALA CA C 13 52.565 . . . . . . . . 174 A CA . 52322 1 673 . 1 . 1 175 175 ALA CB C 13 19.706 . . . . . . . . 174 A CB . 52322 1 674 . 1 . 1 175 175 ALA N N 15 123.755 . . . . . . . . 174 A N . 52322 1 675 . 1 . 1 176 176 THR H H 1 8.140 . . . . . . . . 175 T HN . 52322 1 676 . 1 . 1 176 176 THR C C 13 174.147 . . . . . . . . 175 T CO . 52322 1 677 . 1 . 1 176 176 THR CA C 13 61.594 . . . . . . . . 175 T CA . 52322 1 678 . 1 . 1 176 176 THR CB C 13 70.258 . . . . . . . . 175 T CB . 52322 1 679 . 1 . 1 176 176 THR N N 15 113.749 . . . . . . . . 175 T N . 52322 1 680 . 1 . 1 177 177 ALA H H 1 8.297 . . . . . . . . 176 A HN . 52322 1 681 . 1 . 1 177 177 ALA C C 13 175.500 . . . . . . . . 176 A CO . 52322 1 682 . 1 . 1 177 177 ALA CA C 13 50.681 . . . . . . . . 176 A CA . 52322 1 683 . 1 . 1 177 177 ALA CB C 13 18.197 . . . . . . . . 176 A CB . 52322 1 684 . 1 . 1 177 177 ALA N N 15 128.208 . . . . . . . . 176 A N . 52322 1 685 . 1 . 1 188 188 LEU H H 1 8.192 . . . . . . . . 187 L HN . 52322 1 686 . 1 . 1 188 188 LEU C C 13 177.508 . . . . . . . . 187 L CO . 52322 1 687 . 1 . 1 188 188 LEU CA C 13 55.505 . . . . . . . . 187 L CA . 52322 1 688 . 1 . 1 188 188 LEU CB C 13 42.415 . . . . . . . . 187 L CB . 52322 1 689 . 1 . 1 188 188 LEU N N 15 121.407 . . . . . . . . 187 L N . 52322 1 690 . 1 . 1 189 189 ASP H H 1 8.250 . . . . . . . . 188 D HN . 52322 1 691 . 1 . 1 189 189 ASP C C 13 176.359 . . . . . . . . 188 D CO . 52322 1 692 . 1 . 1 189 189 ASP CA C 13 54.206 . . . . . . . . 188 D CA . 52322 1 693 . 1 . 1 189 189 ASP CB C 13 41.113 . . . . . . . . 188 D CB . 52322 1 694 . 1 . 1 189 189 ASP N N 15 120.658 . . . . . . . . 188 D N . 52322 1 695 . 1 . 1 190 190 ALA H H 1 8.186 . . . . . . . . 189 A HN . 52322 1 696 . 1 . 1 190 190 ALA C C 13 178.097 . . . . . . . . 189 A CO . 52322 1 697 . 1 . 1 190 190 ALA CA C 13 53.011 . . . . . . . . 189 A CA . 52322 1 698 . 1 . 1 190 190 ALA CB C 13 19.141 . . . . . . . . 189 A CB . 52322 1 699 . 1 . 1 190 190 ALA N N 15 124.249 . . . . . . . . 189 A N . 52322 1 700 . 1 . 1 191 191 CYS H H 1 8.361 . . . . . . . . 190 C HN . 52322 1 701 . 1 . 1 191 191 CYS C C 13 175.105 . . . . . . . . 190 C CO . 52322 1 702 . 1 . 1 191 191 CYS CA C 13 58.852 . . . . . . . . 190 C CA . 52322 1 703 . 1 . 1 191 191 CYS CB C 13 28.001 . . . . . . . . 190 C CB . 52322 1 704 . 1 . 1 191 191 CYS N N 15 117.824 . . . . . . . . 190 C N . 52322 1 705 . 1 . 1 192 192 SER H H 1 8.343 . . . . . . . . 191 S HN . 52322 1 706 . 1 . 1 192 192 SER C C 13 175.247 . . . . . . . . 191 S CO . 52322 1 707 . 1 . 1 192 192 SER CA C 13 58.379 . . . . . . . . 191 S CA . 52322 1 708 . 1 . 1 192 192 SER CB C 13 63.868 . . . . . . . . 191 S CB . 52322 1 709 . 1 . 1 192 192 SER N N 15 117.945 . . . . . . . . 191 S N . 52322 1 710 . 1 . 