data_34365 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 34365 _Entry.Title ; Solid-state NMR structure of outer membrane protein AlkL in DMPC lipid bilayers ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2019-03-06 _Entry.Accession_date 2019-03-06 _Entry.Last_release_date 2020-03-11 _Entry.Original_release_date 2020-03-11 _Entry.Origination author _Entry.Format_name . _Entry.NMR_STAR_version 3.2.6.0 _Entry.NMR_STAR_dict_location . _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype STATE _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 . _Entry.BMRB_internal_directory_name . loop_ _Entry_experimental_methods.ID _Entry_experimental_methods.Method _Entry_experimental_methods.Subtype _Entry_experimental_methods.Entry_ID 1 'SOLID-STATE NMR' 'SOLID-STATE NMR' 34365 stop_ 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 T. Schubeis T. . . . 34365 2 L. Andreas L. B. . . 34365 3 G. Pintacuda G. . . . 34365 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID 'Beta Barrel' . 34365 'MEMBRANE PROTEIN' . 34365 'Outer membrane protein' . 34365 Porin . 34365 Transporter . 34365 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 34365 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 591 34365 '15N chemical shifts' 172 34365 '1H chemical shifts' 804 34365 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 . . 2020-08-16 2019-03-06 update BMRB 'update entry citation' 34365 1 . . 2020-03-16 2019-03-06 original author 'original release' 34365 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 6QWR . 34365 stop_ save_ ############### # Citations # ############### save_citation_1 _Citation.Sf_category citations _Citation.Sf_framecode citation_1 _Citation.Entry_ID 34365 _Citation.ID 1 _Citation.Name . _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.PubMed_ID 32817429 _Citation.DOI . _Citation.Full_citation . _Citation.Title ; A beta-barrel for oil transport through lipid membranes: Dynamic NMR structures of AlkL ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Proc. Natl. Acad. Sci. U.S.A.' _Citation.Journal_name_full 'Proceedings of the National Academy of Sciences of the United States of America' _Citation.Journal_volume 117 _Citation.Journal_issue 35 _Citation.Journal_ASTM . _Citation.Journal_ISSN 1091-6490 _Citation.Journal_CSD 0353 _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 21014 _Citation.Page_last 21021 _Citation.Year 2020 _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 Tobias Schubeis T. . . . 34365 1 2 Tanguy 'Le Marchand' T. . . . 34365 1 3 Csaba Daday C. . . . 34365 1 4 Wojciech Kopec W. . . . 34365 1 5 Kumar 'Tekwani Movellan' K. . . . 34365 1 6 Jan Stanek J. . . . 34365 1 7 Tom Schwarzer T. S. . . 34365 1 8 Kathrin Castiglione K. . . . 34365 1 9 Bert 'de Groot' B. L. . . 34365 1 10 Guido Pintacuda G. . . . 34365 1 11 Loren Andreas L. B. . . 34365 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 34365 _Assembly.ID 1 _Assembly.Name 'Outer membrane protein AlkL' _Assembly.BMRB_code . _Assembly.Number_of_components . _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _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 entity_1 1 $entity_1 A A yes . . . . . . 34365 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 34365 _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 A _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; MNENYPAKSAGYNQGDWVAS FNFSKVYVGEELGDLNVGGG ALPNADVSIGNDTTLTFDIA YFVSSNIAVDFFVGVPARAK FQGEKSISSLGRVSEVDYGP AILSLQYHYDSFERLYPYVG VGVGRVLFFDKTDGALSSFD IKDKWAPAFQVGLRYDLGNS WMLNSDVRYIPFKTDVTGTL GPVPVSTKIEVDPFILSLGA SYVFKLAAALEHHHHHHHH ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states . _Entity.Ambiguous_chem_comp_sites . _Entity.Nstd_monomer no _Entity.Nstd_chirality . _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 219 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method man _Entity.Parent_entity_ID 1 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 24087.912 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 . MET . 34365 1 2 . ASN . 34365 1 3 . GLU . 34365 1 4 . ASN . 34365 1 5 . TYR . 34365 1 6 . PRO . 34365 1 7 . ALA . 34365 1 8 . LYS . 34365 1 9 . SER . 34365 1 10 . ALA . 34365 1 11 . GLY . 34365 1 12 . TYR . 34365 1 13 . ASN . 34365 1 14 . GLN . 34365 1 15 . GLY . 34365 1 16 . ASP . 34365 1 17 . TRP . 34365 1 18 . VAL . 34365 1 19 . ALA . 34365 1 20 . SER . 34365 1 21 . PHE . 34365 1 22 . ASN . 34365 1 23 . PHE . 34365 1 24 . SER . 34365 1 25 . LYS . 34365 1 26 . VAL . 34365 1 27 . TYR . 34365 1 28 . VAL . 34365 1 29 . GLY . 34365 1 30 . GLU . 34365 1 31 . GLU . 34365 1 32 . LEU . 34365 1 33 . GLY . 34365 1 34 . ASP . 34365 1 35 . LEU . 34365 1 36 . ASN . 34365 1 37 . VAL . 34365 1 38 . GLY . 34365 1 39 . GLY . 34365 1 40 . GLY . 34365 1 41 . ALA . 34365 1 42 . LEU . 34365 1 43 . PRO . 34365 1 44 . ASN . 34365 1 45 . ALA . 34365 1 46 . ASP . 34365 1 47 . VAL . 34365 1 48 . SER . 34365 1 49 . ILE . 34365 1 50 . GLY . 34365 1 51 . ASN . 34365 1 52 . ASP . 34365 1 53 . THR . 34365 1 54 . THR . 34365 1 55 . LEU . 34365 1 56 . THR . 34365 1 57 . PHE . 34365 1 58 . ASP . 34365 1 59 . ILE . 34365 1 60 . ALA . 34365 1 61 . TYR . 34365 1 62 . PHE . 34365 1 63 . VAL . 34365 1 64 . SER . 34365 1 65 . SER . 34365 1 66 . ASN . 34365 1 67 . ILE . 34365 1 68 . ALA . 34365 1 69 . VAL . 34365 1 70 . ASP . 34365 1 71 . PHE . 34365 1 72 . PHE . 34365 1 73 . VAL . 34365 1 74 . GLY . 34365 1 75 . VAL . 34365 1 76 . PRO . 34365 1 77 . ALA . 34365 1 78 . ARG . 34365 1 79 . ALA . 34365 1 80 . LYS . 34365 1 81 . PHE . 34365 1 82 . GLN . 34365 1 83 . GLY . 34365 1 84 . GLU . 34365 1 85 . LYS . 34365 1 86 . SER . 34365 1 87 . ILE . 34365 1 88 . SER . 34365 1 89 . SER . 34365 1 90 . LEU . 34365 1 91 . GLY . 34365 1 92 . ARG . 34365 1 93 . VAL . 34365 1 94 . SER . 34365 1 95 . GLU . 34365 1 96 . VAL . 34365 1 97 . ASP . 34365 1 98 . TYR . 34365 1 99 . GLY . 34365 1 100 . PRO . 34365 1 101 . ALA . 34365 1 102 . ILE . 34365 1 103 . LEU . 34365 1 104 . SER . 34365 1 105 . LEU . 34365 1 106 . GLN . 34365 1 107 . TYR . 34365 1 108 . HIS . 34365 1 109 . TYR . 34365 1 110 . ASP . 34365 1 111 . SER . 34365 1 112 . PHE . 34365 1 113 . GLU . 34365 1 114 . ARG . 34365 1 115 . LEU . 34365 1 116 . TYR . 34365 1 117 . PRO . 34365 1 118 . TYR . 34365 1 119 . VAL . 34365 1 120 . GLY . 34365 1 121 . VAL . 34365 1 122 . GLY . 34365 1 123 . VAL . 34365 1 124 . GLY . 34365 1 125 . ARG . 34365 1 126 . VAL . 34365 1 127 . LEU . 34365 1 128 . PHE . 34365 1 129 . PHE . 34365 1 130 . ASP . 34365 1 131 . LYS . 34365 1 132 . THR . 34365 1 133 . ASP . 34365 1 134 . GLY . 34365 1 135 . ALA . 34365 1 136 . LEU . 34365 1 137 . SER . 34365 1 138 . SER . 34365 1 139 . PHE . 34365 1 140 . ASP . 34365 1 141 . ILE . 34365 1 142 . LYS . 34365 1 143 . ASP . 34365 1 144 . LYS . 34365 1 145 . TRP . 34365 1 146 . ALA . 34365 1 147 . PRO . 34365 1 148 . ALA . 34365 1 149 . PHE . 34365 1 150 . GLN . 34365 1 151 . VAL . 34365 1 152 . GLY . 34365 1 153 . LEU . 34365 1 154 . ARG . 34365 1 155 . TYR . 34365 1 156 . ASP . 34365 1 157 . LEU . 34365 1 158 . GLY . 34365 1 159 . ASN . 34365 1 160 . SER . 34365 1 161 . TRP . 34365 1 162 . MET . 34365 1 163 . LEU . 34365 1 164 . ASN . 34365 1 165 . SER . 34365 1 166 . ASP . 34365 1 167 . VAL . 34365 1 168 . ARG . 34365 1 169 . TYR . 34365 1 170 . ILE . 34365 1 171 . PRO . 34365 1 172 . PHE . 34365 1 173 . LYS . 34365 1 174 . THR . 34365 1 175 . ASP . 34365 1 176 . VAL . 34365 1 177 . THR . 34365 1 178 . GLY . 34365 1 179 . THR . 34365 1 180 . LEU . 34365 1 181 . GLY . 34365 1 182 . PRO . 34365 1 183 . VAL . 34365 1 184 . PRO . 34365 1 185 . VAL . 34365 1 186 . SER . 34365 1 187 . THR . 34365 1 188 . LYS . 34365 1 189 . ILE . 34365 1 190 . GLU . 34365 1 191 . VAL . 34365 1 192 . ASP . 34365 1 193 . PRO . 34365 1 194 . PHE . 34365 1 195 . ILE . 34365 1 196 . LEU . 34365 1 197 . SER . 34365 1 198 . LEU . 34365 1 199 . GLY . 34365 1 200 . ALA . 34365 1 201 . SER . 34365 1 202 . TYR . 34365 1 203 . VAL . 34365 1 204 . PHE . 34365 1 205 . LYS . 34365 1 206 . LEU . 34365 1 207 . ALA . 34365 1 208 . ALA . 34365 1 209 . ALA . 34365 1 210 . LEU . 34365 1 211 . GLU . 34365 1 212 . HIS . 34365 1 213 . HIS . 34365 1 214 . HIS . 34365 1 215 . HIS . 34365 1 216 . HIS . 34365 1 217 . HIS . 34365 1 218 . HIS . 34365 1 219 . HIS . 34365 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 34365 1 . ASN 2 2 34365 1 . GLU 3 3 34365 1 . ASN 4 4 34365 1 . TYR 5 5 34365 1 . PRO 6 6 34365 1 . ALA 7 7 34365 1 . LYS 8 8 34365 1 . SER 9 9 34365 1 . ALA 10 10 34365 1 . GLY 11 11 34365 1 . TYR 12 12 34365 1 . ASN 13 13 34365 1 . GLN 14 14 34365 1 . GLY 15 15 34365 1 . ASP 16 16 34365 1 . TRP 17 17 34365 1 . VAL 18 18 34365 1 . ALA 19 19 34365 1 . SER 20 20 34365 1 . PHE 21 21 34365 1 . ASN 22 22 34365 1 . PHE 23 23 34365 1 . SER 24 24 34365 1 . LYS 25 25 34365 1 . VAL 26 26 34365 1 . TYR 27 27 34365 1 . VAL 28 28 34365 1 . GLY 29 29 34365 1 . GLU 30 30 34365 1 . GLU 31 31 34365 1 . LEU 32 32 34365 1 . GLY 33 33 34365 1 . ASP 34 34 34365 1 . LEU 35 35 34365 1 . ASN 36 36 34365 1 . VAL 37 37 34365 1 . GLY 38 38 34365 1 . GLY 39 39 34365 1 . GLY 40 40 34365 1 . ALA 41 41 34365 1 . LEU 42 42 34365 1 . PRO 43 43 34365 1 . ASN 44 44 34365 1 . ALA 45 45 34365 1 . ASP 46 46 34365 1 . VAL 47 47 34365 1 . SER 48 48 34365 1 . ILE 49 49 34365 1 . GLY 50 50 34365 1 . ASN 51 51 34365 1 . ASP 52 52 34365 1 . THR 53 53 34365 1 . THR 54 54 34365 1 . LEU 55 55 34365 1 . THR 56 56 34365 1 . PHE 57 57 34365 1 . ASP 58 58 34365 1 . ILE 59 59 34365 1 . ALA 60 60 34365 1 . TYR 61 61 34365 1 . PHE 62 62 34365 1 . VAL 63 63 34365 1 . SER 64 64 34365 1 . SER 65 65 34365 1 . ASN 66 66 34365 1 . ILE 67 67 34365 1 . ALA 68 68 34365 1 . VAL 69 69 34365 1 . ASP 70 70 34365 1 . PHE 71 71 34365 1 . PHE 72 72 34365 1 . VAL 73 73 34365 1 . GLY 74 74 34365 1 . VAL 75 75 34365 1 . PRO 76 76 34365 1 . ALA 77 77 34365 1 . ARG 78 78 34365 1 . ALA 79 79 34365 1 . LYS 80 80 34365 1 . PHE 81 81 34365 1 . GLN 82 82 34365 1 . GLY 83 83 34365 1 . GLU 84 84 34365 1 . LYS 85 85 34365 1 . SER 86 86 34365 1 . ILE 87 87 34365 1 . SER 88 88 34365 1 . SER 89 89 34365 1 . LEU 90 90 34365 1 . GLY 91 91 34365 1 . ARG 92 92 34365 1 . VAL 93 93 34365 1 . SER 94 94 34365 1 . GLU 95 95 34365 1 . VAL 96 96 34365 1 . ASP 97 97 34365 1 . TYR 98 98 34365 1 . GLY 99 99 34365 1 . PRO 100 100 34365 1 . ALA 101 101 34365 1 . ILE 102 102 34365 1 . LEU 103 103 34365 1 . SER 104 104 34365 1 . LEU 105 105 34365 1 . GLN 106 106 34365 1 . TYR 107 107 34365 1 . HIS 108 108 34365 1 . TYR 109 109 34365 1 . ASP 110 110 34365 1 . SER 111 111 34365 1 . PHE 112 112 34365 1 . GLU 113 113 34365 1 . ARG 114 114 34365 1 . LEU 115 115 34365 1 . TYR 116 116 34365 1 . PRO 117 117 34365 1 . TYR 118 118 34365 1 . VAL 119 119 34365 1 . GLY 120 120 34365 1 . VAL 121 121 34365 1 . GLY 122 122 34365 1 . VAL 123 123 34365 1 . GLY 124 124 34365 1 . ARG 125 125 34365 1 . VAL 126 126 34365 1 . LEU 127 127 34365 1 . PHE 128 128 34365 1 . PHE 129 129 34365 1 . ASP 130 130 34365 1 . LYS 131 131 34365 1 . THR 132 132 34365 1 . ASP 133 133 34365 1 . GLY 134 134 34365 1 . ALA 135 135 34365 1 . LEU 136 136 34365 1 . SER 137 137 34365 1 . SER 138 138 34365 1 . PHE 139 139 34365 1 . ASP 140 140 34365 1 . ILE 141 141 34365 1 . LYS 142 142 34365 1 . ASP 143 143 34365 1 . LYS 144 144 34365 1 . TRP 145 145 34365 1 . ALA 146 146 34365 1 . PRO 147 147 34365 1 . ALA 148 148 34365 1 . PHE 149 149 34365 1 . GLN 150 150 34365 1 . VAL 151 151 34365 1 . GLY 152 152 34365 1 . LEU 153 153 34365 1 . ARG 154 154 34365 1 . TYR 155 155 34365 1 . ASP 156 156 34365 1 . LEU 157 157 34365 1 . GLY 158 158 34365 1 . ASN 159 159 34365 1 . SER 160 160 34365 1 . TRP 161 161 34365 1 . MET 162 162 34365 1 . LEU 163 163 34365 1 . ASN 164 164 34365 1 . SER 165 165 34365 1 . ASP 166 166 34365 1 . VAL 167 167 34365 1 . ARG 168 168 34365 1 . TYR 169 169 34365 1 . ILE 170 170 34365 1 . PRO 171 171 34365 1 . PHE 172 172 34365 1 . LYS 173 173 34365 1 . THR 174 174 34365 1 . ASP 175 175 34365 1 . VAL 176 176 34365 1 . THR 177 177 34365 1 . GLY 178 178 34365 1 . THR 179 179 34365 1 . LEU 180 180 34365 1 . GLY 181 181 34365 1 . PRO 182 182 34365 1 . VAL 183 183 34365 1 . PRO 184 184 34365 1 . VAL 185 185 34365 1 . SER 186 186 34365 1 . THR 187 187 34365 1 . LYS 188 188 34365 1 . ILE 189 189 34365 1 . GLU 190 190 34365 1 . VAL 191 191 34365 1 . ASP 192 192 34365 1 . PRO 193 193 34365 1 . PHE 194 194 34365 1 . ILE 195 195 34365 1 . LEU 196 196 34365 1 . SER 197 197 34365 1 . LEU 198 198 34365 1 . GLY 199 199 34365 1 . ALA 200 200 34365 1 . SER 201 201 34365 1 . TYR 202 202 34365 1 . VAL 203 203 34365 1 . PHE 204 204 34365 1 . LYS 205 205 34365 1 . LEU 206 206 34365 1 . ALA 207 207 34365 1 . ALA 208 208 34365 1 . ALA 209 209 34365 1 . LEU 210 210 34365 1 . GLU 211 211 34365 1 . HIS 212 212 34365 1 . HIS 213 213 34365 1 . HIS 214 214 34365 1 . HIS 215 215 34365 1 . HIS 216 216 34365 1 . HIS 217 217 34365 1 . HIS 218 218 34365 1 . HIS 219 219 34365 1 stop_ save_ #################### # Natural source # #################### save_natural_source _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source _Entity_natural_src_list.Entry_ID 34365 _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 . 301 organism . 'Pseudomonas oleovorans' 'Pseudomonas oleovorans' . . Bacteria . Pseudomonas oleovorans . . . . . . . . . . . alkL . 34365 1 stop_ save_ ######################### # Experimental source # ######################### save_experimental_source _Entity_experimental_src_list.Sf_category experimental_source _Entity_experimental_src_list.Sf_framecode experimental_source _Entity_experimental_src_list.Entry_ID 34365 _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' . . 562 Escherichia coli . . . . . . . . . . 34365 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 34365 _Sample.ID 1 _Sample.Name . _Sample.Type liposome _Sample.Sub_type . _Sample.Details '0.5 w/w [U-13C; U-15N] Outer membrane protein AlkL, Water' _Sample.Aggregate_sample_number . _Sample.Solvent_system Water _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 'Outer membrane protein AlkL' '[U-13C; U-15N]' 1 $assembly 1 $entity_1 . . 0.5 . . w/w . . . . 34365 1 stop_ save_ save_sample_2 _Sample.Sf_category sample _Sample.Sf_framecode sample_2 _Sample.Entry_ID 34365 _Sample.ID 2 _Sample.Name . _Sample.Type liposome _Sample.Sub_type . _Sample.Details '0.5 w/w [U-13C; U-15N; U-2H] Outer membrane protein AlkL, Water' _Sample.Aggregate_sample_number . _Sample.Solvent_system Water _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 'Outer membrane protein AlkL' '[U-13C; U-15N; U-2H]' 1 $assembly 1 $entity_1 . . 0.5 . . w/w . . . . 34365 2 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID 34365 _Sample_condition_list.ID 1 _Sample_condition_list.Name . _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' 20 . mM 34365 1 pH 7 . pH 34365 1 pressure 1 . atm 34365 1 temperature 303 . K 34365 1 stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID 34365 _Software.ID 1 _Software.Type . _Software.Name NMRPipe _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . 34365 1 stop_ loop_ _Task.Software_module _Task.Task _Task.Entry_ID _Task.Software_ID . processing 34365 1 stop_ save_ save_software_2 _Software.Sf_category software _Software.Sf_framecode software_2 _Software.Entry_ID 34365 _Software.ID 2 _Software.Type . _Software.Name Sparky _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Goddard . . 34365 2 stop_ loop_ _Task.Software_module _Task.Task _Task.Entry_ID _Task.Software_ID . 'chemical shift assignment' 34365 2 stop_ save_ save_software_3 _Software.Sf_category software _Software.Sf_framecode software_3 _Software.Entry_ID 34365 _Software.ID 3 _Software.Type . _Software.Name 'CcpNmr Analysis' _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID CCPN . . 34365 3 stop_ loop_ _Task.Software_module _Task.Task _Task.Entry_ID _Task.Software_ID . 'chemical shift assignment' 34365 3 stop_ save_ save_software_4 _Software.Sf_category software _Software.Sf_framecode software_4 _Software.Entry_ID 34365 _Software.ID 4 _Software.Type . _Software.Name TALOS _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Cornilescu, Delaglio and Bax' . . 34365 4 stop_ loop_ _Task.Software_module _Task.Task _Task.Entry_ID _Task.Software_ID . 'data analysis' 34365 4 stop_ save_ save_software_5 _Software.Sf_category software _Software.Sf_framecode software_5 _Software.Entry_ID 34365 _Software.ID 5 _Software.Type . _Software.Name CYANA _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Guntert, Mumenthaler and Wuthrich' . . 34365 5 stop_ loop_ _Task.Software_module _Task.Task _Task.Entry_ID _Task.Software_ID . 'structure calculation' 34365 5 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 34365 _NMR_spectrometer.ID 1 _NMR_spectrometer.Name . _NMR_spectrometer.Details '0.7 mm Rotor 111 kHz MAS' _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model 'AVANCE III' _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 1000 save_ save_NMR_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_2 _NMR_spectrometer.Entry_ID 34365 _NMR_spectrometer.ID 2 _NMR_spectrometer.Name . _NMR_spectrometer.Details '1.3 mm Rotor 60 kHz MAS' _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model 'AVANCE III' _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 34365 _NMR_spectrometer_list.ID 1 _NMR_spectrometer_list.Name . loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 NMR_spectrometer_2 Bruker 'AVANCE III' . 1000 . . . 34365 1 2 NMR_spectrometer_3 Bruker 'AVANCE III' . 800 . . . 34365 1 stop_ save_ ############################# # NMR applied experiments # ############################# save_experiment_list _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode experiment_list _Experiment_list.Entry_ID 34365 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '3D hCANH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 34365 1 2 '3D hCONH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 34365 1 3 '3D hcoCAcoNH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 34365 1 4 '3D hcaCBcaNH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 34365 1 5 '3D hcaCBcacoNH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 34365 1 6 '3D hNCAHa' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 34365 1 7 '3D hNcoCAHa' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 34365 1 8 '3D hCOCAHa' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 34365 1 9 '3D hCOnCAHa' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 34365 1 10 '3D HCCH-TOCSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 34365 1 11 '3D hCANH' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . 34365 1 12 '3D hCONH' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . 34365 1 13 '3D hcoCAcoNH' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . 34365 1 14 '3D hCOcaNH' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . 34365 1 15 '3D hNHH BASS-SD' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 34365 1 16 '3D hNNH BASS-SD' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 34365 1 17 '3D hCCH BASS-SD' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 34365 1 18 '3D hNHH RFDR' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 34365 1 19 '3D hCHH RFDR' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 34365 1 20 '4D HNNH RFDR' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . 34365 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 34365 _Chem_shift_reference.ID 1 _Chem_shift_reference.Name . _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 protons' . . . . ppm 0.000 internal indirect 0.25144953 . . . . . 34365 1 H 1 DSS 'methyl protons' . . . . ppm 0.000 internal direct 1.0 . . . . . 34365 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 34365 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name . _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 ; We do not have stereospecific assignments. This means that all HB2/HB3 assignments as well as LEU CD1/CD2 type assignments are ambiguous. ; _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 '3D hCANH' . . . 34365 1 2 '3D hCONH' . . . 34365 1 3 '3D hcoCAcoNH' . . . 34365 1 4 '3D hcaCBcaNH' . . . 34365 1 5 '3D hcaCBcacoNH' . . . 34365 1 6 '3D hNCAHa' . . . 34365 1 7 '3D hNcoCAHa' . . . 34365 1 8 '3D hCOCAHa' . . . 34365 1 9 '3D hCOnCAHa' . . . 34365 1 10 '3D HCCH-TOCSY' . . . 34365 1 11 '3D hCANH' . . . 34365 1 12 '3D hCONH' . . . 34365 1 13 '3D hcoCAcoNH' . . . 34365 1 14 '3D hCOcaNH' . . . 34365 1 15 '3D hNHH BASS-SD' . . . 34365 1 16 '3D hNNH BASS-SD' . . . 34365 1 17 '3D hCCH BASS-SD' . . . 34365 1 18 '3D hNHH RFDR' . . . 34365 1 19 '3D hCHH RFDR' . . . 34365 1 20 '4D HNNH RFDR' . . . 34365 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 4 $software_4 . . 34365 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 11 11 GLY C C 13 172.840 0.000 . . . . . . A 11 GLY C . 34365 1 2 . 1 . 1 12 12 TYR H H 1 7.595 0.054 . . . . . . A 12 TYR H . 34365 1 3 . 1 . 1 12 12 TYR HA H 1 3.888 0.029 . . . . . . A 12 TYR HA . 34365 1 4 . 1 . 1 12 12 TYR HB2 H 1 1.129 0.000 . . . . . . A 12 TYR HB2 . 34365 1 5 . 1 . 1 12 12 TYR HB3 H 1 1.677 0.000 . . . . . . A 12 TYR HB3 . 34365 1 6 . 1 . 1 12 12 TYR C C 13 174.749 0.467 . . . . . . A 12 TYR C . 34365 1 7 . 1 . 1 12 12 TYR CA C 13 55.799 0.096 . . . . . . A 12 TYR CA . 34365 1 8 . 1 . 1 12 12 TYR CB C 13 41.694 0.012 . . . . . . A 12 TYR CB . 34365 1 9 . 1 . 1 12 12 TYR N N 15 120.480 0.134 . . . . . . A 12 TYR N . 34365 1 10 . 1 . 1 13 13 ASN H H 1 8.330 0.031 . . . . . . A 13 ASN H . 34365 1 11 . 1 . 1 13 13 ASN HA H 1 4.497 0.021 . . . . . . A 13 ASN HA . 34365 1 12 . 1 . 1 13 13 ASN HB2 H 1 2.230 0.008 . . . . . . A 13 ASN HB2 . 34365 1 13 . 1 . 1 13 13 ASN HB3 H 1 2.324 0.010 . . . . . . A 13 ASN HB3 . 34365 1 14 . 1 . 1 13 13 ASN C C 13 173.117 0.079 . . . . . . A 13 ASN C . 34365 1 15 . 1 . 1 13 13 ASN CA C 13 51.294 0.077 . . . . . . A 13 ASN CA . 34365 1 16 . 1 . 1 13 13 ASN CB C 13 42.617 0.117 . . . . . . A 13 ASN CB . 34365 1 17 . 1 . 1 13 13 ASN N N 15 118.531 0.065 . . . . . . A 13 ASN N . 34365 1 18 . 1 . 1 14 14 GLN H H 1 8.086 0.033 . . . . . . A 14 GLN H . 34365 1 19 . 1 . 1 14 14 GLN HA H 1 3.177 0.015 . . . . . . A 14 GLN HA . 34365 1 20 . 1 . 1 14 14 GLN HB2 H 1 1.460 0.006 . . . . . . A 14 GLN HB2 . 34365 1 21 . 1 . 1 14 14 GLN HB3 H 1 1.710 0.053 . . . . . . A 14 GLN HB3 . 34365 1 22 . 1 . 1 14 14 GLN C C 13 176.290 0.096 . . . . . . A 14 GLN C . 34365 1 23 . 1 . 1 14 14 GLN CA C 13 57.478 0.074 . . . . . . A 14 GLN CA . 34365 1 24 . 1 . 1 14 14 GLN CB C 13 27.976 0.094 . . . . . . A 14 GLN CB . 34365 1 25 . 1 . 1 14 14 GLN CG C 13 33.477 0.067 . . . . . . A 14 GLN CG . 34365 1 26 . 1 . 1 14 14 GLN N N 15 119.397 0.076 . . . . . . A 14 GLN N . 34365 1 27 . 1 . 1 15 15 GLY H H 1 8.780 0.023 . . . . . . A 15 GLY H . 34365 1 28 . 1 . 1 15 15 GLY HA2 H 1 3.327 0.022 . . . . . . A 15 GLY HA2 . 34365 1 29 . 1 . 1 15 15 GLY HA3 H 1 4.074 0.014 . . . . . . A 15 GLY HA3 . 34365 1 30 . 1 . 1 15 15 GLY C C 13 173.434 0.071 . . . . . . A 15 GLY C . 34365 1 31 . 1 . 1 15 15 GLY CA C 13 44.403 0.054 . . . . . . A 15 GLY CA . 34365 1 32 . 1 . 1 15 15 GLY N N 15 116.487 0.156 . . . . . . A 15 GLY N . 34365 1 33 . 1 . 1 16 16 ASP H H 1 7.505 0.043 . . . . . . A 16 ASP H . 34365 1 34 . 1 . 1 16 16 ASP HA H 1 4.310 0.019 . . . . . . A 16 ASP HA . 34365 1 35 . 1 . 1 16 16 ASP C C 13 174.876 0.167 . . . . . . A 16 ASP C . 34365 1 36 . 1 . 1 16 16 ASP CA C 13 55.375 0.104 . . . . . . A 16 ASP CA . 34365 1 37 . 1 . 1 16 16 ASP CB C 13 40.868 0.136 . . . . . . A 16 ASP CB . 34365 1 38 . 1 . 1 16 16 ASP N N 15 120.679 0.152 . . . . . . A 16 ASP N . 34365 1 39 . 1 . 1 17 17 TRP H H 1 8.185 0.062 . . . . . . A 17 TRP H . 34365 1 40 . 1 . 1 17 17 TRP HA H 1 5.680 0.029 . . . . . . A 17 TRP HA . 34365 1 41 . 1 . 1 17 17 TRP HB2 H 1 2.909 0.024 . . . . . . A 17 TRP HB2 . 34365 1 42 . 1 . 1 17 17 TRP HB3 H 1 3.070 0.000 . . . . . . A 17 TRP HB3 . 34365 1 43 . 1 . 1 17 17 TRP C C 13 176.421 0.042 . . . . . . A 17 TRP C . 34365 1 44 . 1 . 1 17 17 TRP CA C 13 55.480 0.158 . . . . . . A 17 TRP CA . 34365 1 45 . 1 . 1 17 17 TRP CB C 13 32.503 0.079 . . . . . . A 17 TRP CB . 34365 1 46 . 1 . 1 17 17 TRP N N 15 117.515 0.052 . . . . . . A 17 TRP N . 34365 1 47 . 1 . 1 18 18 VAL H H 1 9.414 0.055 . . . . . . A 18 VAL H . 34365 1 48 . 1 . 1 18 18 VAL HA H 1 5.097 0.104 . . . . . . A 18 VAL HA . 34365 1 49 . 1 . 1 18 18 VAL HB H 1 1.478 0.060 . . . . . . A 18 VAL HB . 34365 1 50 . 1 . 1 18 18 VAL HG11 H 1 0.608 0.000 . . . . . . A 18 VAL HG11 . 34365 1 51 . 1 . 1 18 18 VAL HG12 H 1 0.608 0.000 . . . . . . A 18 VAL HG12 . 34365 1 52 . 1 . 1 18 18 VAL HG13 H 1 0.608 0.000 . . . . . . A 18 VAL HG13 . 34365 1 53 . 1 . 1 18 18 VAL C C 13 176.411 0.056 . . . . . . A 18 VAL C . 34365 1 54 . 1 . 1 18 18 VAL CA C 13 60.592 0.113 . . . . . . A 18 VAL CA . 34365 1 55 . 1 . 1 18 18 VAL CB C 13 34.965 0.023 . . . . . . A 18 VAL CB . 34365 1 56 . 1 . 1 18 18 VAL CG1 C 13 21.349 0.022 . . . . . . A 18 VAL CG1 . 34365 1 57 . 1 . 1 18 18 VAL CG2 C 13 23.113 0.000 . . . . . . A 18 VAL CG2 . 34365 1 58 . 1 . 1 18 18 VAL N N 15 119.338 0.236 . . . . . . A 18 VAL N . 34365 1 59 . 1 . 1 19 19 ALA H H 1 9.290 0.026 . . . . . . A 19 ALA H . 34365 1 60 . 1 . 1 19 19 ALA HA H 1 4.884 0.034 . . . . . . A 19 ALA HA . 34365 1 61 . 1 . 1 19 19 ALA HB1 H 1 1.420 0.018 . . . . . . A 19 ALA HB1 . 34365 1 62 . 1 . 1 19 19 ALA HB2 H 1 1.420 0.018 . . . . . . A 19 ALA HB2 . 34365 1 63 . 1 . 1 19 19 ALA HB3 H 1 1.420 0.018 . . . . . . A 19 ALA HB3 . 34365 1 64 . 1 . 1 19 19 ALA C C 13 174.534 0.103 . . . . . . A 19 ALA C . 34365 1 65 . 1 . 1 19 19 ALA CA C 13 50.374 0.055 . . . . . . A 19 ALA CA . 34365 1 66 . 1 . 1 19 19 ALA CB C 13 21.545 0.126 . . . . . . A 19 ALA CB . 34365 1 67 . 1 . 1 19 19 ALA N N 15 134.411 0.124 . . . . . . A 19 ALA N . 34365 1 68 . 1 . 1 20 20 SER H H 1 8.581 0.042 . . . . . . A 20 SER H . 34365 1 69 . 1 . 1 20 20 SER HA H 1 5.428 0.031 . . . . . . A 20 SER HA . 34365 1 70 . 1 . 1 20 20 SER HB2 H 1 3.151 0.008 . . . . . . A 20 SER HB2 . 34365 1 71 . 1 . 1 20 20 SER HB3 H 1 3.351 0.044 . . . . . . A 20 SER HB3 . 34365 1 72 . 1 . 1 20 20 SER C C 13 171.205 0.162 . . . . . . A 20 SER C . 34365 1 73 . 1 . 1 20 20 SER CA C 13 57.523 0.059 . . . . . . A 20 SER CA . 34365 1 74 . 1 . 1 20 20 SER CB C 13 64.889 0.071 . . . . . . A 20 SER CB . 34365 1 75 . 1 . 1 20 20 SER N N 15 117.571 0.143 . . . . . . A 20 SER N . 34365 1 76 . 1 . 1 21 21 PHE H H 1 8.748 0.024 . . . . . . A 21 PHE H . 34365 1 77 . 1 . 1 21 21 PHE HA H 1 5.048 0.020 . . . . . . A 21 PHE HA . 34365 1 78 . 1 . 1 21 21 PHE HB2 H 1 2.602 0.011 . . . . . . A 21 PHE HB2 . 34365 1 79 . 1 . 1 21 21 PHE HB3 H 1 2.901 0.018 . . . . . . A 21 PHE HB3 . 34365 1 80 . 1 . 1 21 21 PHE C C 13 173.716 0.104 . . . . . . A 21 PHE C . 34365 1 81 . 1 . 1 21 21 PHE CA C 13 55.427 0.058 . . . . . . A 21 PHE CA . 34365 1 82 . 1 . 1 21 21 PHE CB C 13 42.030 0.179 . . . . . . A 21 PHE CB . 34365 1 83 . 1 . 1 21 21 PHE N N 15 122.974 0.116 . . . . . . A 21 PHE N . 34365 1 84 . 1 . 1 22 22 ASN H H 1 8.536 0.040 . . . . . . A 22 ASN H . 34365 1 85 . 1 . 1 22 22 ASN HA H 1 5.333 0.021 . . . . . . A 22 ASN HA . 34365 1 86 . 1 . 1 22 22 ASN HB2 H 1 2.006 0.004 . . . . . . A 22 ASN HB2 . 34365 1 87 . 1 . 1 22 22 ASN HB3 H 1 2.059 0.016 . . . . . . A 22 ASN HB3 . 34365 1 88 . 1 . 1 22 22 ASN C C 13 174.154 0.104 . . . . . . A 22 ASN C . 34365 1 89 . 1 . 1 22 22 ASN CA C 13 52.665 0.068 . . . . . . A 22 ASN CA . 34365 1 90 . 1 . 1 22 22 ASN CB C 13 43.966 0.133 . . . . . . A 22 ASN CB . 34365 1 91 . 1 . 1 22 22 ASN N N 15 118.498 0.174 . . . . . . A 22 ASN N . 34365 1 92 . 1 . 1 23 23 PHE H H 1 9.142 0.033 . . . . . . A 23 PHE H . 34365 1 93 . 1 . 1 23 23 PHE HA H 1 4.646 0.013 . . . . . . A 23 PHE HA . 34365 1 94 . 1 . 1 23 23 PHE C C 13 175.318 0.135 . . . . . . A 23 PHE C . 34365 1 95 . 1 . 1 23 23 PHE CA C 13 57.904 0.049 . . . . . . A 23 PHE CA . 34365 1 96 . 1 . 1 23 23 PHE CB C 13 40.392 0.000 . . . . . . A 23 PHE CB . 34365 1 97 . 1 . 1 23 23 PHE N N 15 120.880 0.198 . . . . . . A 23 PHE N . 34365 1 98 . 1 . 1 24 24 SER H H 1 8.390 0.064 . . . . . . A 24 SER H . 34365 1 99 . 1 . 1 24 24 SER HA H 1 5.625 0.041 . . . . . . A 24 SER HA . 34365 1 100 . 1 . 1 24 24 SER C C 13 171.927 0.100 . . . . . . A 24 SER C . 34365 1 101 . 1 . 1 24 24 SER CA C 13 57.340 0.029 . . . . . . A 24 SER CA . 34365 1 102 . 1 . 1 24 24 SER CB C 13 64.531 0.000 . . . . . . A 24 SER CB . 34365 1 103 . 1 . 1 24 24 SER N N 15 121.197 0.103 . . . . . . A 24 SER N . 34365 1 104 . 1 . 1 25 25 LYS H H 1 9.232 0.046 . . . . . . A 25 LYS H . 34365 1 105 . 1 . 1 25 25 LYS HA H 1 4.334 0.049 . . . . . . A 25 LYS HA . 34365 1 106 . 1 . 1 25 25 LYS C C 13 173.706 0.238 . . . . . . A 25 LYS C . 34365 1 107 . 1 . 1 25 25 LYS CA C 13 54.181 0.100 . . . . . . A 25 LYS CA . 34365 1 108 . 1 . 1 25 25 LYS CB C 13 37.904 0.000 . . . . . . A 25 LYS CB . 34365 1 109 . 1 . 1 25 25 LYS N N 15 126.227 0.193 . . . . . . A 25 LYS N . 34365 1 110 . 1 . 1 26 26 VAL H H 1 8.803 0.035 . . . . . . A 26 VAL H . 34365 1 111 . 1 . 1 26 26 VAL HA H 1 4.400 0.023 . . . . . . A 26 VAL HA . 34365 1 112 . 1 . 1 26 26 VAL C C 13 174.926 0.154 . . . . . . A 26 VAL C . 34365 1 113 . 1 . 1 26 26 VAL CA C 13 61.202 0.076 . . . . . . A 26 VAL CA . 34365 1 114 . 1 . 1 26 26 VAL CB C 13 31.916 0.030 . . . . . . A 26 VAL CB . 34365 1 115 . 1 . 1 26 26 VAL N N 15 126.503 0.299 . . . . . . A 26 VAL N . 34365 1 116 . 1 . 1 27 27 TYR H H 1 9.149 0.025 . . . . . . A 27 TYR H . 34365 1 117 . 1 . 1 27 27 TYR HA H 1 4.455 0.030 . . . . . . A 27 TYR HA . 34365 1 118 . 1 . 1 27 27 TYR C C 13 174.879 0.106 . . . . . . A 27 TYR C . 34365 1 119 . 1 . 1 27 27 TYR CA C 13 56.764 0.045 . . . . . . A 27 TYR CA . 34365 1 120 . 1 . 1 27 27 TYR CB C 13 39.323 0.000 . . . . . . A 27 TYR CB . 34365 1 121 . 1 . 1 27 27 TYR N N 15 126.489 0.152 . . . . . . A 27 TYR N . 34365 1 122 . 1 . 1 28 28 VAL H H 1 8.312 0.023 . . . . . . A 28 VAL H . 34365 1 123 . 1 . 1 28 28 VAL C C 13 171.843 0.210 . . . . . . A 28 VAL C . 34365 1 124 . 1 . 1 28 28 VAL CA C 13 60.459 0.000 . . . . . . A 28 VAL CA . 34365 1 125 . 1 . 1 28 28 VAL CB C 13 34.835 0.000 . . . . . . A 28 VAL CB . 34365 1 126 . 1 . 1 28 28 VAL N N 15 122.355 0.094 . . . . . . A 28 VAL N . 34365 1 127 . 1 . 1 29 29 GLY H H 1 7.582 0.022 . . . . . . A 29 GLY H . 34365 1 128 . 1 . 