1 193 193 GLY H H 1 8.399 . . . . . . . . 192 G HN . 52322 1 711 . 1 . 1 193 193 GLY C C 13 173.946 . . . . . . . . 192 G CO . 52322 1 712 . 1 . 1 193 193 GLY CA C 13 45.515 . . . . . . . . 192 G CA . 52322 1 713 . 1 . 1 193 193 GLY N N 15 110.669 . . . . . . . . 192 G N . 52322 1 714 . 1 . 1 194 194 ASN H H 1 8.226 . . . . . . . . 193 N HN . 52322 1 715 . 1 . 1 194 194 ASN C C 13 174.691 . . . . . . . . 193 N CO . 52322 1 716 . 1 . 1 194 194 ASN CA C 13 53.128 . . . . . . . . 193 N CA . 52322 1 717 . 1 . 1 194 194 ASN CB C 13 39.249 . . . . . . . . 193 N CB . 52322 1 718 . 1 . 1 194 194 ASN N N 15 118.456 . . . . . . . . 193 N N . 52322 1 719 . 1 . 1 195 195 ASP H H 1 8.323 . . . . . . . . 194 D HN . 52322 1 720 . 1 . 1 195 195 ASP C C 13 175.140 . . . . . . . . 194 D CO . 52322 1 721 . 1 . 1 195 195 ASP CA C 13 52.289 . . . . . . . . 194 D CA . 52322 1 722 . 1 . 1 195 195 ASP CB C 13 41.282 . . . . . . . . 194 D CB . 52322 1 723 . 1 . 1 195 195 ASP N N 15 122.099 . . . . . . . . 194 D N . 52322 1 724 . 1 . 1 197 197 PHE H H 1 8.238 . . . . . . . . 196 F HN . 52322 1 725 . 1 . 1 197 197 PHE C C 13 175.167 . . . . . . . . 196 F CO . 52322 1 726 . 1 . 1 197 197 PHE CA C 13 57.274 . . . . . . . . 196 F CA . 52322 1 727 . 1 . 1 197 197 PHE CB C 13 39.139 . . . . . . . . 196 F CB . 52322 1 728 . 1 . 1 197 197 PHE N N 15 118.829 . . . . . . . . 196 F N . 52322 1 729 . 1 . 1 198 198 ALA H H 1 7.744 . . . . . . . . 197 A HN . 52322 1 730 . 1 . 1 198 198 ALA C C 13 174.933 . . . . . . . . 197 A CO . 52322 1 731 . 1 . 1 198 198 ALA CA C 13 50.375 . . . . . . . . 197 A CA . 52322 1 732 . 1 . 1 198 198 ALA CB C 13 18.441 . . . . . . . . 197 A CB . 52322 1 733 . 1 . 1 198 198 ALA N N 15 126.425 . . . . . . . . 197 A N . 52322 1 734 . 1 . 1 201 201 GLU H H 1 8.448 . . . . . . . . 200 E HN . 52322 1 735 . 1 . 1 201 201 GLU C C 13 177.150 . . . . . . . . 200 E CO . 52322 1 736 . 1 . 1 201 201 GLU CA C 13 56.975 . . . . . . . . 200 E CA . 52322 1 737 . 1 . 1 201 201 GLU N N 15 122.922 . . . . . . . . 200 E N . 52322 1 738 . 1 . 1 202 202 GLY H H 1 8.456 . . . . . . . . 201 G HN . 52322 1 739 . 1 . 1 202 202 GLY C C 13 174.353 . . . . . . . . 201 G CO . 52322 1 740 . 1 . 1 202 202 GLY CA C 13 45.475 . . . . . . . . 201 G CA . 52322 1 741 . 1 . 1 202 202 GLY N N 15 110.164 . . . . . . . . 201 G N . 52322 1 742 . 1 . 1 203 203 SER H H 1 8.183 . . . . . . . . 202 S HN . 52322 1 743 . 1 . 1 203 203 SER C C 13 174.657 . . . . . . . . 202 S CO . 52322 1 744 . 1 . 1 203 203 SER CA C 13 58.379 . . . . . . . . 202 S CA . 52322 1 745 . 1 . 1 203 203 SER CB C 13 64.215 . . . . . . . . 202 S CB . 52322 1 746 . 1 . 1 203 203 SER N N 15 115.642 . . . . . . . . 202 S N . 52322 1 747 . 1 . 1 204 204 ALA H H 1 8.428 . . . . . . . . 203 A HN . 52322 1 748 . 1 . 