1 29 29 GLY C C 13 172.331 0.108 . . . . . . A 29 GLY C . 34365 1 129 . 1 . 1 29 29 GLY CA C 13 45.103 0.000 . . . . . . A 29 GLY CA . 34365 1 130 . 1 . 1 29 29 GLY N N 15 106.692 0.060 . . . . . . A 29 GLY N . 34365 1 131 . 1 . 1 30 30 GLU H H 1 7.969 0.021 . . . . . . A 30 GLU H . 34365 1 132 . 1 . 1 30 30 GLU C C 13 171.272 0.076 . . . . . . A 30 GLU C . 34365 1 133 . 1 . 1 30 30 GLU CA C 13 61.471 0.000 . . . . . . A 30 GLU CA . 34365 1 134 . 1 . 1 30 30 GLU CB C 13 31.585 0.000 . . . . . . A 30 GLU CB . 34365 1 135 . 1 . 1 30 30 GLU N N 15 120.719 0.115 . . . . . . A 30 GLU N . 34365 1 136 . 1 . 1 31 31 GLU H H 1 7.571 0.041 . . . . . . A 31 GLU H . 34365 1 137 . 1 . 1 31 31 GLU HA H 1 4.544 0.002 . . . . . . A 31 GLU HA . 34365 1 138 . 1 . 1 31 31 GLU C C 13 174.996 0.069 . . . . . . A 31 GLU C . 34365 1 139 . 1 . 1 31 31 GLU CA C 13 56.420 0.094 . . . . . . A 31 GLU CA . 34365 1 140 . 1 . 1 31 31 GLU CB C 13 32.280 0.000 . . . . . . A 31 GLU CB . 34365 1 141 . 1 . 1 31 31 GLU N N 15 116.860 0.144 . . . . . . A 31 GLU N . 34365 1 142 . 1 . 1 32 32 LEU H H 1 8.993 0.030 . . . . . . A 32 LEU H . 34365 1 143 . 1 . 1 32 32 LEU HA H 1 4.476 0.041 . . . . . . A 32 LEU HA . 34365 1 144 . 1 . 1 32 32 LEU C C 13 177.586 0.183 . . . . . . A 32 LEU C . 34365 1 145 . 1 . 1 32 32 LEU CA C 13 54.874 0.019 . . . . . . A 32 LEU CA . 34365 1 146 . 1 . 1 32 32 LEU N N 15 128.831 0.142 . . . . . . A 32 LEU N . 34365 1 147 . 1 . 1 33 33 GLY H H 1 8.163 0.027 . . . . . . A 33 GLY H . 34365 1 148 . 1 . 1 33 33 GLY HA2 H 1 2.913 0.000 . . . . . . A 33 GLY HA2 . 34365 1 149 . 1 . 1 33 33 GLY HA3 H 1 5.356 0.052 . . . . . . A 33 GLY HA3 . 34365 1 150 . 1 . 1 33 33 GLY C C 13 171.147 0.139 . . . . . . A 33 GLY C . 34365 1 151 . 1 . 1 33 33 GLY CA C 13 44.027 0.084 . . . . . . A 33 GLY CA . 34365 1 152 . 1 . 1 33 33 GLY N N 15 111.353 0.279 . . . . . . A 33 GLY N . 34365 1 153 . 1 . 1 34 34 ASP H H 1 7.990 0.038 . . . . . . A 34 ASP H . 34365 1 154 . 1 . 1 34 34 ASP CA C 13 55.476 0.000 . . . . . . A 34 ASP CA . 34365 1 155 . 1 . 1 34 34 ASP CB C 13 40.498 0.000 . . . . . . A 34 ASP CB . 34365 1 156 . 1 . 1 34 34 ASP N N 15 118.627 0.076 . . . . . . A 34 ASP N . 34365 1 157 . 1 . 1 37 37 VAL C C 13 174.305 0.000 . . . . . . A 37 VAL C . 34365 1 158 . 1 . 1 38 38 GLY H H 1 8.047 0.010 . . . . . . A 38 GLY H . 34365 1 159 . 1 . 1 38 38 GLY C C 13 176.901 0.000 . . . . . . A 38 GLY C . 34365 1 160 . 1 . 1 38 38 GLY CA C 13 45.455 0.000 . . . . . . A 38 GLY CA . 34365 1 161 . 1 . 1 38 38 GLY N N 15 106.341 0.242 . . . . . . A 38 GLY N . 34365 1 162 . 1 . 1 39 39 GLY H H 1 7.862 0.008 . . . . . . A 39 GLY H . 34365 1 163 . 1 . 1 39 39 GLY C C 13 174.197 0.000 . . . . . . A 39 GLY C . 34365 1 164 . 1 . 1 39 39 GLY CA C 13 45.070 0.000 . . . . . . A 39 GLY CA . 34365 1 165 . 1 . 1 39 39 GLY N N 15 107.653 0.461 . . . . . . A 39 GLY N . 34365 1 166 . 1 . 1 40 40 GLY H H 1 7.515 0.021 . . . . . . A 40 GLY H . 34365 1 167 . 1 . 1 40 40 GLY CA C 13 44.136 0.000 . . . . . . A 40 GLY CA . 34365 1 168 . 1 . 1 40 40 GLY N N 15 108.446 0.138 . . . . . . A 40 GLY N . 34365 1 169 . 1 . 1 41 41 ALA H H 1 8.162 0.006 . . . . . . A 41 ALA H . 34365 1 170 . 1 . 1 41 41 ALA CA C 13 51.164 0.000 . . . . . . A 41 ALA CA . 34365 1 171 . 1 . 1 41 41 ALA CB C 13 20.210 0.000 . . . . . . A 41 ALA CB . 34365 1 172 . 1 . 1 41 41 ALA N N 15 124.064 0.142 . . . . . . A 41 ALA N . 34365 1 173 . 1 . 1 45 45 ALA H H 1 8.796 0.015 . . . . . . A 45 ALA H . 34365 1 174 . 1 . 1 45 45 ALA HA H 1 5.010 0.000 . . . . . . A 45 ALA HA . 34365 1 175 . 1 . 1 45 45 ALA C C 13 175.727 0.145 . . . . . . A 45 ALA C . 34365 1 176 . 1 . 1 45 45 ALA CA C 13 51.862 0.116 . . . . . . A 45 ALA CA . 34365 1 177 . 1 . 1 45 45 ALA CB C 13 22.002 0.000 . . . . . . A 45 ALA CB . 34365 1 178 . 1 . 1 45 45 ALA N N 15 127.399 0.198 . . . . . . A 45 ALA N . 34365 1 179 . 1 . 1 46 46 ASP H H 1 7.132 0.015 . . . . . . A 46 ASP H . 34365 1 180 . 1 . 1 46 46 ASP HA H 1 4.835 0.015 . . . . . . A 46 ASP HA . 34365 1 181 . 1 . 1 46 46 ASP HB2 H 1 2.182 0.000 . . . . . . A 46 ASP HB2 . 34365 1 182 . 1 . 1 46 46 ASP HB3 H 1 2.422 0.000 . . . . . . A 46 ASP HB3 . 34365 1 183 . 1 . 1 46 46 ASP C C 13 173.129 0.115 . . . . . . A 46 ASP C . 34365 1 184 . 1 . 1 46 46 ASP CA C 13 52.889 0.085 . . . . . . A 46 ASP CA . 34365 1 185 . 1 . 1 46 46 ASP CB C 13 44.605 0.008 . . . . . . A 46 ASP CB . 34365 1 186 . 1 . 1 46 46 ASP N N 15 117.468 0.178 . . . . . . A 46 ASP N . 34365 1 187 . 1 . 1 47 47 VAL H H 1 8.604 0.042 . . . . . . A 47 VAL H . 34365 1 188 . 1 . 1 47 47 VAL HA H 1 5.069 0.020 . . . . . . A 47 VAL HA . 34365 1 189 . 1 . 1 47 47 VAL HB H 1 1.792 0.024 . . . . . . A 47 VAL HB . 34365 1 190 . 1 . 1 47 47 VAL HG11 H 1 1.066 0.000 . . . . . . A 47 VAL HG11 . 34365 1 191 . 1 . 1 47 47 VAL HG12 H 1 1.066 0.000 . . . . . . A 47 VAL HG12 . 34365 1 192 . 1 . 1 47 47 VAL HG13 H 1 1.066 0.000 . . . . . . A 47 VAL HG13 . 34365 1 193 . 1 . 1 47 47 VAL HG21 H 1 1.019 0.001 . . . . . . A 47 VAL HG21 . 34365 1 194 . 1 . 1 47 47 VAL HG22 H 1 1.019 0.001 . . . . . . A 47 VAL HG22 . 34365 1 195 . 1 . 1 47 47 VAL HG23 H 1 1.019 0.001 . . . . . . A 47 VAL HG23 . 34365 1 196 . 1 . 1 47 47 VAL C C 13 173.201 0.087 . . . . . . A 47 VAL C . 34365 1 197 . 1 . 1 47 47 VAL CA C 13 58.914 0.074 . . . . . . A 47 VAL CA . 34365 1 198 . 1 . 1 47 47 VAL CB C 13 36.407 0.148 . . . . . . A 47 VAL CB . 34365 1 199 . 1 . 1 47 47 VAL CG1 C 13 20.245 0.080 . . . . . . A 47 VAL CG1 . 34365 1 200 . 1 . 1 47 47 VAL CG2 C 13 22.203 0.056 . . . . . . A 47 VAL CG2 . 34365 1 201 . 1 . 1 47 47 VAL N N 15 115.219 0.248 . . . . . . A 47 VAL N . 34365 1 202 . 1 . 1 48 48 SER H H 1 9.072 0.029 . . . . . . A 48 SER H . 34365 1 203 . 1 . 1 48 48 SER HA H 1 4.715 0.020 . . . . . . A 48 SER HA . 34365 1 204 . 1 . 1 48 48 SER HB2 H 1 3.673 0.018 . . . . . . A 48 SER HB2 . 34365 1 205 . 1 . 1 48 48 SER HB3 H 1 3.648 0.000 . . . . . . A 48 SER HB3 . 34365 1 206 . 1 . 1 48 48 SER C C 13 173.112 0.037 . . . . . . A 48 SER C . 34365 1 207 . 1 . 1 48 48 SER CA C 13 56.199 0.070 . . . . . . A 48 SER CA . 34365 1 208 . 1 . 1 48 48 SER CB C 13 65.644 0.065 . . . . . . A 48 SER CB . 34365 1 209 . 1 . 1 48 48 SER N N 15 115.832 0.312 . . . . . . A 48 SER N . 34365 1 210 . 1 . 1 49 49 ILE H H 1 7.891 0.015 . . . . . . A 49 ILE H . 34365 1 211 . 1 . 1 49 49 ILE HA H 1 4.228 0.016 . . . . . . A 49 ILE HA . 34365 1 212 . 1 . 1 49 49 ILE CA C 13 60.321 0.085 . . . . . . A 49 ILE CA . 34365 1 213 . 1 . 1 49 49 ILE N N 15 119.594 0.056 . . . . . . A 49 ILE N . 34365 1 214 . 1 . 1 54 54 THR H H 1 9.003 0.049 . . . . . . A 54 THR H . 34365 1 215 . 1 . 1 54 54 THR HA H 1 4.389 0.022 . . . . . . A 54 THR HA . 34365 1 216 . 1 . 1 54 54 THR HB H 1 3.669 0.020 . . . . . . A 54 THR HB . 34365 1 217 . 1 . 1 54 54 THR HG21 H 1 0.665 0.012 . . . . . . A 54 THR HG21 . 34365 1 218 . 1 . 1 54 54 THR HG22 H 1 0.665 0.012 . . . . . . A 54 THR HG22 . 34365 1 219 . 1 . 1 54 54 THR HG23 H 1 0.665 0.012 . . . . . . A 54 THR HG23 . 34365 1 220 . 1 . 1 54 54 THR C C 13 171.111 0.082 . . . . . . A 54 THR C . 34365 1 221 . 1 . 1 54 54 THR CA C 13 58.527 0.120 . . . . . . A 54 THR CA . 34365 1 222 . 1 . 1 54 54 THR CB C 13 69.944 0.128 . . . . . . A 54 THR CB . 34365 1 223 . 1 . 1 54 54 THR CG2 C 13 17.730 0.052 . . . . . . A 54 THR CG2 . 34365 1 224 . 1 . 1 54 54 THR N N 15 115.481 0.156 . . . . . . A 54 THR N . 34365 1 225 . 1 . 1 55 55 LEU H H 1 7.822 0.041 . . . . . . A 55 LEU H . 34365 1 226 . 1 . 1 55 55 LEU HA H 1 5.027 0.035 . . . . . . A 55 LEU HA . 34365 1 227 . 1 . 1 55 55 LEU HB2 H 1 1.209 0.059 . . . . . . A 55 LEU HB2 . 34365 1 228 . 1 . 1 55 55 LEU HB3 H 1 1.186 0.013 . . . . . . A 55 LEU HB3 . 34365 1 229 . 1 . 1 55 55 LEU HG H 1 1.393 0.022 . . . . . . A 55 LEU HG . 34365 1 230 . 1 . 1 55 55 LEU C C 13 175.698 0.100 . . . . . . A 55 LEU C . 34365 1 231 . 1 . 1 55 55 LEU CA C 13 53.426 0.582 . . . . . . A 55 LEU CA . 34365 1 232 . 1 . 1 55 55 LEU CB C 13 45.369 0.144 . . . . . . A 55 LEU CB . 34365 1 233 . 1 . 1 55 55 LEU CG C 13 27.356 0.279 . . . . . . A 55 LEU CG . 34365 1 234 . 1 . 1 55 55 LEU N N 15 122.332 0.170 . . . . . . A 55 LEU N . 34365 1 235 . 1 . 1 56 56 THR H H 1 9.078 0.026 . . . . . . A 56 THR H . 34365 1 236 . 1 . 1 56 56 THR HA H 1 4.467 0.032 . . . . . . A 56 THR HA . 34365 1 237 . 1 . 1 56 56 THR HB H 1 3.401 0.025 . . . . . . A 56 THR HB . 34365 1 238 . 1 . 1 56 56 THR HG21 H 1 0.718 0.016 . . . . . . A 56 THR HG21 . 34365 1 239 . 1 . 1 56 56 THR HG22 H 1 0.718 0.016 . . . . . . A 56 THR HG22 . 34365 1 240 . 1 . 1 56 56 THR HG23 H 1 0.718 0.016 . . . . . . A 56 THR HG23 . 34365 1 241 . 1 . 1 56 56 THR C C 13 171.098 0.048 . . . . . . A 56 THR C . 34365 1 242 . 1 . 1 56 56 THR CA C 13 59.929 0.102 . . . . . . A 56 THR CA . 34365 1 243 . 1 . 1 56 56 THR CB C 13 71.632 0.069 . . . . . . A 56 THR CB . 34365 1 244 . 1 . 1 56 56 THR CG2 C 13 21.846 0.109 . . . . . . A 56 THR CG2 . 34365 1 245 . 1 . 1 56 56 THR N N 15 112.244 0.161 . . . . . . A 56 THR N . 34365 1 246 . 1 . 1 57 57 PHE H H 1 7.926 0.022 . . . . . . A 57 PHE H . 34365 1 247 . 1 . 1 57 57 PHE HA H 1 5.412 0.027 . . . . . . A 57 PHE HA . 34365 1 248 . 1 . 1 57 57 PHE HB2 H 1 2.361 0.001 . . . . . . A 57 PHE HB2 . 34365 1 249 . 1 . 1 57 57 PHE HB3 H 1 2.708 0.026 . . . . . . A 57 PHE HB3 . 34365 1 250 . 1 . 1 57 57 PHE C C 13 173.208 0.005 . . . . . . A 57 PHE C . 34365 1 251 . 1 . 1 57 57 PHE CA C 13 54.925 0.021 . . . . . . A 57 PHE CA . 34365 1 252 . 1 . 1 57 57 PHE CB C 13 44.263 0.081 . . . . . . A 57 PHE CB . 34365 1 253 . 1 . 1 57 57 PHE N N 15 117.394 0.124 . . . . . . A 57 PHE N . 34365 1 254 . 1 . 1 58 58 ASP H H 1 8.159 0.029 . . . . . . A 58 ASP H . 34365 1 255 . 1 . 1 58 58 ASP HA H 1 5.212 0.033 . . . . . . A 58 ASP HA . 34365 1 256 . 1 . 1 58 58 ASP HB2 H 1 2.170 0.000 . . . . . . A 58 ASP HB2 . 34365 1 257 . 1 . 1 58 58 ASP HB3 H 1 2.274 0.009 . . . . . . A 58 ASP HB3 . 34365 1 258 . 1 . 1 58 58 ASP C C 13 171.817 0.072 . . . . . . A 58 ASP C . 34365 1 259 . 1 . 1 58 58 ASP CA C 13 53.662 0.088 . . . . . . A 58 ASP CA . 34365 1 260 . 1 . 1 58 58 ASP CB C 13 44.643 0.126 . . . . . . A 58 ASP CB . 34365 1 261 . 1 . 1 58 58 ASP N N 15 117.241 0.143 . . . . . . A 58 ASP N . 34365 1 262 . 1 . 1 59 59 ILE H H 1 8.642 0.017 . . . . . . A 59 ILE H . 34365 1 263 . 1 . 1 59 59 ILE HA H 1 5.296 0.037 . . . . . . A 59 ILE HA . 34365 1 264 . 1 . 1 59 59 ILE HB H 1 1.677 0.021 . . . . . . A 59 ILE HB . 34365 1 265 . 1 . 1 59 59 ILE HG12 H 1 1.341 0.018 . . . . . . A 59 ILE HG12 . 34365 1 266 . 1 . 1 59 59 ILE HG13 H 1 1.575 0.029 . . . . . . A 59 ILE HG13 . 34365 1 267 . 1 . 1 59 59 ILE HD11 H 1 0.988 0.040 . . . . . . A 59 ILE HD11 . 34365 1 268 . 1 . 1 59 59 ILE HD12 H 1 0.988 0.040 . . . . . . A 59 ILE HD12 . 34365 1 269 . 1 . 1 59 59 ILE HD13 H 1 0.988 0.040 . . . . . . A 59 ILE HD13 . 34365 1 270 . 1 . 1 59 59 ILE C C 13 171.163 0.186 . . . . . . A 59 ILE C . 34365 1 271 . 1 . 1 59 59 ILE CA C 13 55.690 0.117 . . . . . . A 59 ILE CA . 34365 1 272 . 1 . 1 59 59 ILE CB C 13 42.187 0.092 . . . . . . A 59 ILE CB . 34365 1 273 . 1 . 1 59 59 ILE CG1 C 13 29.396 0.079 . . . . . . A 59 ILE CG1 . 34365 1 274 . 1 . 1 59 59 ILE CG2 C 13 17.529 0.000 . . . . . . A 59 ILE CG2 . 34365 1 275 . 1 . 1 59 59 ILE CD1 C 13 14.736 0.096 . . . . . . A 59 ILE CD1 . 34365 1 276 . 1 . 1 59 59 ILE N N 15 119.922 0.118 . . . . . . A 59 ILE N . 34365 1 277 . 1 . 1 60 60 ALA H H 1 8.662 0.060 . . . . . . A 60 ALA H . 34365 1 278 . 1 . 1 60 60 ALA HA H 1 5.755 0.032 . . . . . . A 60 ALA HA . 34365 1 279 . 1 . 1 60 60 ALA HB1 H 1 0.838 0.031 . . . . . . A 60 ALA HB1 . 34365 1 280 . 1 . 1 60 60 ALA HB2 H 1 0.838 0.031 . . . . . . A 60 ALA HB2 . 34365 1 281 . 1 . 1 60 60 ALA HB3 H 1 0.838 0.031 . . . . . . A 60 ALA HB3 . 34365 1 282 . 1 . 1 60 60 ALA C C 13 175.096 0.085 . . . . . . A 60 ALA C . 34365 1 283 . 1 . 1 60 60 ALA CA C 13 49.049 0.101 . . . . . . A 60 ALA CA . 34365 1 284 . 1 . 1 60 60 ALA CB C 13 23.196 0.090 . . . . . . A 60 ALA CB . 34365 1 285 . 1 . 1 60 60 ALA N N 15 128.497 0.163 . . . . . . A 60 ALA N . 34365 1 286 . 1 . 1 61 61 TYR H H 1 8.066 0.039 . . . . . . A 61 TYR H . 34365 1 287 . 1 . 1 61 61 TYR HA H 1 4.323 0.021 . . . . . . A 61 TYR HA . 34365 1 288 . 1 . 1 61 61 TYR HB2 H 1 2.497 0.015 . . . . . . A 61 TYR HB2 . 34365 1 289 . 1 . 1 61 61 TYR HB3 H 1 2.993 0.033 . . . . . . A 61 TYR HB3 . 34365 1 290 . 1 . 1 61 61 TYR C C 13 174.734 0.042 . . . . . . A 61 TYR C . 34365 1 291 . 1 . 1 61 61 TYR CA C 13 55.490 0.080 . . . . . . A 61 TYR CA . 34365 1 292 . 1 . 1 61 61 TYR CB C 13 41.457 0.087 . . . . . . A 61 TYR CB . 34365 1 293 . 1 . 1 61 61 TYR N N 15 119.589 0.086 . . . . . . A 61 TYR N . 34365 1 294 . 1 . 1 62 62 PHE H H 1 7.828 0.036 . . . . . . A 62 PHE H . 34365 1 295 . 1 . 1 62 62 PHE HA H 1 3.751 0.044 . . . . . . A 62 PHE HA . 34365 1 296 . 1 . 1 62 62 PHE HB2 H 1 2.301 0.078 . . . . . . A 62 PHE HB2 . 34365 1 297 . 1 . 1 62 62 PHE HB3 H 1 2.763 0.013 . . . . . . A 62 PHE HB3 . 34365 1 298 . 1 . 1 62 62 PHE C C 13 175.397 0.075 . . . . . . A 62 PHE C . 34365 1 299 . 1 . 1 62 62 PHE CA C 13 59.306 0.104 . . . . . . A 62 PHE CA . 34365 1 300 . 1 . 1 62 62 PHE CB C 13 36.736 0.168 . . . . . . A 62 PHE CB . 34365 1 301 . 1 . 1 62 62 PHE N N 15 127.821 0.074 . . . . . . A 62 PHE N . 34365 1 302 . 1 . 1 63 63 VAL H H 1 7.697 0.031 . . . . . . A 63 VAL H . 34365 1 303 . 1 . 1 63 63 VAL HA H 1 3.710 0.016 . . . . . . A 63 VAL HA . 34365 1 304 . 1 . 1 63 63 VAL HB H 1 2.005 0.057 . . . . . . A 63 VAL HB . 34365 1 305 . 1 . 1 63 63 VAL HG11 H 1 0.485 0.000 . . . . . . A 63 VAL HG11 . 34365 1 306 . 1 . 1 63 63 VAL HG12 H 1 0.485 0.000 . . . . . . A 63 VAL HG12 . 34365 1 307 . 1 . 1 63 63 VAL HG13 H 1 0.485 0.000 . . . . . . A 63 VAL HG13 . 34365 1 308 . 1 . 1 63 63 VAL HG21 H 1 0.886 0.000 . . . . . . A 63 VAL HG21 . 34365 1 309 . 1 . 1 63 63 VAL HG22 H 1 0.886 0.000 . . . . . . A 63 VAL HG22 . 34365 1 310 . 1 . 1 63 63 VAL HG23 H 1 0.886 0.000 . . . . . . A 63 VAL HG23 . 34365 1 311 . 1 . 1 63 63 VAL C C 13 175.366 0.102 . . . . . . A 63 VAL C . 34365 1 312 . 1 . 1 63 63 VAL CA C 13 62.194 0.215 . . . . . . A 63 VAL CA . 34365 1 313 . 1 . 1 63 63 VAL CB C 13 31.672 0.144 . . . . . . A 63 VAL CB . 34365 1 314 . 1 . 1 63 63 VAL CG1 C 13 19.178 0.000 . . . . . . A 63 VAL CG1 . 34365 1 315 . 1 . 1 63 63 VAL CG2 C 13 21.209 0.000 . . . . . . A 63 VAL CG2 . 34365 1 316 . 1 . 1 63 63 VAL N N 15 121.961 0.073 . . . . . . A 63 VAL N . 34365 1 317 . 1 . 1 64 64 SER H H 1 8.161 0.011 . . . . . . A 64 SER H . 34365 1 318 . 1 . 1 64 64 SER HA H 1 4.491 0.044 . . . . . . A 64 SER HA . 34365 1 319 . 1 . 1 64 64 SER HB2 H 1 4.256 0.011 . . . . . . A 64 SER HB2 . 34365 1 320 . 1 . 1 64 64 SER HB3 H 1 4.439 0.017 . . . . . . A 64 SER HB3 . 34365 1 321 . 1 . 1 64 64 SER C C 13 172.353 0.092 . . . . . . A 64 SER C . 34365 1 322 . 1 . 1 64 64 SER CA C 13 56.061 0.077 . . . . . . A 64 SER CA . 34365 1 323 . 1 . 1 64 64 SER CB C 13 66.238 0.073 . . . . . . A 64 SER CB . 34365 1 324 . 1 . 1 64 64 SER N N 15 115.326 0.096 . . . . . . A 64 SER N . 34365 1 325 . 1 . 1 65 65 SER H H 1 8.426 0.024 . . . . . . A 65 SER H . 34365 1 326 . 1 . 1 65 65 SER HA H 1 3.706 0.024 . . . . . . A 65 SER HA . 34365 1 327 . 1 . 