1 204 204 ALA C C 13 177.886 . . . . . . . . 203 A CO . 52322 1 749 . 1 . 1 204 204 ALA CA C 13 52.792 . . . . . . . . 203 A CA . 52322 1 750 . 1 . 1 204 204 ALA CB C 13 19.307 . . . . . . . . 203 A CB . 52322 1 751 . 1 . 1 204 204 ALA N N 15 126.239 . . . . . . . . 203 A N . 52322 1 752 . 1 . 1 205 205 GLU H H 1 8.301 . . . . . . . . 204 E HN . 52322 1 753 . 1 . 1 205 205 GLU C C 13 176.203 . . . . . . . . 204 E CO . 52322 1 754 . 1 . 1 205 205 GLU CA C 13 56.462 . . . . . . . . 204 E CA . 52322 1 755 . 1 . 1 205 205 GLU CB C 13 30.410 . . . . . . . . 204 E CB . 52322 1 756 . 1 . 1 205 205 GLU N N 15 119.937 . . . . . . . . 204 E N . 52322 1 757 . 1 . 1 206 206 ALA H H 1 8.223 . . . . . . . . 205 A HN . 52322 1 758 . 1 . 1 206 206 ALA C C 13 177.105 . . . . . . . . 205 A CO . 52322 1 759 . 1 . 1 206 206 ALA CA C 13 52.392 . . . . . . . . 205 A CA . 52322 1 760 . 1 . 1 206 206 ALA CB C 13 19.367 . . . . . . . . 205 A CB . 52322 1 761 . 1 . 1 206 206 ALA N N 15 125.327 . . . . . . . . 205 A N . 52322 1 762 . 1 . 1 207 207 ALA H H 1 8.275 . . . . . . . . 206 A HN . 52322 1 763 . 1 . 1 207 207 ALA C C 13 175.740 . . . . . . . . 206 A CO . 52322 1 764 . 1 . 1 207 207 ALA CA C 13 50.618 . . . . . . . . 206 A CA . 52322 1 765 . 1 . 1 207 207 ALA CB C 13 18.294 . . . . . . . . 206 A CB . 52322 1 766 . 1 . 1 207 207 ALA N N 15 125.155 . . . . . . . . 206 A N . 52322 1 767 . 1 . 1 209 209 GLU H H 1 8.548 . . . . . . . . 208 E HN . 52322 1 768 . 1 . 1 209 209 GLU C C 13 176.610 . . . . . . . . 208 E CO . 52322 1 769 . 1 . 1 209 209 GLU CA C 13 56.786 . . . . . . . . 208 E CA . 52322 1 770 . 1 . 1 209 209 GLU CB C 13 30.101 . . . . . . . . 208 E CB . 52322 1 771 . 1 . 1 209 209 GLU N N 15 120.789 . . . . . . . . 208 E N . 52322 1 772 . 1 . 1 210 210 LEU H H 1 8.152 . . . . . . . . 209 L HN . 52322 1 773 . 1 . 1 210 210 LEU C C 13 177.090 . . . . . . . . 209 L CO . 52322 1 774 . 1 . 1 210 210 LEU CA C 13 55.413 . . . . . . . . 209 L CA . 52322 1 775 . 1 . 1 210 210 LEU CB C 13 42.468 . . . . . . . . 209 L CB . 52322 1 776 . 1 . 1 210 210 LEU N N 15 123.005 . . . . . . . . 209 L N . 52322 1 777 . 1 . 1 211 211 ASP H H 1 8.301 . . . . . . . . 210 D HN . 52322 1 778 . 1 . 1 211 211 ASP C C 13 176.767 . . . . . . . . 210 D CO . 52322 1 779 . 1 . 1 211 211 ASP CA C 13 54.189 . . . . . . . . 210 D CA . 52322 1 780 . 1 . 1 211 211 ASP CB C 13 41.056 . . . . . . . . 210 D CB . 52322 1 781 . 1 . 1 211 211 ASP N N 15 121.521 . . . . . . . . 210 D N . 52322 1 782 . 1 . 1 212 212 LEU H H 1 8.111 . . . . . . . . 211 L HN . 52322 1 783 . 1 . 1 212 212 LEU C C 13 177.864 . . . . . . . . 211 L CO . 52322 1 784 . 1 . 1 212 212 LEU CB C 13 42.185 . . . . . . . . 211 L CB . 52322 1 785 . 1 . 1 212 212 LEU N N 15 122.963 . . . . . . . . 211 L N . 52322 1 786 . 1 . 