1 65 65 SER HB2 H 1 3.719 0.030 . . . . . . A 65 SER HB2 . 34365 1 328 . 1 . 1 65 65 SER HB3 H 1 3.870 0.002 . . . . . . A 65 SER HB3 . 34365 1 329 . 1 . 1 65 65 SER C C 13 172.810 0.055 . . . . . . A 65 SER C . 34365 1 330 . 1 . 1 65 65 SER CA C 13 61.546 0.058 . . . . . . A 65 SER CA . 34365 1 331 . 1 . 1 65 65 SER CB C 13 63.351 0.095 . . . . . . A 65 SER CB . 34365 1 332 . 1 . 1 65 65 SER N N 15 111.566 0.147 . . . . . . A 65 SER N . 34365 1 333 . 1 . 1 66 66 ASN H H 1 7.437 0.021 . . . . . . A 66 ASN H . 34365 1 334 . 1 . 1 66 66 ASN HA H 1 4.804 0.015 . . . . . . A 66 ASN HA . 34365 1 335 . 1 . 1 66 66 ASN HB2 H 1 1.790 0.000 . . . . . . A 66 ASN HB2 . 34365 1 336 . 1 . 1 66 66 ASN HB3 H 1 1.986 0.000 . . . . . . A 66 ASN HB3 . 34365 1 337 . 1 . 1 66 66 ASN C C 13 172.863 0.035 . . . . . . A 66 ASN C . 34365 1 338 . 1 . 1 66 66 ASN CA C 13 54.376 0.027 . . . . . . A 66 ASN CA . 34365 1 339 . 1 . 1 66 66 ASN CB C 13 43.132 0.038 . . . . . . A 66 ASN CB . 34365 1 340 . 1 . 1 66 66 ASN N N 15 110.875 0.162 . . . . . . A 66 ASN N . 34365 1 341 . 1 . 1 67 67 ILE H H 1 7.158 0.021 . . . . . . A 67 ILE H . 34365 1 342 . 1 . 1 67 67 ILE HA H 1 4.882 0.024 . . . . . . A 67 ILE HA . 34365 1 343 . 1 . 1 67 67 ILE HB H 1 1.515 0.011 . . . . . . A 67 ILE HB . 34365 1 344 . 1 . 1 67 67 ILE HG21 H 1 0.488 0.001 . . . . . . A 67 ILE HG21 . 34365 1 345 . 1 . 1 67 67 ILE HG22 H 1 0.488 0.001 . . . . . . A 67 ILE HG22 . 34365 1 346 . 1 . 1 67 67 ILE HG23 H 1 0.488 0.001 . . . . . . A 67 ILE HG23 . 34365 1 347 . 1 . 1 67 67 ILE C C 13 173.316 0.060 . . . . . . A 67 ILE C . 34365 1 348 . 1 . 1 67 67 ILE CA C 13 59.231 0.097 . . . . . . A 67 ILE CA . 34365 1 349 . 1 . 1 67 67 ILE CB C 13 38.496 0.068 . . . . . . A 67 ILE CB . 34365 1 350 . 1 . 1 67 67 ILE CG1 C 13 28.220 0.000 . . . . . . A 67 ILE CG1 . 34365 1 351 . 1 . 1 67 67 ILE CG2 C 13 17.173 0.096 . . . . . . A 67 ILE CG2 . 34365 1 352 . 1 . 1 67 67 ILE N N 15 118.623 0.110 . . . . . . A 67 ILE N . 34365 1 353 . 1 . 1 68 68 ALA H H 1 8.326 0.029 . . . . . . A 68 ALA H . 34365 1 354 . 1 . 1 68 68 ALA HA H 1 4.666 0.026 . . . . . . A 68 ALA HA . 34365 1 355 . 1 . 1 68 68 ALA HB1 H 1 -0.561 0.029 . . . . . . A 68 ALA HB1 . 34365 1 356 . 1 . 1 68 68 ALA HB2 H 1 -0.561 0.029 . . . . . . A 68 ALA HB2 . 34365 1 357 . 1 . 1 68 68 ALA HB3 H 1 -0.561 0.029 . . . . . . A 68 ALA HB3 . 34365 1 358 . 1 . 1 68 68 ALA C C 13 175.932 0.043 . . . . . . A 68 ALA C . 34365 1 359 . 1 . 1 68 68 ALA CA C 13 48.575 0.049 . . . . . . A 68 ALA CA . 34365 1 360 . 1 . 1 68 68 ALA CB C 13 21.508 0.087 . . . . . . A 68 ALA CB . 34365 1 361 . 1 . 1 68 68 ALA N N 15 126.828 0.123 . . . . . . A 68 ALA N . 34365 1 362 . 1 . 1 69 69 VAL H H 1 8.197 0.043 . . . . . . A 69 VAL H . 34365 1 363 . 1 . 1 69 69 VAL HA H 1 4.571 0.040 . . . . . . A 69 VAL HA . 34365 1 364 . 1 . 1 69 69 VAL HB H 1 1.657 0.038 . . . . . . A 69 VAL HB . 34365 1 365 . 1 . 1 69 69 VAL HG11 H 1 0.634 0.048 . . . . . . A 69 VAL HG11 . 34365 1 366 . 1 . 1 69 69 VAL HG12 H 1 0.634 0.048 . . . . . . A 69 VAL HG12 . 34365 1 367 . 1 . 1 69 69 VAL HG13 H 1 0.634 0.048 . . . . . . A 69 VAL HG13 . 34365 1 368 . 1 . 1 69 69 VAL HG21 H 1 0.697 0.051 . . . . . . A 69 VAL HG21 . 34365 1 369 . 1 . 1 69 69 VAL HG22 H 1 0.697 0.051 . . . . . . A 69 VAL HG22 . 34365 1 370 . 1 . 1 69 69 VAL HG23 H 1 0.697 0.051 . . . . . . A 69 VAL HG23 . 34365 1 371 . 1 . 1 69 69 VAL C C 13 173.966 0.062 . . . . . . A 69 VAL C . 34365 1 372 . 1 . 1 69 69 VAL CA C 13 60.327 0.064 . . . . . . A 69 VAL CA . 34365 1 373 . 1 . 1 69 69 VAL CB C 13 32.915 0.085 . . . . . . A 69 VAL CB . 34365 1 374 . 1 . 1 69 69 VAL CG1 C 13 21.824 0.289 . . . . . . A 69 VAL CG1 . 34365 1 375 . 1 . 1 69 69 VAL CG2 C 13 21.351 0.465 . . . . . . A 69 VAL CG2 . 34365 1 376 . 1 . 1 69 69 VAL N N 15 119.260 0.099 . . . . . . A 69 VAL N . 34365 1 377 . 1 . 1 70 70 ASP H H 1 9.005 0.031 . . . . . . A 70 ASP H . 34365 1 378 . 1 . 1 70 70 ASP HA H 1 5.493 0.028 . . . . . . A 70 ASP HA . 34365 1 379 . 1 . 1 70 70 ASP HB2 H 1 1.855 0.028 . . . . . . A 70 ASP HB2 . 34365 1 380 . 1 . 1 70 70 ASP HB3 H 1 2.210 0.035 . . . . . . A 70 ASP HB3 . 34365 1 381 . 1 . 1 70 70 ASP C C 13 172.676 0.024 . . . . . . A 70 ASP C . 34365 1 382 . 1 . 1 70 70 ASP CA C 13 51.534 0.076 . . . . . . A 70 ASP CA . 34365 1 383 . 1 . 1 70 70 ASP CB C 13 43.955 0.059 . . . . . . A 70 ASP CB . 34365 1 384 . 1 . 1 70 70 ASP N N 15 124.526 0.075 . . . . . . A 70 ASP N . 34365 1 385 . 1 . 1 71 71 PHE H H 1 9.318 0.041 . . . . . . A 71 PHE H . 34365 1 386 . 1 . 1 71 71 PHE HA H 1 5.420 0.019 . . . . . . A 71 PHE HA . 34365 1 387 . 1 . 1 71 71 PHE HB2 H 1 2.587 0.004 . . . . . . A 71 PHE HB2 . 34365 1 388 . 1 . 1 71 71 PHE HB3 H 1 2.763 0.023 . . . . . . A 71 PHE HB3 . 34365 1 389 . 1 . 1 71 71 PHE C C 13 171.756 0.083 . . . . . . A 71 PHE C . 34365 1 390 . 1 . 1 71 71 PHE CA C 13 56.436 0.052 . . . . . . A 71 PHE CA . 34365 1 391 . 1 . 1 71 71 PHE CB C 13 42.443 0.062 . . . . . . A 71 PHE CB . 34365 1 392 . 1 . 1 71 71 PHE N N 15 125.961 0.071 . . . . . . A 71 PHE N . 34365 1 393 . 1 . 1 72 72 PHE H H 1 8.098 0.033 . . . . . . A 72 PHE H . 34365 1 394 . 1 . 1 72 72 PHE HA H 1 4.928 0.022 . . . . . . A 72 PHE HA . 34365 1 395 . 1 . 1 72 72 PHE HB2 H 1 2.335 0.025 . . . . . . A 72 PHE HB2 . 34365 1 396 . 1 . 1 72 72 PHE HB3 H 1 2.627 0.016 . . . . . . A 72 PHE HB3 . 34365 1 397 . 1 . 1 72 72 PHE C C 13 172.545 0.062 . . . . . . A 72 PHE C . 34365 1 398 . 1 . 1 72 72 PHE CA C 13 55.161 0.049 . . . . . . A 72 PHE CA . 34365 1 399 . 1 . 1 72 72 PHE CB C 13 42.945 0.088 . . . . . . A 72 PHE CB . 34365 1 400 . 1 . 1 72 72 PHE N N 15 129.078 0.074 . . . . . . A 72 PHE N . 34365 1 401 . 1 . 1 73 73 VAL H H 1 8.012 0.041 . . . . . . A 73 VAL H . 34365 1 402 . 1 . 1 73 73 VAL HA H 1 3.881 0.041 . . . . . . A 73 VAL HA . 34365 1 403 . 1 . 1 73 73 VAL HB H 1 2.007 0.002 . . . . . . A 73 VAL HB . 34365 1 404 . 1 . 1 73 73 VAL HG11 H 1 0.788 0.000 . . . . . . A 73 VAL HG11 . 34365 1 405 . 1 . 1 73 73 VAL HG12 H 1 0.788 0.000 . . . . . . A 73 VAL HG12 . 34365 1 406 . 1 . 1 73 73 VAL HG13 H 1 0.788 0.000 . . . . . . A 73 VAL HG13 . 34365 1 407 . 1 . 1 73 73 VAL HG21 H 1 0.726 0.000 . . . . . . A 73 VAL HG21 . 34365 1 408 . 1 . 1 73 73 VAL HG22 H 1 0.726 0.000 . . . . . . A 73 VAL HG22 . 34365 1 409 . 1 . 1 73 73 VAL HG23 H 1 0.726 0.000 . . . . . . A 73 VAL HG23 . 34365 1 410 . 1 . 1 73 73 VAL C C 13 175.347 0.037 . . . . . . A 73 VAL C . 34365 1 411 . 1 . 1 73 73 VAL CA C 13 60.164 0.054 . . . . . . A 73 VAL CA . 34365 1 412 . 1 . 1 73 73 VAL CB C 13 32.211 1.043 . . . . . . A 73 VAL CB . 34365 1 413 . 1 . 1 73 73 VAL CG1 C 13 22.630 0.117 . . . . . . A 73 VAL CG1 . 34365 1 414 . 1 . 1 73 73 VAL CG2 C 13 21.142 0.032 . . . . . . A 73 VAL CG2 . 34365 1 415 . 1 . 1 73 73 VAL N N 15 121.367 0.135 . . . . . . A 73 VAL N . 34365 1 416 . 1 . 1 74 74 GLY CA C 13 46.748 0.000 . . . . . . A 74 GLY CA . 34365 1 417 . 1 . 1 75 75 VAL H H 1 8.197 0.043 . . . . . . A 75 VAL H . 34365 1 418 . 1 . 1 75 75 VAL N N 15 115.403 0.098 . . . . . . A 75 VAL N . 34365 1 419 . 1 . 1 76 76 PRO HA H 1 3.998 0.015 . . . . . . A 76 PRO HA . 34365 1 420 . 1 . 1 76 76 PRO HB2 H 1 1.582 0.017 . . . . . . A 76 PRO HB2 . 34365 1 421 . 1 . 1 76 76 PRO HB3 H 1 1.827 0.043 . . . . . . A 76 PRO HB3 . 34365 1 422 . 1 . 1 76 76 PRO HG2 H 1 1.316 0.029 . . . . . . A 76 PRO HG2 . 34365 1 423 . 1 . 1 76 76 PRO HG3 H 1 1.859 0.031 . . . . . . A 76 PRO HG3 . 34365 1 424 . 1 . 1 76 76 PRO HD2 H 1 3.28 0.018 . . . . . . A 76 PRO HD2 . 34365 1 425 . 1 . 1 76 76 PRO HD3 H 1 3.519 0.031 . . . . . . A 76 PRO HD3 . 34365 1 426 . 1 . 1 76 76 PRO C C 13 175.053 0.170 . . . . . . A 76 PRO C . 34365 1 427 . 1 . 1 76 76 PRO CA C 13 64.454 0.055 . . . . . . A 76 PRO CA . 34365 1 428 . 1 . 1 76 76 PRO CB C 13 32.427 0.106 . . . . . . A 76 PRO CB . 34365 1 429 . 1 . 1 76 76 PRO CG C 13 27.016 0.076 . . . . . . A 76 PRO CG . 34365 1 430 . 1 . 1 76 76 PRO CD C 13 47.352 0.080 . . . . . . A 76 PRO CD . 34365 1 431 . 1 . 1 77 77 ALA H H 1 7.740 0.035 . . . . . . A 77 ALA H . 34365 1 432 . 1 . 1 77 77 ALA HA H 1 4.199 0.018 . . . . . . A 77 ALA HA . 34365 1 433 . 1 . 1 77 77 ALA HB1 H 1 0.765 0.005 . . . . . . A 77 ALA HB1 . 34365 1 434 . 1 . 1 77 77 ALA HB2 H 1 0.765 0.005 . . . . . . A 77 ALA HB2 . 34365 1 435 . 1 . 1 77 77 ALA HB3 H 1 0.765 0.005 . . . . . . A 77 ALA HB3 . 34365 1 436 . 1 . 1 77 77 ALA C C 13 174.243 0.019 . . . . . . A 77 ALA C . 34365 1 437 . 1 . 1 77 77 ALA CA C 13 49.986 0.052 . . . . . . A 77 ALA CA . 34365 1 438 . 1 . 1 77 77 ALA CB C 13 20.135 0.135 . . . . . . A 77 ALA CB . 34365 1 439 . 1 . 1 77 77 ALA N N 15 125.141 0.107 . . . . . . A 77 ALA N . 34365 1 440 . 1 . 1 78 78 ARG H H 1 9.251 0.015 . . . . . . A 78 ARG H . 34365 1 441 . 1 . 1 78 78 ARG HA H 1 5.130 0.022 . . . . . . A 78 ARG HA . 34365 1 442 . 1 . 1 78 78 ARG HB2 H 1 1.447 0.026 . . . . . . A 78 ARG HB2 . 34365 1 443 . 1 . 1 78 78 ARG HB3 H 1 1.403 0.000 . . . . . . A 78 ARG HB3 . 34365 1 444 . 1 . 1 78 78 ARG HG2 H 1 1.335 0.000 . . . . . . A 78 ARG HG2 . 34365 1 445 . 1 . 1 78 78 ARG HG3 H 1 1.335 0.000 . . . . . . A 78 ARG HG3 . 34365 1 446 . 1 . 1 78 78 ARG C C 13 176.505 0.080 . . . . . . A 78 ARG C . 34365 1 447 . 1 . 1 78 78 ARG CA C 13 55.127 0.067 . . . . . . A 78 ARG CA . 34365 1 448 . 1 . 1 78 78 ARG CB C 13 33.060 0.152 . . . . . . A 78 ARG CB . 34365 1 449 . 1 . 1 78 78 ARG CG C 13 24.456 0.061 . . . . . . A 78 ARG CG . 34365 1 450 . 1 . 1 78 78 ARG N N 15 119.759 0.161 . . . . . . A 78 ARG N . 34365 1 451 . 1 . 1 79 79 ALA H H 1 9.858 0.037 . . . . . . A 79 ALA H . 34365 1 452 . 1 . 1 79 79 ALA HA H 1 4.671 0.032 . . . . . . A 79 ALA HA . 34365 1 453 . 1 . 1 79 79 ALA HB1 H 1 1.052 0.025 . . . . . . A 79 ALA HB1 . 34365 1 454 . 1 . 1 79 79 ALA HB2 H 1 1.052 0.025 . . . . . . A 79 ALA HB2 . 34365 1 455 . 1 . 1 79 79 ALA HB3 H 1 1.052 0.025 . . . . . . A 79 ALA HB3 . 34365 1 456 . 1 . 1 79 79 ALA C C 13 175.265 0.090 . . . . . . A 79 ALA C . 34365 1 457 . 1 . 1 79 79 ALA CA C 13 50.523 0.055 . . . . . . A 79 ALA CA . 34365 1 458 . 1 . 1 79 79 ALA CB C 13 19.815 0.074 . . . . . . A 79 ALA CB . 34365 1 459 . 1 . 1 79 79 ALA N N 15 131.262 0.133 . . . . . . A 79 ALA N . 34365 1 460 . 1 . 1 80 80 LYS H H 1 8.650 0.044 . . . . . . A 80 LYS H . 34365 1 461 . 1 . 1 80 80 LYS HA H 1 4.542 0.016 . . . . . . A 80 LYS HA . 34365 1 462 . 1 . 1 80 80 LYS HB2 H 1 1.430 0.033 . . . . . . A 80 LYS HB2 . 34365 1 463 . 1 . 1 80 80 LYS HB3 H 1 1.654 0.023 . . . . . . A 80 LYS HB3 . 34365 1 464 . 1 . 1 80 80 LYS HG2 H 1 1.058 0.010 . . . . . . A 80 LYS HG2 . 34365 1 465 . 1 . 1 80 80 LYS HG3 H 1 1.058 0.010 . . . . . . A 80 LYS HG3 . 34365 1 466 . 1 . 1 80 80 LYS C C 13 175.285 0.079 . . . . . . A 80 LYS C . 34365 1 467 . 1 . 1 80 80 LYS CA C 13 55.161 0.071 . . . . . . A 80 LYS CA . 34365 1 468 . 1 . 1 80 80 LYS CB C 13 32.415 0.067 . . . . . . A 80 LYS CB . 34365 1 469 . 1 . 1 80 80 LYS CG C 13 25.225 0.075 . . . . . . A 80 LYS CG . 34365 1 470 . 1 . 1 80 80 LYS N N 15 123.611 0.118 . . . . . . A 80 LYS N . 34365 1 471 . 1 . 1 81 81 PHE H H 1 8.399 0.057 . . . . . . A 81 PHE H . 34365 1 472 . 1 . 1 81 81 PHE HA H 1 4.555 0.016 . . . . . . A 81 PHE HA . 34365 1 473 . 1 . 1 81 81 PHE HB2 H 1 2.821 0.016 . . . . . . A 81 PHE HB2 . 34365 1 474 . 1 . 1 81 81 PHE HB3 H 1 2.821 0.016 . . . . . . A 81 PHE HB3 . 34365 1 475 . 1 . 1 81 81 PHE C C 13 174.566 0.088 . . . . . . A 81 PHE C . 34365 1 476 . 1 . 1 81 81 PHE CA C 13 57.031 0.124 . . . . . . A 81 PHE CA . 34365 1 477 . 1 . 1 81 81 PHE CB C 13 39.076 0.077 . . . . . . A 81 PHE CB . 34365 1 478 . 1 . 1 81 81 PHE N N 15 123.875 0.162 . . . . . . A 81 PHE N . 34365 1 479 . 1 . 1 82 82 GLN H H 1 9.175 0.025 . . . . . . A 82 GLN H . 34365 1 480 . 1 . 1 82 82 GLN HA H 1 4.792 0.023 . . . . . . A 82 GLN HA . 34365 1 481 . 1 . 1 82 82 GLN HB2 H 1 1.783 0.010 . . . . . . A 82 GLN HB2 . 34365 1 482 . 1 . 1 82 82 GLN HB3 H 1 2.064 0.039 . . . . . . A 82 GLN HB3 . 34365 1 483 . 1 . 1 82 82 GLN C C 13 175.811 0.095 . . . . . . A 82 GLN C . 34365 1 484 . 1 . 1 82 82 GLN CA C 13 53.740 0.074 . . . . . . A 82 GLN CA . 34365 1 485 . 1 . 1 82 82 GLN CB C 13 30.696 0.081 . . . . . . A 82 GLN CB . 34365 1 486 . 1 . 1 82 82 GLN CG C 13 33.169 0.030 . . . . . . A 82 GLN CG . 34365 1 487 . 1 . 1 82 82 GLN N N 15 127.249 0.238 . . . . . . A 82 GLN N . 34365 1 488 . 1 . 1 83 83 GLY H H 1 9.105 0.032 . . . . . . A 83 GLY H . 34365 1 489 . 1 . 1 83 83 GLY HA2 H 1 3.387 0.026 . . . . . . A 83 GLY HA2 . 34365 1 490 . 1 . 1 83 83 GLY HA3 H 1 3.739 0.016 . . . . . . A 83 GLY HA3 . 34365 1 491 . 1 . 1 83 83 GLY C C 13 172.106 0.076 . . . . . . A 83 GLY C . 34365 1 492 . 1 . 1 83 83 GLY CA C 13 46.677 0.051 . . . . . . A 83 GLY CA . 34365 1 493 . 1 . 1 83 83 GLY N N 15 112.458 0.136 . . . . . . A 83 GLY N . 34365 1 494 . 1 . 1 84 84 GLU H H 1 7.846 0.015 . . . . . . A 84 GLU H . 34365 1 495 . 1 . 1 84 84 GLU HA H 1 4.665 0.020 . . . . . . A 84 GLU HA . 34365 1 496 . 1 . 1 84 84 GLU HB2 H 1 2.062 0.014 . . . . . . A 84 GLU HB2 . 34365 1 497 . 1 . 1 84 84 GLU HB3 H 1 2.115 0.055 . . . . . . A 84 GLU HB3 . 34365 1 498 . 1 . 1 84 84 GLU HG2 H 1 2.030 0.010 . . . . . . A 84 GLU HG2 . 34365 1 499 . 1 . 1 84 84 GLU HG3 H 1 2.135 0.024 . . . . . . A 84 GLU HG3 . 34365 1 500 . 1 . 1 84 84 GLU C C 13 175.689 0.029 . . . . . . A 84 GLU C . 34365 1 501 . 1 . 1 84 84 GLU CA C 13 53.560 0.075 . . . . . . A 84 GLU CA . 34365 1 502 . 1 . 1 84 84 GLU CB C 13 34.446 0.118 . . . . . . A 84 GLU CB . 34365 1 503 . 1 . 1 84 84 GLU CG C 13 37.108 0.220 . . . . . . A 84 GLU CG . 34365 1 504 . 1 . 1 84 84 GLU N N 15 121.491 0.148 . . . . . . A 84 GLU N . 34365 1 505 . 1 . 1 85 85 LYS H H 1 9.410 0.023 . . . . . . A 85 LYS H . 34365 1 506 . 1 . 1 85 85 LYS HA H 1 3.668 0.023 . . . . . . A 85 LYS HA . 34365 1 507 . 1 . 1 85 85 LYS HB2 H 1 1.797 0.029 . . . . . . A 85 LYS HB2 . 34365 1 508 . 1 . 1 85 85 LYS HB3 H 1 2.005 0.037 . . . . . . A 85 LYS HB3 . 34365 1 509 . 1 . 1 85 85 LYS HG2 H 1 1.373 0.030 . . . . . . A 85 LYS HG2 . 34365 1 510 . 1 . 1 85 85 LYS HG3 H 1 1.373 0.030 . . . . . . A 85 LYS HG3 . 34365 1 511 . 1 . 1 85 85 LYS HD2 H 1 1.514 0.000 . . . . . . A 85 LYS HD2 . 34365 1 512 . 1 . 1 85 85 LYS HD3 H 1 1.662 0.000 . . . . . . A 85 LYS HD3 . 34365 1 513 . 1 . 1 85 85 LYS HE2 H 1 2.812 0.000 . . . . . . A 85 LYS HE2 . 34365 1 514 . 1 . 1 85 85 LYS HE3 H 1 2.812 0.000 . . . . . . A 85 LYS HE3 . 34365 1 515 . 1 . 1 85 85 LYS C C 13 179.643 0.102 . . . . . . A 85 LYS C . 34365 1 516 . 1 . 1 85 85 LYS CA C 13 58.519 0.058 . . . . . . A 85 LYS CA . 34365 1 517 . 1 . 1 85 85 LYS CB C 13 30.161 0.087 . . . . . . A 85 LYS CB . 34365 1 518 . 1 . 1 85 85 LYS CG C 13 26.109 0.113 . . . . . . A 85 LYS CG . 34365 1 519 . 1 . 1 85 85 LYS CD C 13 29.840 0.048 . . . . . . A 85 LYS CD . 34365 1 520 . 1 . 1 85 85 LYS CE C 13 42.467 0.000 . . . . . . A 85 LYS CE . 34365 1 521 . 1 . 1 85 85 LYS N N 15 119.122 0.089 . . . . . . A 85 LYS N . 34365 1 522 . 1 . 1 86 86 SER H H 1 8.633 0.038 . . . . . . A 86 SER H . 34365 1 523 . 1 . 1 86 86 SER HA H 1 4.225 0.043 . . . . . . A 86 SER HA . 34365 1 524 . 1 . 1 86 86 SER HB2 H 1 3.876 0.021 . . . . . . A 86 SER HB2 . 34365 1 525 . 1 . 1 86 86 SER HB3 H 1 4.210 0.010 . . . . . . A 86 SER HB3 . 34365 1 526 . 1 . 1 86 86 SER C C 13 176.071 0.160 . . . . . . A 86 SER C . 34365 1 527 . 1 . 1 86 86 SER CA C 13 61.447 0.072 . . . . . . A 86 SER CA . 34365 1 528 . 1 . 1 86 86 SER CB C 13 63.152 0.102 . . . . . . A 86 SER CB . 34365 1 529 . 1 . 1 86 86 SER N N 15 120.187 0.122 . . . . . . A 86 SER N . 34365 1 530 . 1 . 1 87 87 ILE H H 1 7.671 0.035 . . . . . . A 87 ILE H . 34365 1 531 . 1 . 1 87 87 ILE HA H 1 4.582 0.034 . . . . . . A 87 ILE HA . 34365 1 532 . 1 . 1 87 87 ILE HB H 1 2.181 0.025 . . . . . . A 87 ILE HB . 34365 1 533 . 1 . 1 87 87 ILE HG12 H 1 1.034 0.028 . . . . . . A 87 ILE HG12 . 34365 1 534 . 1 . 1 87 87 ILE HG13 H 1 1.601 0.009 . . . . . . A 87 ILE HG13 . 34365 1 535 . 1 . 1 87 87 ILE HG21 H 1 0.626 0.008 . . . . . . A 87 ILE HG21 . 34365 1 536 . 1 . 1 87 87 ILE HG22 H 1 0.626 0.008 . . . . . . A 87 ILE HG22 . 34365 1 537 . 1 . 1 87 87 ILE HG23 H 1 0.626 0.008 . . . . . . A 87 ILE HG23 . 34365 1 538 . 1 . 1 87 87 ILE HD11 H 1 0.058 0.041 . . . . . . A 87 ILE HD11 . 34365 1 539 . 1 . 1 87 87 ILE HD12 H 1 0.058 0.041 . . . . . . A 87 ILE HD12 . 34365 1 540 . 1 . 1 87 87 ILE HD13 H 1 0.058 0.041 . . . . . . A 87 ILE HD13 . 34365 1 541 . 1 . 1 87 87 ILE C C 13 176.442 0.083 . . . . . . A 87 ILE C . 34365 1 542 . 1 . 1 87 87 ILE CA C 13 60.582 0.103 . . . . . . A 87 ILE CA . 34365 1 543 . 1 . 1 87 87 ILE CB C 13 37.120 0.132 . . . . . . A 87 ILE CB . 34365 1 544 . 1 . 1 87 87 ILE CG1 C 13 27.792 0.139 . . . . . . A 87 ILE CG1 . 34365 1 545 . 1 . 1 87 87 ILE CG2 C 13 18.176 0.051 . . . . . . A 87 ILE CG2 . 34365 1 546 . 1 . 1 87 87 ILE CD1 C 13 14.473 0.108 . . . . . . A 87 ILE CD1 . 34365 1 547 . 1 . 1 87 87 ILE N N 15 111.054 0.169 . . . . . . A 87 ILE N . 34365 1 548 . 1 . 1 88 88 SER H H 1 7.635 0.019 . . . . . . A 88 SER H . 34365 1 549 . 1 . 1 88 88 SER HA H 1 3.681 0.013 . . . . . . A 88 SER HA . 34365 1 550 . 1 . 1 88 88 SER HB2 H 1 3.713 0.014 . . . . . . A 88 SER HB2 . 34365 1 551 . 1 . 1 88 88 SER HB3 H 1 3.853 0.030 . . . . . . A 88 SER HB3 . 34365 1 552 . 1 . 1 88 88 SER C C 13 177.371 0.149 . . . . . . A 88 SER C . 34365 1 553 . 1 . 1 88 88 SER CA C 13 61.258 0.313 . . . . . . A 88 SER CA . 34365 1 554 . 1 . 1 88 88 SER CB C 13 62.620 0.375 . . . . . . A 88 SER CB . 34365 1 555 . 1 . 1 88 88 SER N N 15 119.498 0.208 . . . . . . A 88 SER N . 34365 1 556 . 1 . 1 89 89 SER H H 1 8.349 0.027 . . . . . . A 89 SER H . 34365 1 557 . 1 . 1 89 89 SER HA H 1 3.975 0.032 . . . . . . A 89 SER HA . 34365 1 558 . 1 . 1 89 89 SER HB2 H 1 3.692 0.009 . . . . . . A 89 SER HB2 . 34365 1 559 . 1 . 1 89 89 SER HB3 H 1 3.806 0.020 . . . . . . A 89 SER HB3 . 34365 1 560 . 1 . 1 89 89 SER C C 13 175.379 0.113 . . . . . . A 89 SER C . 34365 1 561 . 1 . 1 89 89 SER CA C 13 60.178 0.106 . . . . . . A 89 SER CA . 34365 1 562 . 1 . 1 89 89 SER CB C 13 62.575 0.058 . . . . . . A 89 SER CB . 34365 1 563 . 1 . 1 89 89 SER N N 15 115.585 0.130 . . . . . . A 89 SER N . 34365 1 564 . 1 . 1 90 90 LEU H H 1 7.455 0.024 . . . . . . A 90 LEU H . 34365 1 565 . 1 . 1 90 90 LEU HA H 1 3.924 0.017 . . . . . . A 90 LEU HA . 34365 1 566 . 1 . 1 90 90 LEU HG H 1 1.803 0.000 . . . . . . A 90 LEU HG . 34365 1 567 . 1 . 1 90 90 LEU C C 13 177.481 0.105 . . . . . . A 90 LEU C . 34365 1 568 . 1 . 1 90 90 LEU CA C 13 55.852 0.069 . . . . . . A 90 LEU CA . 34365 1 569 . 1 . 1 90 90 LEU CB C 13 41.736 0.053 . . . . . . A 90 LEU CB . 34365 1 570 . 1 . 1 90 90 LEU CG C 13 26.996 0.006 . . . . . . A 90 LEU CG . 34365 1 571 . 1 . 1 90 90 LEU N N 15 119.532 0.244 . . . . . . A 90 LEU N . 34365 1 572 . 1 . 1 91 91 GLY H H 1 7.089 0.022 . . . . . . A 91 GLY H . 34365 1 573 . 1 . 1 91 91 GLY HA2 H 1 3.530 0.012 . . . . . . A 91 GLY HA2 . 34365 1 574 . 1 . 1 91 91 GLY HA3 H 1 3.720 0.017 . . . . . . A 91 GLY HA3 . 34365 1 575 . 1 . 1 91 91 GLY C C 13 173.815 0.076 . . . . . . A 91 GLY C . 34365 1 576 . 1 . 1 91 91 GLY CA C 13 46.315 0.056 . . . . . . A 91 GLY CA . 34365 1 577 . 1 . 1 91 91 GLY N N 15 103.266 0.099 . . . . . . A 91 GLY N . 34365 1 578 . 1 . 1 92 92 ARG H H 1 8.225 0.028 . . . . . . A 92 ARG H . 34365 1 579 . 1 . 1 92 92 ARG HA H 1 4.263 0.018 . . . . . . A 92 ARG HA . 34365 1 580 . 1 . 1 92 92 ARG HB2 H 1 1.649 0.015 . . . . . . A 92 ARG HB2 . 34365 1 581 . 1 . 1 92 92 ARG HB3 H 1 1.889 0.018 . . . . . . A 92 ARG HB3 . 34365 1 582 . 1 . 1 92 92 ARG C C 13 175.961 0.151 . . . . . . A 92 ARG C . 34365 1 583 . 1 . 1 92 92 ARG CA C 13 56.013 0.102 . . . . . . A 92 ARG CA . 34365 1 584 . 1 . 1 92 92 ARG CB C 13 28.735 0.126 . . . . . . A 92 ARG CB . 34365 1 585 . 1 . 1 92 92 ARG CG C 13 26.223 0.054 . . . . . . A 92 ARG CG . 34365 1 586 . 1 . 1 92 92 ARG N N 15 126.963 0.110 . . . . . . A 92 ARG N . 34365 1 587 . 1 . 1 93 93 VAL H H 1 9.151 0.026 . . . . . . A 93 VAL H . 34365 1 588 . 1 . 1 93 93 VAL HA H 1 3.317 0.030 . . . . . . A 93 VAL HA . 34365 1 589 . 1 . 1 93 93 VAL HB H 1 1.666 0.031 . . . . . . A 93 VAL HB . 34365 1 590 . 1 . 1 93 93 VAL HG11 H 1 0.650 0.013 . . . . . . A 93 VAL HG11 . 34365 1 591 . 1 . 1 93 93 VAL HG12 H 1 0.650 0.013 . . . . . . A 93 VAL HG12 . 34365 1 592 . 1 . 1 93 93 VAL HG13 H 1 0.650 0.013 . . . . . . A 93 VAL HG13 . 34365 1 593 . 1 . 1 93 93 VAL HG21 H 1 0.622 0.008 . . . . . . A 93 VAL HG21 . 34365 1 594 . 1 . 1 93 93 VAL HG22 H 1 0.622 0.008 . . . . . . A 93 VAL HG22 . 34365 1 595 . 1 . 1 93 93 VAL HG23 H 1 0.622 0.008 . . . . . . A 93 VAL HG23 . 34365 1 596 . 1 . 1 93 93 VAL C C 13 174.721 0.020 . . . . . . A 93 VAL C . 34365 1 597 . 1 . 1 93 93 VAL CA C 13 66.712 0.066 . . . . . . A 93 VAL CA . 34365 1 598 . 1 . 1 93 93 VAL CB C 13 32.822 0.107 . . . . . . A 93 VAL CB . 34365 1 599 . 1 . 1 93 93 VAL CG1 C 13 21.065 0.122 . . . . . . A 93 VAL CG1 . 34365 1 600 . 1 . 1 93 93 VAL CG2 C 13 22.315 0.024 . . . . . . A 93 VAL CG2 . 34365 1 601 . 1 . 1 93 93 VAL N N 15 133.102 0.195 . . . . . . A 93 VAL N . 34365 1 602 . 1 . 1 94 94 SER H H 1 7.239 0.027 . . . . . . A 94 SER H . 34365 1 603 . 1 . 1 94 94 SER HA H 1 4.087 0.019 . . . . . . A 94 SER HA . 34365 1 604 . 1 . 1 94 94 SER HB2 H 1 2.450 0.019 . . . . . . A 94 SER HB2 . 34365 1 605 . 1 . 1 94 94 SER HB3 H 1 3.429 0.023 . . . . . . A 94 SER HB3 . 34365 1 606 . 1 . 1 94 94 SER C C 13 172.655 0.107 . . . . . . A 94 SER C . 34365 1 607 . 1 . 1 94 94 SER CA C 13 57.588 0.062 . . . . . . A 94 SER CA . 34365 1 608 . 1 . 1 94 94 SER CB C 13 63.523 0.070 . . . . . . A 94 SER CB . 34365 1 609 . 1 . 1 94 94 SER N N 15 106.105 0.086 . . . . . . A 94 SER N . 34365 1 610 . 1 . 1 95 95 GLU H H 1 8.625 0.024 . . . . . . A 95 GLU H . 34365 1 611 . 1 . 1 95 95 GLU HA H 1 5.332 0.030 . . . . . . A 95 GLU HA . 34365 1 612 . 1 . 1 95 95 GLU HB2 H 1 1.700 0.019 . . . . . . A 95 GLU HB2 . 34365 1 613 . 1 . 1 95 95 GLU HB3 H 1 2.104 0.008 . . . . . . A 95 GLU HB3 . 34365 1 614 . 1 . 1 95 95 GLU C C 13 173.790 0.097 . . . . . . A 95 GLU C . 34365 1 615 . 1 . 1 95 95 GLU CA C 13 55.009 0.116 . . . . . . A 95 GLU CA . 34365 1 616 . 1 . 1 95 95 GLU CB C 13 34.413 0.192 . . . . . . A 95 GLU CB . 34365 1 617 . 1 . 1 95 95 GLU CG C 13 37.154 0.000 . . . . . . A 95 GLU CG . 34365 1 618 . 1 . 1 95 95 GLU N N 15 115.021 0.107 . . . . . . A 95 GLU N . 34365 1 619 . 1 . 1 96 96 VAL H H 1 8.936 0.027 . . . . . . A 96 VAL H . 34365 1 620 . 1 . 1 96 96 VAL HA H 1 4.780 0.017 . . . . . . A 96 VAL HA . 34365 1 621 . 1 . 1 96 96 VAL HB H 1 2.413 0.027 . . . . . . A 96 VAL HB . 34365 1 622 . 1 . 1 96 96 VAL HG11 H 1 1.093 0.026 . . . . . . A 96 VAL HG11 . 34365 1 623 . 1 . 1 96 96 VAL HG12 H 1 1.093 0.026 . . . . . . A 96 VAL HG12 . 34365 1 624 . 1 . 1 96 96 VAL HG13 H 1 1.093 0.026 . . . . . . A 96 VAL HG13 . 34365 1 625 . 1 . 1 96 96 VAL HG21 H 1 1.288 0.024 . . . . . . A 96 VAL HG21 . 34365 1 626 . 1 . 1 96 96 VAL HG22 H 1 1.288 0.024 . . . . . . A 96 VAL HG22 . 34365 1 627 . 1 . 1 96 96 VAL HG23 H 1 1.288 0.024 . . . . . . A 96 VAL HG23 . 34365 1 628 . 1 . 1 96 96 VAL C C 13 171.989 0.076 . . . . . . A 96 VAL C . 34365 1 629 . 1 . 1 96 96 VAL CA C 13 61.257 0.073 . . . . . . A 96 VAL CA . 34365 1 630 . 1 . 1 96 96 VAL CB C 13 35.803 0.100 . . . . . . A 96 VAL CB . 34365 1 631 . 1 . 1 96 96 VAL CG1 C 13 20.374 0.077 . . . . . . A 96 VAL CG1 . 34365 1 632 . 1 . 1 96 96 VAL CG2 C 13 24.382 0.188 . . . . . . A 96 VAL CG2 . 34365 1 633 . 1 . 1 96 96 VAL N N 15 118.253 0.117 . . . . . . A 96 VAL N . 34365 1 634 . 1 . 1 97 97 ASP H H 1 8.680 0.041 . . . . . . A 97 ASP H . 34365 1 635 . 1 . 1 97 97 ASP HA H 1 6.088 0.029 . . . . . . A 97 ASP HA . 34365 1 636 . 1 . 1 97 97 ASP HB2 H 1 2.689 0.012 . . . . . . A 97 ASP HB2 . 34365 1 637 . 1 . 1 97 97 ASP HB3 H 1 2.322 0.022 . . . . . . A 97 ASP HB3 . 34365 1 638 . 1 . 1 97 97 ASP C C 13 176.588 0.061 . . . . . . A 97 ASP C . 34365 1 639 . 1 . 1 97 97 ASP CA C 13 53.302 0.072 . . . . . . A 97 ASP CA . 34365 1 640 . 1 . 1 97 97 ASP CB C 13 42.095 0.072 . . . . . . A 97 ASP CB . 34365 1 641 . 1 . 1 97 97 ASP N N 15 127.293 0.123 . . . . . . A 97 ASP N . 34365 1 642 . 1 . 1 98 98 TYR H H 1 9.493 0.025 . . . . . . A 98 TYR H . 34365 1 643 . 1 . 1 98 98 TYR HA H 1 5.297 0.056 . . . . . . A 98 TYR HA . 34365 1 644 . 1 . 1 98 98 TYR HB2 H 1 2.604 0.011 . . . . . . A 98 TYR HB2 . 34365 1 645 . 1 . 1 98 98 TYR HB3 H 1 2.375 0.004 . . . . . . A 98 TYR HB3 . 34365 1 646 . 1 . 1 98 98 TYR C C 13 173.760 0.086 . . . . . . A 98 TYR C . 34365 1 647 . 1 . 1 98 98 TYR CA C 13 55.548 0.105 . . . . . . A 98 TYR CA . 34365 1 648 . 1 . 1 98 98 TYR CB C 13 42.305 0.063 . . . . . . A 98 TYR CB . 34365 1 649 . 1 . 1 98 98 TYR N N 15 119.516 0.137 . . . . . . A 98 TYR N . 34365 1 650 . 1 . 1 99 99 GLY H H 1 8.495 0.028 . . . . . . A 99 GLY H . 34365 1 651 . 1 . 1 99 99 GLY HA2 H 1 2.480 0.019 . . . . . . A 99 GLY HA2 . 34365 1 652 . 1 . 1 99 99 GLY HA3 H 1 2.132 0.025 . . . . . . A 99 GLY HA3 . 34365 1 653 . 1 . 1 99 99 GLY C C 13 176.992 0.154 . . . . . . A 99 GLY C . 34365 1 654 . 1 . 1 99 99 GLY CA C 13 44.416 0.083 . . . . . . A 99 GLY CA . 34365 1 655 . 1 . 1 99 99 GLY N N 15 106.540 0.145 . . . . . . A 99 GLY N . 34365 1 656 . 1 . 1 100 100 PRO HA H 1 4.511 0.019 . . . . . . A 100 PRO HA . 34365 1 657 . 1 . 1 100 100 PRO HB2 H 1 1.521 0.025 . . . . . . A 100 PRO HB2 . 34365 1 658 . 1 . 1 100 100 PRO HB3 H 1 1.719 0.000 . . . . . . A 100 PRO HB3 . 34365 1 659 . 1 . 1 100 100 PRO HG2 H 1 1.714 0.008 . . . . . . A 100 PRO HG2 . 34365 1 660 . 1 . 1 100 100 PRO HG3 H 1 1.714 0.008 . . . . . . A 100 PRO HG3 . 34365 1 661 . 1 . 1 100 100 PRO HD2 H 1 3.597 0.000 . . . . . . A 100 PRO HD2 . 34365 1 662 . 1 . 1 100 100 PRO HD3 H 1 4.049 0.000 . . . . . . A 100 PRO HD3 . 34365 1 663 . 1 . 1 100 100 PRO C C 13 175.132 0.029 . . . . . . A 100 PRO C . 34365 1 664 . 1 . 1 100 100 PRO CA C 13 60.617 0.085 . . . . . . A 100 PRO CA . 34365 1 665 . 1 . 1 100 100 PRO CB C 13 32.328 0.079 . . . . . . A 100 PRO CB . 34365 1 666 . 1 . 1 100 100 PRO CG C 13 26.482 0.038 . . . . . . A 100 PRO CG . 34365 1 667 . 1 . 1 100 100 PRO CD C 13 49.577 0.071 . . . . . . A 100 PRO CD . 34365 1 668 . 1 . 1 101 101 ALA H H 1 8.267 0.019 . . . . . . A 101 ALA H . 34365 1 669 . 1 . 1 101 101 ALA HA H 1 5.187 0.038 . . . . . . A 101 ALA HA . 34365 1 670 . 1 . 1 101 101 ALA HB1 H 1 1.155 0.014 . . . . . . A 101 ALA HB1 . 34365 1 671 . 1 . 1 101 101 ALA HB2 H 1 1.155 0.014 . . . . . . A 101 ALA HB2 . 34365 1 672 . 1 . 1 101 101 ALA HB3 H 1 1.155 0.014 . . . . . . A 101 ALA HB3 . 34365 1 673 . 1 . 1 101 101 ALA C C 13 176.929 0.124 . . . . . . A 101 ALA C . 34365 1 674 . 1 . 1 101 101 ALA CA C 13 50.444 0.053 . . . . . . A 101 ALA CA . 34365 1 675 . 1 . 1 101 101 ALA CB C 13 20.386 0.075 . . . . . . A 101 ALA CB . 34365 1 676 . 1 . 1 101 101 ALA N N 15 125.877 0.193 . . . . . . A 101 ALA N . 34365 1 677 . 1 . 1 102 102 ILE H H 1 8.502 0.037 . . . . . . A 102 ILE H . 34365 1 678 . 1 . 1 102 102 ILE HA H 1 4.642 0.035 . . . . . . A 102 ILE HA . 34365 1 679 . 1 . 1 102 102 ILE HB H 1 1.121 0.031 . . . . . . A 102 ILE HB . 34365 1 680 . 1 . 1 102 102 ILE HG12 H 1 0.098 0.023 . . . . . . A 102 ILE HG12 . 34365 1 681 . 1 . 1 102 102 ILE HG13 H 1 1.106 0.042 . . . . . . A 102 ILE HG13 . 34365 1 682 . 1 . 1 102 102 ILE HG21 H 1 0.158 0.088 . . . . . . A 102 ILE HG21 . 34365 1 683 . 1 . 1 102 102 ILE HG22 H 1 0.158 0.088 . . . . . . A 102 ILE HG22 . 34365 1 684 . 1 . 1 102 102 ILE HG23 H 1 0.158 0.088 . . . . . . A 102 ILE HG23 . 34365 1 685 . 1 . 1 102 102 ILE HD11 H 1 0.070 0.048 . . . . . . A 102 ILE HD11 . 34365 1 686 . 1 . 1 102 102 ILE HD12 H 1 0.070 0.048 . . . . . . A 102 ILE HD12 . 34365 1 687 . 1 . 1 102 102 ILE HD13 H 1 0.070 0.048 . . . . . . A 102 ILE HD13 . 34365 1 688 . 1 . 1 102 102 ILE C C 13 175.290 0.053 . . . . . . A 102 ILE C . 34365 1 689 . 1 . 1 102 102 ILE CA C 13 60.543 0.112 . . . . . . A 102 ILE CA . 34365 1 690 . 1 . 1 102 102 ILE CB C 13 43.083 0.104 . . . . . . A 102 ILE CB . 34365 1 691 . 1 . 1 102 102 ILE CG1 C 13 27.057 0.124 . . . . . . A 102 ILE CG1 . 34365 1 692 . 1 . 1 102 102 ILE CG2 C 13 17.365 0.135 . . . . . . A 102 ILE CG2 . 34365 1 693 . 1 . 1 102 102 ILE CD1 C 13 13.812 0.146 . . . . . . A 102 ILE CD1 . 34365 1 694 . 1 . 1 102 102 ILE N N 15 118.910 0.151 . . . . . . A 102 ILE N . 34365 1 695 . 1 . 1 103 103 LEU H H 1 8.920 0.025 . . . . . . A 103 LEU H . 34365 1 696 . 1 . 1 103 103 LEU HA H 1 5.395 0.086 . . . . . . A 103 LEU HA . 34365 1 697 . 1 . 1 103 103 LEU HB2 H 1 1.264 0.000 . . . . . . A 103 LEU HB2 . 34365 1 698 . 1 . 1 103 103 LEU HB3 H 1 2.006 0.000 . . . . . . A 103 LEU HB3 . 34365 1 699 . 1 . 1 103 103 LEU C C 13 173.709 0.174 . . . . . . A 103 LEU C . 34365 1 700 . 1 . 1 103 103 LEU CA C 13 53.386 0.114 . . . . . . A 103 LEU CA . 34365 1 701 . 1 . 1 103 103 LEU CB C 13 45.430 0.109 . . . . . . A 103 LEU CB . 34365 1 702 . 1 . 1 103 103 LEU N N 15 135.240 0.107 . . . . . . A 103 LEU N . 34365 1 703 . 1 . 1 104 104 SER H H 1 9.549 0.020 . . . . . . A 104 SER H . 34365 1 704 . 1 . 1 104 104 SER HA H 1 4.959 0.020 . . . . . . A 104 SER HA . 34365 1 705 . 1 . 1 104 104 SER HB2 H 1 3.221 0.000 . . . . . . A 104 SER HB2 . 34365 1 706 . 1 . 1 104 104 SER HB3 H 1 2.995 0.022 . . . . . . A 104 SER HB3 . 34365 1 707 . 1 . 1 104 104 SER C C 13 171.837 0.096 . . . . . . A 104 SER C . 34365 1 708 . 1 . 1 104 104 SER CA C 13 56.520 0.098 . . . . . . A 104 SER CA . 34365 1 709 . 1 . 1 104 104 SER CB C 13 67.468 0.111 . . . . . . A 104 SER CB . 34365 1 710 . 1 . 1 104 104 SER N N 15 118.423 0.100 . . . . . . A 104 SER N . 34365 1 711 . 1 . 1 105 105 LEU H H 1 8.481 0.024 . . . . . . A 105 LEU H . 34365 1 712 . 1 . 1 105 105 LEU HA H 1 4.967 0.008 . . . . . . A 105 LEU HA . 34365 1 713 . 1 . 1 105 105 LEU HB2 H 1 1.292 0.076 . . . . . . A 105 LEU HB2 . 34365 1 714 . 1 . 1 105 105 LEU HB3 H 1 1.259 0.017 . . . . . . A 105 LEU HB3 . 34365 1 715 . 1 . 1 105 105 LEU HG H 1 1.393 0.033 . . . . . . A 105 LEU HG . 34365 1 716 . 1 . 1 105 105 LEU C C 13 175.012 0.046 . . . . . . A 105 LEU C . 34365 1 717 . 1 . 1 105 105 LEU CA C 13 53.100 0.054 . . . . . . A 105 LEU CA . 34365 1 718 . 1 . 1 105 105 LEU CB C 13 45.299 0.104 . . . . . . A 105 LEU CB . 34365 1 719 . 1 . 1 105 105 LEU CG C 13 27.339 0.163 . . . . . . A 105 LEU CG . 34365 1 720 . 1 . 1 105 105 LEU N N 15 120.268 0.136 . . . . . . A 105 LEU N . 34365 1 721 . 1 . 