1 213 213 PHE H H 1 8.146 . . . . . . . . 212 F HN . 52322 1 787 . 1 . 1 213 213 PHE C C 13 175.935 . . . . . . . . 212 F CO . 52322 1 788 . 1 . 1 213 213 PHE CA C 13 58.062 . . . . . . . . 212 F CA . 52322 1 789 . 1 . 1 213 213 PHE CB C 13 39.083 . . . . . . . . 212 F CB . 52322 1 790 . 1 . 1 213 213 PHE N N 15 118.782 . . . . . . . . 212 F N . 52322 1 791 . 1 . 1 214 214 ALA H H 1 7.783 . . . . . . . . 213 A HN . 52322 1 792 . 1 . 1 214 214 ALA C C 13 177.638 . . . . . . . . 213 A CO . 52322 1 793 . 1 . 1 214 214 ALA CA C 13 52.746 . . . . . . . . 213 A CA . 52322 1 794 . 1 . 1 214 214 ALA CB C 13 19.324 . . . . . . . . 213 A CB . 52322 1 795 . 1 . 1 214 214 ALA N N 15 123.690 . . . . . . . . 213 A N . 52322 1 796 . 1 . 1 215 215 MET H H 1 8.100 . . . . . . . . 214 M HN . 52322 1 797 . 1 . 1 215 215 MET C C 13 176.017 . . . . . . . . 214 M CO . 52322 1 798 . 1 . 1 215 215 MET CA C 13 55.521 . . . . . . . . 214 M CA . 52322 1 799 . 1 . 1 215 215 MET CB C 13 32.956 . . . . . . . . 214 M CB . 52322 1 800 . 1 . 1 215 215 MET N N 15 118.850 . . . . . . . . 214 M N . 52322 1 801 . 1 . 1 216 216 LYS H H 1 8.201 . . . . . . . . 215 K HN . 52322 1 802 . 1 . 1 216 216 LYS C C 13 174.092 . . . . . . . . 215 K CO . 52322 1 803 . 1 . 1 216 216 LYS CA C 13 54.282 . . . . . . . . 215 K CA . 52322 1 804 . 1 . 1 216 216 LYS CB C 13 32.675 . . . . . . . . 215 K CB . 52322 1 805 . 1 . 1 216 216 LYS N N 15 123.970 . . . . . . . . 215 K N . 52322 1 806 . 1 . 1 219 219 GLU H H 1 8.617 . . . . . . . . 218 E HN . 52322 1 807 . 1 . 1 219 219 GLU C C 13 177.109 . . . . . . . . 218 E CO . 52322 1 808 . 1 . 1 219 219 GLU CA C 13 56.983 . . . . . . . . 218 E CA . 52322 1 809 . 1 . 1 219 219 GLU CB C 13 30.276 . . . . . . . . 218 E CB . 52322 1 810 . 1 . 1 219 219 GLU N N 15 121.301 . . . . . . . . 218 E N . 52322 1 811 . 1 . 1 220 220 THR H H 1 8.166 . . . . . . . . 219 T HN . 52322 1 812 . 1 . 1 220 220 THR C C 13 174.861 . . . . . . . . 219 T CO . 52322 1 813 . 1 . 1 220 220 THR CA C 13 62.073 . . . . . . . . 219 T CA . 52322 1 814 . 1 . 1 220 220 THR CB C 13 70.145 . . . . . . . . 219 T CB . 52322 1 815 . 1 . 1 220 220 THR N N 15 114.515 . . . . . . . . 219 T N . 52322 1 816 . 1 . 1 222 222 ALA H H 1 8.244 . . . . . . . . 221 A HN . 52322 1 817 . 1 . 1 222 222 ALA C C 13 177.735 . . . . . . . . 221 A CO . 52322 1 818 . 1 . 1 222 222 ALA CA C 13 55.584 . . . . . . . . 221 A CA . 52322 1 819 . 1 . 1 222 222 ALA N N 15 124.014 . . . . . . . . 221 A N . 52322 1 820 . 1 . 1 223 223 PRO H H 1 8.186 . . . . . . . . 222 P HN . 52322 1 821 . 1 . 1 223 223 PRO C C 13 176.417 . . . . . . . . 222 P CO . 52322 1 822 . 1 . 1 223 223 PRO CB C 13 30.340 . . . . . . . . 222 P CB . 52322 1 823 . 1 . 1 223 223 PRO N N 15 120.487 . . . . . . . . 222 P N . 52322 1 stop_ save_