1 106 106 GLN H H 1 8.999 0.031 . . . . . . A 106 GLN H . 34365 1 722 . 1 . 1 106 106 GLN HA H 1 5.294 0.011 . . . . . . A 106 GLN HA . 34365 1 723 . 1 . 1 106 106 GLN HB2 H 1 1.099 0.043 . . . . . . A 106 GLN HB2 . 34365 1 724 . 1 . 1 106 106 GLN HB3 H 1 1.622 0.007 . . . . . . A 106 GLN HB3 . 34365 1 725 . 1 . 1 106 106 GLN HE21 H 1 6.726 0.038 . . . . . . A 106 GLN HE21 . 34365 1 726 . 1 . 1 106 106 GLN HE22 H 1 7.640 0.027 . . . . . . A 106 GLN HE22 . 34365 1 727 . 1 . 1 106 106 GLN C C 13 174.788 0.071 . . . . . . A 106 GLN C . 34365 1 728 . 1 . 1 106 106 GLN CA C 13 52.494 0.076 . . . . . . A 106 GLN CA . 34365 1 729 . 1 . 1 106 106 GLN CB C 13 33.325 0.146 . . . . . . A 106 GLN CB . 34365 1 730 . 1 . 1 106 106 GLN CG C 13 32.878 0.019 . . . . . . A 106 GLN CG . 34365 1 731 . 1 . 1 106 106 GLN CD C 13 179.863 0.004 . . . . . . A 106 GLN CD . 34365 1 732 . 1 . 1 106 106 GLN N N 15 117.198 0.120 . . . . . . A 106 GLN N . 34365 1 733 . 1 . 1 106 106 GLN NE2 N 15 117.241 0.039 . . . . . . A 106 GLN NE2 . 34365 1 734 . 1 . 1 107 107 TYR H H 1 8.854 0.026 . . . . . . A 107 TYR H . 34365 1 735 . 1 . 1 107 107 TYR HA H 1 4.866 0.058 . . . . . . A 107 TYR HA . 34365 1 736 . 1 . 1 107 107 TYR HB2 H 1 2.596 0.004 . . . . . . A 107 TYR HB2 . 34365 1 737 . 1 . 1 107 107 TYR HB3 H 1 2.245 0.018 . . . . . . A 107 TYR HB3 . 34365 1 738 . 1 . 1 107 107 TYR C C 13 173.668 0.007 . . . . . . A 107 TYR C . 34365 1 739 . 1 . 1 107 107 TYR CA C 13 56.943 0.074 . . . . . . A 107 TYR CA . 34365 1 740 . 1 . 1 107 107 TYR CB C 13 41.314 0.166 . . . . . . A 107 TYR CB . 34365 1 741 . 1 . 1 107 107 TYR N N 15 121.505 0.103 . . . . . . A 107 TYR N . 34365 1 742 . 1 . 1 108 108 HIS H H 1 8.629 0.017 . . . . . . A 108 HIS H . 34365 1 743 . 1 . 1 108 108 HIS HA H 1 4.575 0.017 . . . . . . A 108 HIS HA . 34365 1 744 . 1 . 1 108 108 HIS HB2 H 1 2.895 0.039 . . . . . . A 108 HIS HB2 . 34365 1 745 . 1 . 1 108 108 HIS HB3 H 1 2.542 0.015 . . . . . . A 108 HIS HB3 . 34365 1 746 . 1 . 1 108 108 HIS HD1 H 1 9.707 0.017 . . . . . . A 108 HIS HD1 . 34365 1 747 . 1 . 1 108 108 HIS C C 13 174.350 0.032 . . . . . . A 108 HIS C . 34365 1 748 . 1 . 1 108 108 HIS CA C 13 54.675 0.125 . . . . . . A 108 HIS CA . 34365 1 749 . 1 . 1 108 108 HIS CB C 13 32.831 0.091 . . . . . . A 108 HIS CB . 34365 1 750 . 1 . 1 108 108 HIS N N 15 128.001 0.239 . . . . . . A 108 HIS N . 34365 1 751 . 1 . 1 108 108 HIS ND1 N 15 162.828 0.148 . . . . . . A 108 HIS ND1 . 34365 1 752 . 1 . 1 109 109 TYR H H 1 6.548 0.013 . . . . . . A 109 TYR H . 34365 1 753 . 1 . 1 109 109 TYR HA H 1 5.130 0.022 . . . . . . A 109 TYR HA . 34365 1 754 . 1 . 1 109 109 TYR CA C 13 56.657 0.007 . . . . . . A 109 TYR CA . 34365 1 755 . 1 . 1 109 109 TYR CB C 13 40.839 0.000 . . . . . . A 109 TYR CB . 34365 1 756 . 1 . 1 109 109 TYR N N 15 124.002 0.073 . . . . . . A 109 TYR N . 34365 1 757 . 1 . 1 115 115 LEU H H 1 8.515 0.000 . . . . . . A 115 LEU H . 34365 1 758 . 1 . 1 115 115 LEU HA H 1 4.796 0.036 . . . . . . A 115 LEU HA . 34365 1 759 . 1 . 1 115 115 LEU C C 13 175.127 0.097 . . . . . . A 115 LEU C . 34365 1 760 . 1 . 1 115 115 LEU CA C 13 53.430 0.181 . . . . . . A 115 LEU CA . 34365 1 761 . 1 . 1 115 115 LEU N N 15 125.875 0.020 . . . . . . A 115 LEU N . 34365 1 762 . 1 . 1 116 116 TYR H H 1 9.088 0.027 . . . . . . A 116 TYR H . 34365 1 763 . 1 . 1 116 116 TYR HA H 1 5.047 0.001 . . . . . . A 116 TYR HA . 34365 1 764 . 1 . 1 116 116 TYR C C 13 174.558 0.106 . . . . . . A 116 TYR C . 34365 1 765 . 1 . 1 116 116 TYR CA C 13 54.556 0.007 . . . . . . A 116 TYR CA . 34365 1 766 . 1 . 1 116 116 TYR N N 15 122.356 0.158 . . . . . . A 116 TYR N . 34365 1 767 . 1 . 1 117 117 PRO HA H 1 5.328 0.020 . . . . . . A 117 PRO HA . 34365 1 768 . 1 . 1 117 117 PRO HB2 H 1 1.804 0.014 . . . . . . A 117 PRO HB2 . 34365 1 769 . 1 . 1 117 117 PRO HB3 H 1 2.185 0.017 . . . . . . A 117 PRO HB3 . 34365 1 770 . 1 . 1 117 117 PRO HG2 H 1 1.769 0.000 . . . . . . A 117 PRO HG2 . 34365 1 771 . 1 . 1 117 117 PRO HG3 H 1 1.906 0.107 . . . . . . A 117 PRO HG3 . 34365 1 772 . 1 . 1 117 117 PRO HD2 H 1 3.516 0.011 . . . . . . A 117 PRO HD2 . 34365 1 773 . 1 . 1 117 117 PRO HD3 H 1 3.983 0.020 . . . . . . A 117 PRO HD3 . 34365 1 774 . 1 . 1 117 117 PRO C C 13 174.583 0.133 . . . . . . A 117 PRO C . 34365 1 775 . 1 . 1 117 117 PRO CA C 13 62.209 0.070 . . . . . . A 117 PRO CA . 34365 1 776 . 1 . 1 117 117 PRO CB C 13 32.633 0.107 . . . . . . A 117 PRO CB . 34365 1 777 . 1 . 1 117 117 PRO CG C 13 27.574 0.080 . . . . . . A 117 PRO CG . 34365 1 778 . 1 . 1 117 117 PRO CD C 13 51.275 0.140 . . . . . . A 117 PRO CD . 34365 1 779 . 1 . 1 118 118 TYR H H 1 8.949 0.028 . . . . . . A 118 TYR H . 34365 1 780 . 1 . 1 118 118 TYR HA H 1 5.497 0.016 . . . . . . A 118 TYR HA . 34365 1 781 . 1 . 1 118 118 TYR HB2 H 1 2.720 0.018 . . . . . . A 118 TYR HB2 . 34365 1 782 . 1 . 1 118 118 TYR HB3 H 1 2.467 0.000 . . . . . . A 118 TYR HB3 . 34365 1 783 . 1 . 1 118 118 TYR C C 13 172.558 0.103 . . . . . . A 118 TYR C . 34365 1 784 . 1 . 1 118 118 TYR CA C 13 55.998 0.104 . . . . . . A 118 TYR CA . 34365 1 785 . 1 . 1 118 118 TYR CB C 13 42.204 0.147 . . . . . . A 118 TYR CB . 34365 1 786 . 1 . 1 118 118 TYR N N 15 118.244 0.151 . . . . . . A 118 TYR N . 34365 1 787 . 1 . 1 119 119 VAL H H 1 8.325 0.029 . . . . . . A 119 VAL H . 34365 1 788 . 1 . 1 119 119 VAL HA H 1 4.960 0.018 . . . . . . A 119 VAL HA . 34365 1 789 . 1 . 1 119 119 VAL HB H 1 2.121 0.038 . . . . . . A 119 VAL HB . 34365 1 790 . 1 . 1 119 119 VAL HG11 H 1 0.869 0.053 . . . . . . A 119 VAL HG11 . 34365 1 791 . 1 . 1 119 119 VAL HG12 H 1 0.869 0.053 . . . . . . A 119 VAL HG12 . 34365 1 792 . 1 . 1 119 119 VAL HG13 H 1 0.869 0.053 . . . . . . A 119 VAL HG13 . 34365 1 793 . 1 . 1 119 119 VAL HG21 H 1 0.976 0.003 . . . . . . A 119 VAL HG21 . 34365 1 794 . 1 . 1 119 119 VAL HG22 H 1 0.976 0.003 . . . . . . A 119 VAL HG22 . 34365 1 795 . 1 . 1 119 119 VAL HG23 H 1 0.976 0.003 . . . . . . A 119 VAL HG23 . 34365 1 796 . 1 . 1 119 119 VAL C C 13 174.465 0.069 . . . . . . A 119 VAL C . 34365 1 797 . 1 . 1 119 119 VAL CA C 13 58.166 0.069 . . . . . . A 119 VAL CA . 34365 1 798 . 1 . 1 119 119 VAL CB C 13 36.510 0.082 . . . . . . A 119 VAL CB . 34365 1 799 . 1 . 1 119 119 VAL CG1 C 13 19.695 0.058 . . . . . . A 119 VAL CG1 . 34365 1 800 . 1 . 1 119 119 VAL CG2 C 13 22.241 0.074 . . . . . . A 119 VAL CG2 . 34365 1 801 . 1 . 1 119 119 VAL N N 15 111.891 0.232 . . . . . . A 119 VAL N . 34365 1 802 . 1 . 1 120 120 GLY H H 1 8.695 0.022 . . . . . . A 120 GLY H . 34365 1 803 . 1 . 1 120 120 GLY HA2 H 1 4.055 0.029 . . . . . . A 120 GLY HA2 . 34365 1 804 . 1 . 1 120 120 GLY HA3 H 1 4.956 0.040 . . . . . . A 120 GLY HA3 . 34365 1 805 . 1 . 1 120 120 GLY C C 13 171.808 0.130 . . . . . . A 120 GLY C . 34365 1 806 . 1 . 1 120 120 GLY CA C 13 46.719 0.067 . . . . . . A 120 GLY CA . 34365 1 807 . 1 . 1 120 120 GLY N N 15 108.034 0.157 . . . . . . A 120 GLY N . 34365 1 808 . 1 . 1 121 121 VAL H H 1 8.323 0.024 . . . . . . A 121 VAL H . 34365 1 809 . 1 . 1 121 121 VAL HA H 1 4.835 0.011 . . . . . . A 121 VAL HA . 34365 1 810 . 1 . 1 121 121 VAL HB H 1 1.793 0.005 . . . . . . A 121 VAL HB . 34365 1 811 . 1 . 1 121 121 VAL HG11 H 1 0.639 0.000 . . . . . . A 121 VAL HG11 . 34365 1 812 . 1 . 1 121 121 VAL HG12 H 1 0.639 0.000 . . . . . . A 121 VAL HG12 . 34365 1 813 . 1 . 1 121 121 VAL HG13 H 1 0.639 0.000 . . . . . . A 121 VAL HG13 . 34365 1 814 . 1 . 1 121 121 VAL HG21 H 1 0.711 0.029 . . . . . . A 121 VAL HG21 . 34365 1 815 . 1 . 1 121 121 VAL HG22 H 1 0.711 0.029 . . . . . . A 121 VAL HG22 . 34365 1 816 . 1 . 1 121 121 VAL HG23 H 1 0.711 0.029 . . . . . . A 121 VAL HG23 . 34365 1 817 . 1 . 1 121 121 VAL C C 13 173.219 0.048 . . . . . . A 121 VAL C . 34365 1 818 . 1 . 1 121 121 VAL CA C 13 59.408 0.093 . . . . . . A 121 VAL CA . 34365 1 819 . 1 . 1 121 121 VAL CB C 13 35.372 0.072 . . . . . . A 121 VAL CB . 34365 1 820 . 1 . 1 121 121 VAL CG1 C 13 20.284 0.058 . . . . . . A 121 VAL CG1 . 34365 1 821 . 1 . 1 121 121 VAL CG2 C 13 21.546 0.101 . . . . . . A 121 VAL CG2 . 34365 1 822 . 1 . 1 121 121 VAL N N 15 115.610 0.130 . . . . . . A 121 VAL N . 34365 1 823 . 1 . 1 122 122 GLY H H 1 8.487 0.014 . . . . . . A 122 GLY H . 34365 1 824 . 1 . 1 122 122 GLY HA2 H 1 3.776 0.010 . . . . . . A 122 GLY HA2 . 34365 1 825 . 1 . 1 122 122 GLY HA3 H 1 4.045 0.024 . . . . . . A 122 GLY HA3 . 34365 1 826 . 1 . 1 122 122 GLY C C 13 170.010 0.042 . . . . . . A 122 GLY C . 34365 1 827 . 1 . 1 122 122 GLY CA C 13 46.037 0.080 . . . . . . A 122 GLY CA . 34365 1 828 . 1 . 1 122 122 GLY N N 15 112.138 0.096 . . . . . . A 122 GLY N . 34365 1 829 . 1 . 1 123 123 VAL H H 1 8.564 0.020 . . . . . . A 123 VAL H . 34365 1 830 . 1 . 1 123 123 VAL HA H 1 4.666 0.038 . . . . . . A 123 VAL HA . 34365 1 831 . 1 . 1 123 123 VAL HB H 1 1.617 0.038 . . . . . . A 123 VAL HB . 34365 1 832 . 1 . 1 123 123 VAL HG11 H 1 0.672 0.030 . . . . . . A 123 VAL HG11 . 34365 1 833 . 1 . 1 123 123 VAL HG12 H 1 0.672 0.030 . . . . . . A 123 VAL HG12 . 34365 1 834 . 1 . 1 123 123 VAL HG13 H 1 0.672 0.030 . . . . . . A 123 VAL HG13 . 34365 1 835 . 1 . 1 123 123 VAL HG21 H 1 0.711 0.012 . . . . . . A 123 VAL HG21 . 34365 1 836 . 1 . 1 123 123 VAL HG22 H 1 0.711 0.012 . . . . . . A 123 VAL HG22 . 34365 1 837 . 1 . 1 123 123 VAL HG23 H 1 0.711 0.012 . . . . . . A 123 VAL HG23 . 34365 1 838 . 1 . 1 123 123 VAL C C 13 172.721 0.115 . . . . . . A 123 VAL C . 34365 1 839 . 1 . 1 123 123 VAL CA C 13 59.029 0.061 . . . . . . A 123 VAL CA . 34365 1 840 . 1 . 1 123 123 VAL CB C 13 35.246 0.125 . . . . . . A 123 VAL CB . 34365 1 841 . 1 . 1 123 123 VAL CG1 C 13 20.502 0.148 . . . . . . A 123 VAL CG1 . 34365 1 842 . 1 . 1 123 123 VAL CG2 C 13 22.233 0.042 . . . . . . A 123 VAL CG2 . 34365 1 843 . 1 . 1 123 123 VAL N N 15 118.429 0.162 . . . . . . A 123 VAL N . 34365 1 844 . 1 . 1 124 124 GLY H H 1 9.451 0.016 . . . . . . A 124 GLY H . 34365 1 845 . 1 . 1 124 124 GLY HA2 H 1 3.387 0.065 . . . . . . A 124 GLY HA2 . 34365 1 846 . 1 . 1 124 124 GLY HA3 H 1 4.202 0.038 . . . . . . A 124 GLY HA3 . 34365 1 847 . 1 . 1 124 124 GLY C C 13 171.266 0.118 . . . . . . A 124 GLY C . 34365 1 848 . 1 . 1 124 124 GLY CA C 13 44.249 0.121 . . . . . . A 124 GLY CA . 34365 1 849 . 1 . 1 124 124 GLY N N 15 111.820 0.141 . . . . . . A 124 GLY N . 34365 1 850 . 1 . 1 125 125 ARG H H 1 8.698 0.038 . . . . . . A 125 ARG H . 34365 1 851 . 1 . 1 125 125 ARG HA H 1 4.440 0.023 . . . . . . A 125 ARG HA . 34365 1 852 . 1 . 1 125 125 ARG HB2 H 1 0.825 0.000 . . . . . . A 125 ARG HB2 . 34365 1 853 . 1 . 1 125 125 ARG HB3 H 1 1.507 0.000 . . . . . . A 125 ARG HB3 . 34365 1 854 . 1 . 1 125 125 ARG C C 13 174.191 0.066 . . . . . . A 125 ARG C . 34365 1 855 . 1 . 1 125 125 ARG CA C 13 52.642 0.066 . . . . . . A 125 ARG CA . 34365 1 856 . 1 . 1 125 125 ARG CB C 13 32.397 0.108 . . . . . . A 125 ARG CB . 34365 1 857 . 1 . 1 125 125 ARG N N 15 121.076 0.139 . . . . . . A 125 ARG N . 34365 1 858 . 1 . 1 126 126 VAL H H 1 8.756 0.022 . . . . . . A 126 VAL H . 34365 1 859 . 1 . 1 126 126 VAL HA H 1 3.110 0.031 . . . . . . A 126 VAL HA . 34365 1 860 . 1 . 1 126 126 VAL HB H 1 0.930 0.027 . . . . . . A 126 VAL HB . 34365 1 861 . 1 . 1 126 126 VAL HG11 H 1 -0.058 0.022 . . . . . . A 126 VAL HG11 . 34365 1 862 . 1 . 1 126 126 VAL HG12 H 1 -0.058 0.022 . . . . . . A 126 VAL HG12 . 34365 1 863 . 1 . 1 126 126 VAL HG13 H 1 -0.058 0.022 . . . . . . A 126 VAL HG13 . 34365 1 864 . 1 . 1 126 126 VAL HG21 H 1 -0.467 0.037 . . . . . . A 126 VAL HG21 . 34365 1 865 . 1 . 1 126 126 VAL HG22 H 1 -0.467 0.037 . . . . . . A 126 VAL HG22 . 34365 1 866 . 1 . 1 126 126 VAL HG23 H 1 -0.467 0.037 . . . . . . A 126 VAL HG23 . 34365 1 867 . 1 . 1 126 126 VAL C C 13 172.827 0.099 . . . . . . A 126 VAL C . 34365 1 868 . 1 . 1 126 126 VAL CA C 13 63.354 0.137 . . . . . . A 126 VAL CA . 34365 1 869 . 1 . 1 126 126 VAL CB C 13 30.791 0.113 . . . . . . A 126 VAL CB . 34365 1 870 . 1 . 1 126 126 VAL CG1 C 13 19.846 0.084 . . . . . . A 126 VAL CG1 . 34365 1 871 . 1 . 1 126 126 VAL CG2 C 13 20.707 0.068 . . . . . . A 126 VAL CG2 . 34365 1 872 . 1 . 1 126 126 VAL N N 15 127.971 0.109 . . . . . . A 126 VAL N . 34365 1 873 . 1 . 1 127 127 LEU H H 1 6.678 0.050 . . . . . . A 127 LEU H . 34365 1 874 . 1 . 1 127 127 LEU HA H 1 3.858 0.045 . . . . . . A 127 LEU HA . 34365 1 875 . 1 . 1 127 127 LEU HB2 H 1 0.798 0.013 . . . . . . A 127 LEU HB2 . 34365 1 876 . 1 . 1 127 127 LEU HB3 H 1 0.956 0.014 . . . . . . A 127 LEU HB3 . 34365 1 877 . 1 . 1 127 127 LEU HG H 1 1.453 0.014 . . . . . . A 127 LEU HG . 34365 1 878 . 1 . 1 127 127 LEU HD11 H 1 0.186 0.000 . . . . . . A 127 LEU HD11 . 34365 1 879 . 1 . 1 127 127 LEU HD12 H 1 0.186 0.000 . . . . . . A 127 LEU HD12 . 34365 1 880 . 1 . 1 127 127 LEU HD13 H 1 0.186 0.000 . . . . . . A 127 LEU HD13 . 34365 1 881 . 1 . 1 127 127 LEU HD21 H 1 0.186 0.000 . . . . . . A 127 LEU HD21 . 34365 1 882 . 1 . 1 127 127 LEU HD22 H 1 0.186 0.000 . . . . . . A 127 LEU HD22 . 34365 1 883 . 1 . 1 127 127 LEU HD23 H 1 0.186 0.000 . . . . . . A 127 LEU HD23 . 34365 1 884 . 1 . 1 127 127 LEU C C 13 174.617 0.062 . . . . . . A 127 LEU C . 34365 1 885 . 1 . 1 127 127 LEU CA C 13 53.472 0.121 . . . . . . A 127 LEU CA . 34365 1 886 . 1 . 1 127 127 LEU CB C 13 44.455 0.104 . . . . . . A 127 LEU CB . 34365 1 887 . 1 . 1 127 127 LEU CG C 13 26.768 0.173 . . . . . . A 127 LEU CG . 34365 1 888 . 1 . 1 127 127 LEU CD1 C 13 20.852 0.000 . . . . . . A 127 LEU CD1 . 34365 1 889 . 1 . 1 127 127 LEU CD2 C 13 20.852 0.000 . . . . . . A 127 LEU CD2 . 34365 1 890 . 1 . 1 127 127 LEU N N 15 125.820 0.056 . . . . . . A 127 LEU N . 34365 1 891 . 1 . 1 128 128 PHE H H 1 8.005 0.023 . . . . . . A 128 PHE H . 34365 1 892 . 1 . 1 128 128 PHE HA H 1 4.543 0.008 . . . . . . A 128 PHE HA . 34365 1 893 . 1 . 1 128 128 PHE HB2 H 1 2.527 0.027 . . . . . . A 128 PHE HB2 . 34365 1 894 . 1 . 1 128 128 PHE HB3 H 1 2.759 0.015 . . . . . . A 128 PHE HB3 . 34365 1 895 . 1 . 1 128 128 PHE HE1 H 1 6.794 0.000 . . . . . . A 128 PHE HE1 . 34365 1 896 . 1 . 1 128 128 PHE C C 13 175.335 0.062 . . . . . . A 128 PHE C . 34365 1 897 . 1 . 1 128 128 PHE CA C 13 54.988 0.063 . . . . . . A 128 PHE CA . 34365 1 898 . 1 . 1 128 128 PHE CB C 13 42.134 0.064 . . . . . . A 128 PHE CB . 34365 1 899 . 1 . 1 128 128 PHE N N 15 117.540 0.086 . . . . . . A 128 PHE N . 34365 1 900 . 1 . 1 129 129 PHE H H 1 7.990 0.048 . . . . . . A 129 PHE H . 34365 1 901 . 1 . 1 129 129 PHE HA H 1 4.617 0.011 . . . . . . A 129 PHE HA . 34365 1 902 . 1 . 1 129 129 PHE HB2 H 1 2.402 0.015 . . . . . . A 129 PHE HB2 . 34365 1 903 . 1 . 1 129 129 PHE HB3 H 1 2.623 0.013 . . . . . . A 129 PHE HB3 . 34365 1 904 . 1 . 1 129 129 PHE C C 13 174.610 0.060 . . . . . . A 129 PHE C . 34365 1 905 . 1 . 1 129 129 PHE CA C 13 54.855 0.052 . . . . . . A 129 PHE CA . 34365 1 906 . 1 . 1 129 129 PHE CB C 13 42.734 0.192 . . . . . . A 129 PHE CB . 34365 1 907 . 1 . 1 129 129 PHE N N 15 117.623 0.168 . . . . . . A 129 PHE N . 34365 1 908 . 1 . 1 130 130 ASP H H 1 7.371 0.020 . . . . . . A 130 ASP H . 34365 1 909 . 1 . 1 130 130 ASP HA H 1 5.780 0.027 . . . . . . A 130 ASP HA . 34365 1 910 . 1 . 1 130 130 ASP C C 13 175.195 0.023 . . . . . . A 130 ASP C . 34365 1 911 . 1 . 1 130 130 ASP CA C 13 54.139 0.103 . . . . . . A 130 ASP CA . 34365 1 912 . 1 . 1 130 130 ASP CB C 13 41.036 0.000 . . . . . . A 130 ASP CB . 34365 1 913 . 1 . 1 130 130 ASP N N 15 120.269 0.065 . . . . . . A 130 ASP N . 34365 1 914 . 1 . 1 131 131 LYS H H 1 8.436 0.026 . . . . . . A 131 LYS H . 34365 1 915 . 1 . 1 131 131 LYS HA H 1 4.178 0.026 . . . . . . A 131 LYS HA . 34365 1 916 . 1 . 1 131 131 LYS HB2 H 1 1.888 0.009 . . . . . . A 131 LYS HB2 . 34365 1 917 . 1 . 1 131 131 LYS HB3 H 1 1.720 0.000 . . . . . . A 131 LYS HB3 . 34365 1 918 . 1 . 1 131 131 LYS HG2 H 1 1.243 0.000 . . . . . . A 131 LYS HG2 . 34365 1 919 . 1 . 1 131 131 LYS HG3 H 1 1.861 0.000 . . . . . . A 131 LYS HG3 . 34365 1 920 . 1 . 1 131 131 LYS C C 13 176.935 0.156 . . . . . . A 131 LYS C . 34365 1 921 . 1 . 1 131 131 LYS CA C 13 59.069 0.112 . . . . . . A 131 LYS CA . 34365 1 922 . 1 . 1 131 131 LYS CB C 13 32.115 0.166 . . . . . . A 131 LYS CB . 34365 1 923 . 1 . 1 131 131 LYS CG C 13 27.277 0.040 . . . . . . A 131 LYS CG . 34365 1 924 . 1 . 1 131 131 LYS N N 15 120.566 0.125 . . . . . . A 131 LYS N . 34365 1 925 . 1 . 1 132 132 THR H H 1 9.094 0.026 . . . . . . A 132 THR H . 34365 1 926 . 1 . 1 132 132 THR HA H 1 4.426 0.037 . . . . . . A 132 THR HA . 34365 1 927 . 1 . 1 132 132 THR HB H 1 3.788 0.031 . . . . . . A 132 THR HB . 34365 1 928 . 1 . 1 132 132 THR HG21 H 1 1.056 0.008 . . . . . . A 132 THR HG21 . 34365 1 929 . 1 . 1 132 132 THR HG22 H 1 1.056 0.008 . . . . . . A 132 THR HG22 . 34365 1 930 . 1 . 1 132 132 THR HG23 H 1 1.056 0.008 . . . . . . A 132 THR HG23 . 34365 1 931 . 1 . 1 132 132 THR C C 13 172.502 0.041 . . . . . . A 132 THR C . 34365 1 932 . 1 . 1 132 132 THR CA C 13 62.251 0.080 . . . . . . A 132 THR CA . 34365 1 933 . 1 . 1 132 132 THR CB C 13 71.310 0.065 . . . . . . A 132 THR CB . 34365 1 934 . 1 . 1 132 132 THR CG2 C 13 19.923 0.074 . . . . . . A 132 THR CG2 . 34365 1 935 . 1 . 1 132 132 THR N N 15 122.596 0.249 . . . . . . A 132 THR N . 34365 1 936 . 1 . 1 133 133 ASP H H 1 8.555 0.037 . . . . . . A 133 ASP H . 34365 1 937 . 1 . 1 133 133 ASP HA H 1 4.361 0.032 . . . . . . A 133 ASP HA . 34365 1 938 . 1 . 1 133 133 ASP HB2 H 1 2.492 0.017 . . . . . . A 133 ASP HB2 . 34365 1 939 . 1 . 1 133 133 ASP HB3 H 1 2.995 0.031 . . . . . . A 133 ASP HB3 . 34365 1 940 . 1 . 1 133 133 ASP C C 13 176.878 0.040 . . . . . . A 133 ASP C . 34365 1 941 . 1 . 1 133 133 ASP CA C 13 55.437 0.064 . . . . . . A 133 ASP CA . 34365 1 942 . 1 . 1 133 133 ASP CB C 13 41.448 0.065 . . . . . . A 133 ASP CB . 34365 1 943 . 1 . 1 133 133 ASP N N 15 128.279 0.158 . . . . . . A 133 ASP N . 34365 1 944 . 1 . 1 134 134 GLY H H 1 7.386 0.030 . . . . . . A 134 GLY H . 34365 1 945 . 1 . 1 134 134 GLY HA2 H 1 2.883 0.031 . . . . . . A 134 GLY HA2 . 34365 1 946 . 1 . 1 134 134 GLY HA3 H 1 4.102 0.032 . . . . . . A 134 GLY HA3 . 34365 1 947 . 1 . 1 134 134 GLY C C 13 173.517 0.069 . . . . . . A 134 GLY C . 34365 1 948 . 1 . 1 134 134 GLY CA C 13 45.892 0.063 . . . . . . A 134 GLY CA . 34365 1 949 . 1 . 1 134 134 GLY N N 15 111.778 0.120 . . . . . . A 134 GLY N . 34365 1 950 . 1 . 1 135 135 ALA H H 1 8.698 0.036 . . . . . . A 135 ALA H . 34365 1 951 . 1 . 1 135 135 ALA HA H 1 3.996 0.021 . . . . . . A 135 ALA HA . 34365 1 952 . 1 . 1 135 135 ALA HB1 H 1 1.292 0.031 . . . . . . A 135 ALA HB1 . 34365 1 953 . 1 . 1 135 135 ALA HB2 H 1 1.292 0.031 . . . . . . A 135 ALA HB2 . 34365 1 954 . 1 . 1 135 135 ALA HB3 H 1 1.292 0.031 . . . . . . A 135 ALA HB3 . 34365 1 955 . 1 . 1 135 135 ALA C C 13 177.898 0.188 . . . . . . A 135 ALA C . 34365 1 956 . 1 . 1 135 135 ALA CA C 13 54.825 0.092 . . . . . . A 135 ALA CA . 34365 1 957 . 1 . 1 135 135 ALA CB C 13 20.161 0.085 . . . . . . A 135 ALA CB . 34365 1 958 . 1 . 1 135 135 ALA N N 15 131.807 0.097 . . . . . . A 135 ALA N . 34365 1 959 . 1 . 1 136 136 LEU H H 1 8.174 0.041 . . . . . . A 136 LEU H . 34365 1 960 . 1 . 1 136 136 LEU HA H 1 4.423 0.051 . . . . . . A 136 LEU HA . 34365 1 961 . 1 . 1 136 136 LEU HB2 H 1 1.059 0.006 . . . . . . A 136 LEU HB2 . 34365 1 962 . 1 . 1 136 136 LEU HB3 H 1 1.612 0.031 . . . . . . A 136 LEU HB3 . 34365 1 963 . 1 . 1 136 136 LEU C C 13 175.297 0.107 . . . . . . A 136 LEU C . 34365 1 964 . 1 . 1 136 136 LEU CA C 13 53.579 0.090 . . . . . . A 136 LEU CA . 34365 1 965 . 1 . 1 136 136 LEU CB C 13 44.858 0.094 . . . . . . A 136 LEU CB . 34365 1 966 . 1 . 1 136 136 LEU CG C 13 27.032 0.201 . . . . . . A 136 LEU CG . 34365 1 967 . 1 . 1 136 136 LEU N N 15 113.703 0.193 . . . . . . A 136 LEU N . 34365 1 968 . 1 . 1 137 137 SER H H 1 8.662 0.049 . . . . . . A 137 SER H . 34365 1 969 . 1 . 1 137 137 SER HA H 1 4.556 0.017 . . . . . . A 137 SER HA . 34365 1 970 . 1 . 1 137 137 SER HB2 H 1 3.700 0.024 . . . . . . A 137 SER HB2 . 34365 1 971 . 1 . 1 137 137 SER HB3 H 1 3.784 0.007 . . . . . . A 137 SER HB3 . 34365 1 972 . 1 . 1 137 137 SER C C 13 174.186 0.070 . . . . . . A 137 SER C . 34365 1 973 . 1 . 1 137 137 SER CA C 13 56.807 0.138 . . . . . . A 137 SER CA . 34365 1 974 . 1 . 1 137 137 SER CB C 13 64.829 0.068 . . . . . . A 137 SER CB . 34365 1 975 . 1 . 1 137 137 SER N N 15 117.996 0.173 . . . . . . A 137 SER N . 34365 1 976 . 1 . 1 138 138 SER H H 1 9.251 0.025 . . . . . . A 138 SER H . 34365 1 977 . 1 . 1 138 138 SER HA H 1 3.866 0.029 . . . . . . A 138 SER HA . 34365 1 978 . 1 . 1 138 138 SER HB2 H 1 3.702 0.010 . . . . . . A 138 SER HB2 . 34365 1 979 . 1 . 1 138 138 SER HB3 H 1 3.868 0.000 . . . . . . A 138 SER HB3 . 34365 1 980 . 1 . 1 138 138 SER C C 13 174.189 0.046 . . . . . . A 138 SER C . 34365 1 981 . 1 . 1 138 138 SER CA C 13 58.008 0.066 . . . . . . A 138 SER CA . 34365 1 982 . 1 . 1 138 138 SER CB C 13 61.755 0.111 . . . . . . A 138 SER CB . 34365 1 983 . 1 . 1 138 138 SER N N 15 115.402 0.168 . . . . . . A 138 SER N . 34365 1 984 . 1 . 1 139 139 PHE H H 1 8.334 0.019 . . . . . . A 139 PHE H . 34365 1 985 . 1 . 1 139 139 PHE HA H 1 4.648 0.007 . . . . . . A 139 PHE HA . 34365 1 986 . 1 . 1 139 139 PHE HB2 H 1 2.713 0.010 . . . . . . A 139 PHE HB2 . 34365 1 987 . 1 . 1 139 139 PHE HB3 H 1 3.026 0.005 . . . . . . A 139 PHE HB3 . 34365 1 988 . 1 . 1 139 139 PHE C C 13 174.784 0.084 . . . . . . A 139 PHE C . 34365 1 989 . 1 . 1 139 139 PHE CA C 13 57.063 0.054 . . . . . . A 139 PHE CA . 34365 1 990 . 1 . 1 139 139 PHE CB C 13 39.041 0.094 . . . . . . A 139 PHE CB . 34365 1 991 . 1 . 1 139 139 PHE N N 15 119.492 0.180 . . . . . . A 139 PHE N . 34365 1 992 . 1 . 1 140 140 ASP H H 1 8.462 0.025 . . . . . . A 140 ASP H . 34365 1 993 . 1 . 1 140 140 ASP HA H 1 4.114 0.020 . . . . . . A 140 ASP HA . 34365 1 994 . 1 . 1 140 140 ASP HB2 H 1 2.198 0.021 . . . . . . A 140 ASP HB2 . 34365 1 995 . 1 . 1 140 140 ASP HB3 H 1 1.984 0.020 . . . . . . A 140 ASP HB3 . 34365 1 996 . 1 . 1 140 140 ASP C C 13 171.773 0.078 . . . . . . A 140 ASP C . 34365 1 997 . 1 . 1 140 140 ASP CA C 13 52.336 0.052 . . . . . . A 140 ASP CA . 34365 1 998 . 1 . 1 140 140 ASP CB C 13 44.189 0.048 . . . . . . A 140 ASP CB . 34365 1 999 . 1 . 1 140 140 ASP N N 15 127.640 0.097 . . . . . . A 140 ASP N . 34365 1 1000 . 1 . 1 141 141 ILE H H 1 7.162 0.025 . . . . . . A 141 ILE H . 34365 1 1001 . 1 . 1 141 141 ILE HA H 1 4.700 0.011 . . . . . . A 141 ILE HA . 34365 1 1002 . 1 . 1 141 141 ILE HB H 1 0.942 0.043 . . . . . . A 141 ILE HB . 34365 1 1003 . 1 . 1 141 141 ILE HG12 H 1 0.902 0.015 . . . . . . A 141 ILE HG12 . 34365 1 1004 . 1 . 1 141 141 ILE HG13 H 1 -0.420 0.009 . . . . . . A 141 ILE HG13 . 34365 1 1005 . 1 . 1 141 141 ILE HD11 H 1 -0.153 0.037 . . . . . . A 141 ILE HD11 . 34365 1 1006 . 1 . 1 141 141 ILE HD12 H 1 -0.153 0.037 . . . . . . A 141 ILE HD12 . 34365 1 1007 . 1 . 1 141 141 ILE HD13 H 1 -0.153 0.037 . . . . . . A 141 ILE HD13 . 34365 1 1008 . 1 . 1 141 141 ILE C C 13 172.973 0.018 . . . . . . A 141 ILE C . 34365 1 1009 . 1 . 1 141 141 ILE CA C 13 58.381 0.062 . . . . . . A 141 ILE CA . 34365 1 1010 . 1 . 1 141 141 ILE CB C 13 40.243 0.077 . . . . . . A 141 ILE CB . 34365 1 1011 . 1 . 1 141 141 ILE CG1 C 13 27.598 0.104 . . . . . . A 141 ILE CG1 . 34365 1 1012 . 1 . 1 141 141 ILE CD1 C 13 14.489 0.101 . . . . . . A 141 ILE CD1 . 34365 1 1013 . 1 . 1 141 141 ILE N N 15 119.444 0.118 . . . . . . A 141 ILE N . 34365 1 1014 . 1 . 1 142 142 LYS H H 1 6.462 0.036 . . . . . . A 142 LYS H . 34365 1 1015 . 1 . 1 142 142 LYS HA H 1 4.293 0.007 . . . . . . A 142 LYS HA . 34365 1 1016 . 1 . 1 142 142 LYS HB2 H 1 1.772 0.000 . . . . . . A 142 LYS HB2 . 34365 1 1017 . 1 . 1 142 142 LYS HB3 H 1 1.772 0.000 . . . . . . A 142 LYS HB3 . 34365 1 1018 . 1 . 1 142 142 LYS C C 13 176.465 0.094 . . . . . . A 142 LYS C . 34365 1 1019 . 1 . 1 142 142 LYS CA C 13 55.155 0.043 . . . . . . A 142 LYS CA . 34365 1 1020 . 1 . 1 142 142 LYS CB C 13 33.326 0.082 . . . . . . A 142 LYS CB . 34365 1 1021 . 1 . 1 142 142 LYS N N 15 123.986 0.126 . . . . . . A 142 LYS N . 34365 1 1022 . 1 . 1 143 143 ASP H H 1 8.177 0.016 . . . . . . A 143 ASP H . 34365 1 1023 . 1 . 1 143 143 ASP HA H 1 4.550 0.017 . . . . . . A 143 ASP HA . 34365 1 1024 . 1 . 1 143 143 ASP HB2 H 1 2.329 0.003 . . . . . . A 143 ASP HB2 . 34365 1 1025 . 1 . 1 143 143 ASP HB3 H 1 2.007 0.015 . . . . . . A 143 ASP HB3 . 34365 1 1026 . 1 . 1 143 143 ASP C C 13 176.193 0.076 . . . . . . A 143 ASP C . 34365 1 1027 . 1 . 1 143 143 ASP CA C 13 55.356 0.045 . . . . . . A 143 ASP CA . 34365 1 1028 . 1 . 1 143 143 ASP CB C 13 40.759 0.090 . . . . . . A 143 ASP CB . 34365 1 1029 . 1 . 1 143 143 ASP N N 15 124.838 0.082 . . . . . . A 143 ASP N . 34365 1 1030 . 1 . 1 144 144 LYS H H 1 7.191 0.028 . . . . . . A 144 LYS H . 34365 1 1031 . 1 . 1 144 144 LYS HA H 1 4.679 0.005 . . . . . . A 144 LYS HA . 34365 1 1032 . 1 . 1 144 144 LYS C C 13 177.219 0.088 . . . . . . A 144 LYS C . 34365 1 1033 . 1 . 1 144 144 LYS CA C 13 53.265 0.059 . . . . . . A 144 LYS CA . 34365 1 1034 . 1 . 1 144 144 LYS CB C 13 36.980 0.010 . . . . . . A 144 LYS CB . 34365 1 1035 . 1 . 1 144 144 LYS N N 15 115.966 0.272 . . . . . . A 144 LYS N . 34365 1 1036 . 1 . 1 145 145 TRP H H 1 8.581 0.016 . . . . . . A 145 TRP H . 34365 1 1037 . 1 . 1 145 145 TRP HA H 1 5.294 0.019 . . . . . . A 145 TRP HA . 34365 1 1038 . 1 . 1 145 145 TRP HB2 H 1 2.814 0.012 . . . . . . A 145 TRP HB2 . 34365 1 1039 . 1 . 1 145 145 TRP HB3 H 1 3.030 0.028 . . . . . . A 145 TRP HB3 . 34365 1 1040 . 1 . 1 145 145 TRP C C 13 175.581 0.067 . . . . . . A 145 TRP C . 34365 1 1041 . 1 . 1 145 145 TRP CA C 13 56.540 0.109 . . . . . . A 145 TRP CA . 34365 1 1042 . 1 . 1 145 145 TRP CB C 13 31.221 0.086 . . . . . . A 145 TRP CB . 34365 1 1043 . 1 . 1 145 145 TRP N N 15 122.064 0.233 . . . . . . A 145 TRP N . 34365 1 1044 . 1 . 1 146 146 ALA H H 1 9.047 0.023 . . . . . . A 146 ALA H . 34365 1 1045 . 1 . 1 146 146 ALA HA H 1 4.739 0.026 . . . . . . A 146 ALA HA . 34365 1 1046 . 1 . 1 146 146 ALA HB1 H 1 1.054 0.011 . . . . . . A 146 ALA HB1 . 34365 1 1047 . 1 . 1 146 146 ALA HB2 H 1 1.054 0.011 . . . . . . A 146 ALA HB2 . 34365 1 1048 . 1 . 1 146 146 ALA HB3 H 1 1.054 0.011 . . . . . . A 146 ALA HB3 . 34365 1 1049 . 1 . 1 146 146 ALA C C 13 173.341 0.105 . . . . . . A 146 ALA C . 34365 1 1050 . 1 . 1 146 146 ALA CA C 13 50.488 0.075 . . . . . . A 146 ALA CA . 34365 1 1051 . 1 . 1 146 146 ALA CB C 13 21.979 0.033 . . . . . . A 146 ALA CB . 34365 1 1052 . 1 . 1 146 146 ALA N N 15 123.577 0.187 . . . . . . A 146 ALA N . 34365 1 1053 . 1 . 1 147 147 PRO HA H 1 4.517 0.042 . . . . . . A 147 PRO HA . 34365 1 1054 . 1 . 1 147 147 PRO HB2 H 1 1.540 0.005 . . . . . . A 147 PRO HB2 . 34365 1 1055 . 1 . 1 147 147 PRO HB3 H 1 1.729 0.019 . . . . . . A 147 PRO HB3 . 34365 1 1056 . 1 . 1 147 147 PRO HG2 H 1 2.075 0.073 . . . . . . A 147 PRO HG2 . 34365 1 1057 . 1 . 1 147 147 PRO HG3 H 1 1.845 0.009 . . . . . . A 147 PRO HG3 . 34365 1 1058 . 1 . 1 147 147 PRO HD2 H 1 3.469 0.000 . . . . . . A 147 PRO HD2 . 34365 1 1059 . 1 . 1 147 147 PRO HD3 H 1 3.799 0.000 . . . . . . A 147 PRO HD3 . 34365 1 1060 . 1 . 1 147 147 PRO C C 13 172.382 0.060 . . . . . . A 147 PRO C . 34365 1 1061 . 1 . 1 147 147 PRO CA C 13 62.102 0.052 . . . . . . A 147 PRO CA . 34365 1 1062 . 1 . 1 147 147 PRO CB C 13 31.857 0.142 . . . . . . A 147 PRO CB . 34365 1 1063 . 1 . 1 147 147 PRO CG C 13 26.408 0.090 . . . . . . A 147 PRO CG . 34365 1 1064 . 1 . 1 147 147 PRO CD C 13 49.464 0.086 . . . . . . A 147 PRO CD . 34365 1 1065 . 1 . 1 147 147 PRO N N 15 133.328 0.019 . . . . . . A 147 PRO N . 34365 1 1066 . 1 . 1 148 148 ALA H H 1 7.164 0.025 . . . . . . A 148 ALA H . 34365 1 1067 . 1 . 1 148 148 ALA HA H 1 4.827 0.024 . . . . . . A 148 ALA HA . 34365 1 1068 . 1 . 1 148 148 ALA HB1 H 1 0.558 0.027 . . . . . . A 148 ALA HB1 . 34365 1 1069 . 1 . 1 148 148 ALA HB2 H 1 0.558 0.027 . . . . . . A 148 ALA HB2 . 34365 1 1070 . 1 . 1 148 148 ALA HB3 H 1 0.558 0.027 . . . . . . A 148 ALA HB3 . 34365 1 1071 . 1 . 1 148 148 ALA C C 13 175.478 0.091 . . . . . . A 148 ALA C . 34365 1 1072 . 1 . 1 148 148 ALA CA C 13 49.471 0.059 . . . . . . A 148 ALA CA . 34365 1 1073 . 1 . 1 148 148 ALA CB C 13 23.984 0.078 . . . . . . A 148 ALA CB . 34365 1 1074 . 1 . 1 148 148 ALA N N 15 117.238 0.051 . . . . . . A 148 ALA N . 34365 1 1075 . 1 . 1 149 149 PHE H H 1 8.510 0.022 . . . . . . A 149 PHE H . 34365 1 1076 . 1 . 1 149 149 PHE HA H 1 5.106 0.018 . . . . . . A 149 PHE HA . 34365 1 1077 . 1 . 1 149 149 PHE HB2 H 1 2.726 0.033 . . . . . . A 149 PHE HB2 . 34365 1 1078 . 1 . 1 149 149 PHE HB3 H 1 3.139 0.012 . . . . . . A 149 PHE HB3 . 34365 1 1079 . 1 . 1 149 149 PHE C C 13 176.004 0.053 . . . . . . A 149 PHE C . 34365 1 1080 . 1 . 1 149 149 PHE CA C 13 55.890 0.081 . . . . . . A 149 PHE CA . 34365 1 1081 . 1 . 1 149 149 PHE CB C 13 43.996 0.064 . . . . . . A 149 PHE CB . 34365 1 1082 . 1 . 1 149 149 PHE N N 15 119.118 0.153 . . . . . . A 149 PHE N . 34365 1 1083 . 1 . 1 150 150 GLN H H 1 8.575 0.036 . . . . . . A 150 GLN H . 34365 1 1084 . 1 . 1 150 150 GLN HA H 1 5.451 0.036 . . . . . . A 150 GLN HA . 34365 1 1085 . 1 . 1 150 150 GLN HB3 H 1 1.942 0.048 . . . . . . A 150 GLN HB3 . 34365 1 1086 . 1 . 1 150 150 GLN HE21 H 1 7.520 0.023 . . . . . . A 150 GLN HE21 . 34365 1 1087 . 1 . 1 150 150 GLN HE22 H 1 6.481 0.031 . . . . . . A 150 GLN HE22 . 34365 1 1088 . 1 . 1 150 150 GLN C C 13 173.459 0.174 . . . . . . A 150 GLN C . 34365 1 1089 . 1 . 1 150 150 GLN CA C 13 54.734 0.081 . . . . . . A 150 GLN CA . 34365 1 1090 . 1 . 1 150 150 GLN CB C 13 32.753 0.102 . . . . . . A 150 GLN CB . 34365 1 1091 . 1 . 1 150 150 GLN CG C 13 33.591 0.060 . . . . . . A 150 GLN CG . 34365 1 1092 . 1 . 1 150 150 GLN N N 15 124.663 0.060 . . . . . . A 150 GLN N . 34365 1 1093 . 1 . 1 150 150 GLN NE2 N 15 116.110 0.138 . . . . . . A 150 GLN NE2 . 34365 1 1094 . 1 . 1 151 151 VAL H H 1 8.345 0.020 . . . . . . A 151 VAL H . 34365 1 1095 . 1 . 1 151 151 VAL HA H 1 4.602 0.014 . . . . . . A 151 VAL HA . 34365 1 1096 . 1 . 1 151 151 VAL HB H 1 1.438 0.004 . . . . . . A 151 VAL HB . 34365 1 1097 . 1 . 1 151 151 VAL HG11 H 1 0.526 0.022 . . . . . . A 151 VAL HG11 . 34365 1 1098 . 1 . 1 151 151 VAL HG12 H 1 0.526 0.022 . . . . . . A 151 VAL HG12 . 34365 1 1099 . 1 . 1 151 151 VAL HG13 H 1 0.526 0.022 . . . . . . A 151 VAL HG13 . 34365 1 1100 . 1 . 1 151 151 VAL HG21 H 1 0.532 0.021 . . . . . . A 151 VAL HG21 . 34365 1 1101 . 1 . 1 151 151 VAL HG22 H 1 0.532 0.021 . . . . . . A 151 VAL HG22 . 34365 1 1102 . 1 . 1 151 151 VAL HG23 H 1 0.532 0.021 . . . . . . A 151 VAL HG23 . 34365 1 1103 . 1 . 1 151 151 VAL C C 13 172.911 0.046 . . . . . . A 151 VAL C . 34365 1 1104 . 1 . 1 151 151 VAL CA C 13 60.286 0.106 . . . . . . A 151 VAL CA . 34365 1 1105 . 1 . 1 151 151 VAL CB C 13 35.020 0.056 . . . . . . A 151 VAL CB . 34365 1 1106 . 1 . 1 151 151 VAL CG1 C 13 21.363 0.149 . . . . . . A 151 VAL CG1 . 34365 1 1107 . 1 . 1 151 151 VAL CG2 C 13 21.199 0.156 . . . . . . A 151 VAL CG2 . 34365 1 1108 . 1 . 1 151 151 VAL N N 15 121.596 0.072 . . . . . . A 151 VAL N . 34365 1 1109 . 1 . 1 152 152 GLY H H 1 8.511 0.024 . . . . . . A 152 GLY H . 34365 1 1110 . 1 . 1 152 152 GLY HA2 H 1 4.210 0.037 . . . . . . A 152 GLY HA2 . 34365 1 1111 . 1 . 1 152 152 GLY HA3 H 1 2.462 0.036 . . . . . . A 152 GLY HA3 . 34365 1 1112 . 1 . 1 152 152 GLY C C 13 170.597 0.050 . . . . . . A 152 GLY C . 34365 1 1113 . 1 . 1 152 152 GLY CA C 13 44.866 0.078 . . . . . . A 152 GLY CA . 34365 1 1114 . 1 . 1 152 152 GLY N N 15 111.601 0.106 . . . . . . A 152 GLY N . 34365 1 1115 . 1 . 1 153 153 LEU H H 1 8.990 0.038 . . . . . . A 153 LEU H . 34365 1 1116 . 1 . 1 153 153 LEU HA H 1 4.580 0.018 . . . . . . A 153 LEU HA . 34365 1 1117 . 1 . 1 153 153 LEU HB2 H 1 1.241 0.008 . . . . . . A 153 LEU HB2 . 34365 1 1118 . 1 . 1 153 153 LEU HB3 H 1 1.440 0.008 . . . . . . A 153 LEU HB3 . 34365 1 1119 . 1 . 1 153 153 LEU C C 13 174.678 0.092 . . . . . . A 153 LEU C . 34365 1 1120 . 1 . 1 153 153 LEU CA C 13 54.904 0.065 . . . . . . A 153 LEU CA . 34365 1 1121 . 1 . 1 153 153 LEU CB C 13 46.655 0.119 . . . . . . A 153 LEU CB . 34365 1 1122 . 1 . 1 153 153 LEU N N 15 117.992 0.084 . . . . . . A 153 LEU N . 34365 1 1123 . 1 . 1 154 154 ARG H H 1 7.366 0.034 . . . . . . A 154 ARG H . 34365 1 1124 . 1 . 1 154 154 ARG HA H 1 5.815 0.020 . . . . . . A 154 ARG HA . 34365 1 1125 . 1 . 1 154 154 ARG HB2 H 1 1.824 0.021 . . . . . . A 154 ARG HB2 . 34365 1 1126 . 1 . 1 154 154 ARG HB3 H 1 1.492 0.033 . . . . . . A 154 ARG HB3 . 34365 1 1127 . 1 . 1 154 154 ARG HD2 H 1 2.793 0.025 . . . . . . A 154 ARG HD2 . 34365 1 1128 . 1 . 1 154 154 ARG HD3 H 1 3.231 0.026 . . . . . . A 154 ARG HD3 . 34365 1 1129 . 1 . 1 154 154 ARG HE H 1 7.455 0.018 . . . . . . A 154 ARG HE . 34365 1 1130 . 1 . 1 154 154 ARG C C 13 175.145 0.113 . . . . . . A 154 ARG C . 34365 1 1131 . 1 . 1 154 154 ARG CA C 13 54.176 0.065 . . . . . . A 154 ARG CA . 34365 1 1132 . 1 . 1 154 154 ARG CB C 13 34.428 0.117 . . . . . . A 154 ARG CB . 34365 1 1133 . 1 . 1 154 154 ARG CG C 13 29.669 0.022 . . . . . . A 154 ARG CG . 34365 1 1134 . 1 . 1 154 154 ARG CD C 13 43.761 0.067 . . . . . . A 154 ARG CD . 34365 1 1135 . 1 . 1 154 154 ARG N N 15 120.357 0.121 . . . . . . A 154 ARG N . 34365 1 1136 . 1 . 1 154 154 ARG NE N 15 90.184 0.000 . . . . . . A 154 ARG NE . 34365 1 1137 . 1 . 1 155 155 TYR H H 1 8.572 0.024 . . . . . . A 155 TYR H . 34365 1 1138 . 1 . 1 155 155 TYR HA H 1 5.339 0.012 . . . . . . A 155 TYR HA . 34365 1 1139 . 1 . 1 155 155 TYR HB2 H 1 2.524 0.013 . . . . . . A 155 TYR HB2 . 34365 1 1140 . 1 . 1 155 155 TYR HB3 H 1 2.789 0.025 . . . . . . A 155 TYR HB3 . 34365 1 1141 . 1 . 1 155 155 TYR C C 13 174.838 0.109 . . . . . . A 155 TYR C . 34365 1 1142 . 1 . 1 155 155 TYR CA C 13 55.861 0.111 . . . . . . A 155 TYR CA . 34365 1 1143 . 1 . 1 155 155 TYR CB C 13 42.807 0.018 . . . . . . A 155 TYR CB . 34365 1 1144 . 1 . 1 155 155 TYR N N 15 120.886 0.088 . . . . . . A 155 TYR N . 34365 1 1145 . 1 . 1 156 156 ASP H H 1 8.478 0.008 . . . . . . A 156 ASP H . 34365 1 1146 . 1 . 1 156 156 ASP HA H 1 4.447 0.014 . . . . . . A 156 ASP HA . 34365 1 1147 . 1 . 1 156 156 ASP HB2 H 1 2.428 0.021 . . . . . . A 156 ASP HB2 . 34365 1 1148 . 1 . 1 156 156 ASP HB3 H 1 2.611 0.083 . . . . . . A 156 ASP HB3 . 34365 1 1149 . 1 . 1 156 156 ASP C C 13 174.865 0.058 . . . . . . A 156 ASP C . 34365 1 1150 . 1 . 1 156 156 ASP CA C 13 55.045 0.102 . . . . . . A 156 ASP CA . 34365 1 1151 . 1 . 1 156 156 ASP CB C 13 41.940 0.119 . . . . . . A 156 ASP CB . 34365 1 1152 . 1 . 1 156 156 ASP N N 15 127.823 0.119 . . . . . . A 156 ASP N . 34365 1 1153 . 1 . 1 157 157 LEU H H 1 7.082 0.018 . . . . . . A 157 LEU H . 34365 1 1154 . 1 . 1 157 157 LEU C C 13 175.617 0.000 . . . . . . A 157 LEU C . 34365 1 1155 . 1 . 1 157 157 LEU CA C 13 53.877 0.000 . . . . . . A 157 LEU CA . 34365 1 1156 . 1 . 1 157 157 LEU N N 15 120.394 0.038 . . . . . . A 157 LEU N . 34365 1 1157 . 1 . 1 158 158 GLY H H 1 9.248 0.032 . . . . . . A 158 GLY H . 34365 1 1158 . 1 . 1 158 158 GLY CA C 13 46.701 0.000 . . . . . . A 158 GLY CA . 34365 1 1159 . 1 . 1 158 158 GLY N N 15 112.984 0.067 . . . . . . A 158 GLY N . 34365 1 1160 . 1 . 1 161 161 TRP H H 1 8.609 0.027 . . . . . . A 161 TRP H . 34365 1 1161 . 1 . 1 161 161 TRP HA H 1 5.316 0.023 . . . . . . A 161 TRP HA . 34365 1 1162 . 1 . 1 161 161 TRP HB2 H 1 3.279 0.011 . . . . . . A 161 TRP HB2 . 34365 1 1163 . 1 . 1 161 161 TRP HB3 H 1 2.944 0.049 . . . . . . A 161 TRP HB3 . 34365 1 1164 . 1 . 1 161 161 TRP C C 13 176.896 0.066 . . . . . . A 161 TRP C . 34365 1 1165 . 1 . 1 161 161 TRP CA C 13 56.385 0.110 . . . . . . A 161 TRP CA . 34365 1 1166 . 1 . 1 161 161 TRP CB C 13 32.060 0.076 . . . . . . A 161 TRP CB . 34365 1 1167 . 1 . 1 161 161 TRP N N 15 122.961 0.055 . . . . . . A 161 TRP N . 34365 1 1168 . 1 . 1 162 162 MET H H 1 9.519 0.031 . . . . . . A 162 MET H . 34365 1 1169 . 1 . 1 162 162 MET HA H 1 5.282 0.052 . . . . . . A 162 MET HA . 34365 1 1170 . 1 . 1 162 162 MET HB2 H 1 1.431 0.024 . . . . . . A 162 MET HB2 . 34365 1 1171 . 1 . 1 162 162 MET HB3 H 1 1.944 0.039 . . . . . . A 162 MET HB3 . 34365 1 1172 . 1 . 1 162 162 MET HG2 H 1 2.016 0.006 . . . . . . A 162 MET HG2 . 34365 1 1173 . 1 . 1 162 162 MET HG3 H 1 2.171 0.017 . . . . . . A 162 MET HG3 . 34365 1 1174 . 1 . 1 162 162 MET C C 13 175.991 0.084 . . . . . . A 162 MET C . 34365 1 1175 . 1 . 1 162 162 MET CA C 13 53.796 0.070 . . . . . . A 162 MET CA . 34365 1 1176 . 1 . 1 162 162 MET CB C 13 37.416 0.124 . . . . . . A 162 MET CB . 34365 1 1177 . 1 . 1 162 162 MET CG C 13 32.209 0.097 . . . . . . A 162 MET CG . 34365 1 1178 . 1 . 1 162 162 MET N N 15 116.679 0.091 . . . . . . A 162 MET N . 34365 1 1179 . 1 . 1 163 163 LEU H H 1 8.902 0.027 . . . . . . A 163 LEU H . 34365 1 1180 . 1 . 1 163 163 LEU HA H 1 4.991 0.027 . . . . . . A 163 LEU HA . 34365 1 1181 . 1 . 1 163 163 LEU HB2 H 1 1.835 0.017 . . . . . . A 163 LEU HB2 . 34365 1 1182 . 1 . 1 163 163 LEU HB3 H 1 1.998 0.079 . . . . . . A 163 LEU HB3 . 34365 1 1183 . 1 . 1 163 163 LEU C C 13 175.977 0.094 . . . . . . A 163 LEU C . 34365 1 1184 . 1 . 1 163 163 LEU CA C 13 54.261 0.110 . . . . . . A 163 LEU CA . 34365 1 1185 . 1 . 1 163 163 LEU CB C 13 43.631 0.033 . . . . . . A 163 LEU CB . 34365 1 1186 . 1 . 1 163 163 LEU CG C 13 27.406 0.000 . . . . . . A 163 LEU CG . 34365 1 1187 . 1 . 1 163 163 LEU N N 15 120.197 0.160 . . . . . . A 163 LEU N . 34365 1 1188 . 1 . 1 164 164 ASN H H 1 8.941 0.025 . . . . . . A 164 ASN H . 34365 1 1189 . 1 . 1 164 164 ASN HA H 1 5.232 0.013 . . . . . . A 164 ASN HA . 34365 1 1190 . 1 . 1 164 164 ASN HB2 H 1 2.468 0.011 . . . . . . A 164 ASN HB2 . 34365 1 1191 . 1 . 1 164 164 ASN HB3 H 1 2.068 0.012 . . . . . . A 164 ASN HB3 . 34365 1 1192 . 1 . 1 164 164 ASN HD21 H 1 7.503 0.026 . . . . . . A 164 ASN HD21 . 34365 1 1193 . 1 . 1 164 164 ASN HD22 H 1 9.125 0.000 . . . . . . A 164 ASN HD22 . 34365 1 1194 . 1 . 1 164 164 ASN C C 13 173.075 0.098 . . . . . . A 164 ASN C . 34365 1 1195 . 1 . 1 164 164 ASN CA C 13 54.256 0.064 . . . . . . A 164 ASN CA . 34365 1 1196 . 1 . 1 164 164 ASN CB C 13 44.433 0.090 . . . . . . A 164 ASN CB . 34365 1 1197 . 1 . 1 164 164 ASN CG C 13 179.988 0.032 . . . . . . A 164 ASN CG . 34365 1 1198 . 1 . 1 164 164 ASN N N 15 121.362 0.156 . . . . . . A 164 ASN N . 34365 1 1199 . 1 . 1 164 164 ASN ND2 N 15 121.709 0.061 . . . . . . A 164 ASN ND2 . 34365 1 1200 . 1 . 1 165 165 SER H H 1 8.299 0.035 . . . . . . A 165 SER H . 34365 1 1201 . 1 . 1 165 165 SER HA H 1 5.357 0.047 . . . . . . A 165 SER HA . 34365 1 1202 . 1 . 1 165 165 SER HB2 H 1 3.527 0.025 . . . . . . A 165 SER HB2 . 34365 1 1203 . 1 . 1 165 165 SER HB3 H 1 3.527 0.025 . . . . . . A 165 SER HB3 . 34365 1 1204 . 1 . 1 165 165 SER C C 13 173.027 0.077 . . . . . . A 165 SER C . 34365 1 1205 . 1 . 1 165 165 SER CA C 13 56.643 0.071 . . . . . . A 165 SER CA . 34365 1 1206 . 1 . 1 165 165 SER CB C 13 66.681 0.067 . . . . . . A 165 SER CB . 34365 1 1207 . 1 . 1 165 165 SER N N 15 118.523 0.140 . . . . . . A 165 SER N . 34365 1 1208 . 1 . 1 166 166 ASP H H 1 8.947 0.023 . . . . . . A 166 ASP H . 34365 1 1209 . 1 . 1 166 166 ASP HA H 1 4.980 0.038 . . . . . . A 166 ASP HA . 34365 1 1210 . 1 . 1 166 166 ASP HB2 H 1 2.087 0.031 . . . . . . A 166 ASP HB2 . 34365 1 1211 . 1 . 1 166 166 ASP HB3 H 1 2.567 0.030 . . . . . . A 166 ASP HB3 . 34365 1 1212 . 1 . 1 166 166 ASP C C 13 172.178 0.105 . . . . . . A 166 ASP C . 34365 1 1213 . 1 . 1 166 166 ASP CA C 13 54.711 0.078 . . . . . . A 166 ASP CA . 34365 1 1214 . 1 . 1 166 166 ASP CB C 13 46.418 0.061 . . . . . . A 166 ASP CB . 34365 1 1215 . 1 . 1 166 166 ASP N N 15 121.899 0.085 . . . . . . A 166 ASP N . 34365 1 1216 . 1 . 1 167 167 VAL H H 1 9.202 0.036 . . . . . . A 167 VAL H . 34365 1 1217 . 1 . 1 167 167 VAL HA H 1 5.287 0.015 . . . . . . A 167 VAL HA . 34365 1 1218 . 1 . 1 167 167 VAL HB H 1 1.631 0.024 . . . . . . A 167 VAL HB . 34365 1 1219 . 1 . 1 167 167 VAL HG11 H 1 0.620 0.001 . . . . . . A 167 VAL HG11 . 34365 1 1220 . 1 . 1 167 167 VAL HG12 H 1 0.620 0.001 . . . . . . A 167 VAL HG12 . 34365 1 1221 . 1 . 1 167 167 VAL HG13 H 1 0.620 0.001 . . . . . . A 167 VAL HG13 . 34365 1 1222 . 1 . 1 167 167 VAL HG21 H 1 0.746 0.013 . . . . . . A 167 VAL HG21 . 34365 1 1223 . 1 . 1 167 167 VAL HG22 H 1 0.746 0.013 . . . . . . A 167 VAL HG22 . 34365 1 1224 . 1 . 1 167 167 VAL HG23 H 1 0.746 0.013 . . . . . . A 167 VAL HG23 . 34365 1 1225 . 1 . 1 167 167 VAL C C 13 173.989 0.062 . . . . . . A 167 VAL C . 34365 1 1226 . 1 . 1 167 167 VAL CA C 13 59.253 0.080 . . . . . . A 167 VAL CA . 34365 1 1227 . 1 . 1 167 167 VAL CB C 13 34.947 0.091 . . . . . . A 167 VAL CB . 34365 1 1228 . 1 . 1 167 167 VAL CG1 C 13 22.944 0.003 . . . . . . A 167 VAL CG1 . 34365 1 1229 . 1 . 1 167 167 VAL CG2 C 13 22.298 0.080 . . . . . . A 167 VAL CG2 . 34365 1 1230 . 1 . 1 167 167 VAL N N 15 118.822 0.086 . . . . . . A 167 VAL N . 34365 1 1231 . 1 . 1 168 168 ARG H H 1 8.486 0.029 . . . . . . A 168 ARG H . 34365 1 1232 . 1 . 1 168 168 ARG HA H 1 5.249 0.024 . . . . . . A 168 ARG HA . 34365 1 1233 . 1 . 1 168 168 ARG HB2 H 1 0.755 0.049 . . . . . . A 168 ARG HB2 . 34365 1 1234 . 1 . 1 168 168 ARG HB3 H 1 1.045 0.021 . . . . . . A 168 ARG HB3 . 34365 1 1235 . 1 . 1 168 168 ARG HG2 H 1 0.774 0.000 . . . . . . A 168 ARG HG2 . 34365 1 1236 . 1 . 1 168 168 ARG HG3 H 1 1.692 0.000 . . . . . . A 168 ARG HG3 . 34365 1 1237 . 1 . 1 168 168 ARG HD2 H 1 1.320 0.025 . . . . . . A 168 ARG HD2 . 34365 1 1238 . 1 . 1 168 168 ARG HD3 H 1 1.965 0.006 . . . . . . A 168 ARG HD3 . 34365 1 1239 . 1 . 1 168 168 ARG HE H 1 7.943 0.027 . . . . . . A 168 ARG HE . 34365 1 1240 . 1 . 1 168 168 ARG C C 13 174.819 0.113 . . . . . . A 168 ARG C . 34365 1 1241 . 1 . 1 168 168 ARG CA C 13 53.033 0.078 . . . . . . A 168 ARG CA . 34365 1 1242 . 1 . 1 168 168 ARG CB C 13 34.496 0.104 . . . . . . A 168 ARG CB . 34365 1 1243 . 1 . 1 168 168 ARG CG C 13 28.382 0.059 . . . . . . A 168 ARG CG . 34365 1 1244 . 1 . 1 168 168 ARG CD C 13 42.927 0.073 . . . . . . A 168 ARG CD . 34365 1 1245 . 1 . 1 168 168 ARG N N 15 122.853 0.069 . . . . . . A 168 ARG N . 34365 1 1246 . 1 . 1 168 168 ARG NE N 15 93.194 0.051 . . . . . . A 168 ARG NE . 34365 1 1247 . 1 . 1 169 169 TYR H H 1 8.481 0.025 . . . . . . A 169 TYR H . 34365 1 1248 . 1 . 1 169 169 TYR HA H 1 5.382 0.020 . . . . . . A 169 TYR HA . 34365 1 1249 . 1 . 1 169 169 TYR HB2 H 1 2.372 0.015 . . . . . . A 169 TYR HB2 . 34365 1 1250 . 1 . 1 169 169 TYR HB3 H 1 2.708 0.018 . . . . . . A 169 TYR HB3 . 34365 1 1251 . 1 . 1 169 169 TYR C C 13 174.406 0.040 . . . . . . A 169 TYR C . 34365 1 1252 . 1 . 1 169 169 TYR CA C 13 54.623 0.058 . . . . . . A 169 TYR CA . 34365 1 1253 . 1 . 1 169 169 TYR CB C 13 43.091 0.045 . . . . . . A 169 TYR CB . 34365 1 1254 . 1 . 1 169 169 TYR N N 15 121.964 0.056 . . . . . . A 169 TYR N . 34365 1 1255 . 1 . 1 171 171 PRO HA H 1 4.462 0.012 . . . . . . A 171 PRO HA . 34365 1 1256 . 1 . 1 171 171 PRO HB2 H 1 1.521 0.005 . . . . . . A 171 PRO HB2 . 34365 1 1257 . 1 . 1 171 171 PRO HB3 H 1 1.751 0.034 . . . . . . A 171 PRO HB3 . 34365 1 1258 . 1 . 1 171 171 PRO HG2 H 1 2.014 0.000 . . . . . . A 171 PRO HG2 . 34365 1 1259 . 1 . 1 171 171 PRO HG3 H 1 1.544 0.000 . . . . . . A 171 PRO HG3 . 34365 1 1260 . 1 . 1 171 171 PRO C C 13 177.287 0.081 . . . . . . A 171 PRO C . 34365 1 1261 . 1 . 1 171 171 PRO CA C 13 62.293 0.074 . . . . . . A 171 PRO CA . 34365 1 1262 . 1 . 1 171 171 PRO CB C 13 31.870 0.084 . . . . . . A 171 PRO CB . 34365 1 1263 . 1 . 1 171 171 PRO CG C 13 26.639 0.221 . . . . . . A 171 PRO CG . 34365 1 1264 . 1 . 1 171 171 PRO CD C 13 49.926 0.084 . . . . . . A 171 PRO CD . 34365 1 1265 . 1 . 1 172 172 PHE H H 1 8.158 0.028 . . . . . . A 172 PHE H . 34365 1 1266 . 1 . 1 172 172 PHE HA H 1 4.976 0.018 . . . . . . A 172 PHE HA . 34365 1 1267 . 1 . 1 172 172 PHE HB2 H 1 2.656 0.023 . . . . . . A 172 PHE HB2 . 34365 1 1268 . 1 . 1 172 172 PHE HB3 H 1 2.463 0.026 . . . . . . A 172 PHE HB3 . 34365 1 1269 . 1 . 1 172 172 PHE C C 13 171.810 0.099 . . . . . . A 172 PHE C . 34365 1 1270 . 1 . 1 172 172 PHE CA C 13 56.032 0.096 . . . . . . A 172 PHE CA . 34365 1 1271 . 1 . 1 172 172 PHE CB C 13 41.233 0.068 . . . . . . A 172 PHE CB . 34365 1 1272 . 1 . 1 172 172 PHE N N 15 113.845 0.162 . . . . . . A 172 PHE N . 34365 1 1273 . 1 . 1 173 173 LYS H H 1 8.107 0.019 . . . . . . A 173 LYS H . 34365 1 1274 . 1 . 1 173 173 LYS HA H 1 5.295 0.018 . . . . . . A 173 LYS HA . 34365 1 1275 . 1 . 1 173 173 LYS HB2 H 1 1.626 0.023 . . . . . . A 173 LYS HB2 . 34365 1 1276 . 1 . 1 173 173 LYS HB3 H 1 1.488 0.013 . . . . . . A 173 LYS HB3 . 34365 1 1277 . 1 . 1 173 173 LYS HG2 H 1 1.170 0.026 . . . . . . A 173 LYS HG2 . 34365 1 1278 . 1 . 1 173 173 LYS HG3 H 1 1.085 0.023 . . . . . . A 173 LYS HG3 . 34365 1 1279 . 1 . 1 173 173 LYS C C 13 175.776 0.057 . . . . . . A 173 LYS C . 34365 1 1280 . 1 . 1 173 173 LYS CA C 13 54.287 0.065 . . . . . . A 173 LYS CA . 34365 1 1281 . 1 . 1 173 173 LYS CB C 13 35.484 0.083 . . . . . . A 173 LYS CB . 34365 1 1282 . 1 . 1 173 173 LYS CG C 13 24.855 0.056 . . . . . . A 173 LYS CG . 34365 1 1283 . 1 . 1 173 173 LYS CD C 13 29.779 0.054 . . . . . . A 173 LYS CD . 34365 1 1284 . 1 . 1 173 173 LYS CE C 13 41.995 0.032 . . . . . . A 173 LYS CE . 34365 1 1285 . 1 . 1 173 173 LYS N N 15 120.148 0.138 . . . . . . A 173 LYS N . 34365 1 1286 . 1 . 1 174 174 THR H H 1 8.593 0.022 . . . . . . A 174 THR H . 34365 1 1287 . 1 . 1 174 174 THR HA H 1 4.890 0.018 . . . . . . A 174 THR HA . 34365 1 1288 . 1 . 1 174 174 THR HB H 1 4.009 0.030 . . . . . . A 174 THR HB . 34365 1 1289 . 1 . 1 174 174 THR HG21 H 1 0.970 0.044 . . . . . . A 174 THR HG21 . 34365 1 1290 . 1 . 1 174 174 THR HG22 H 1 0.970 0.044 . . . . . . A 174 THR HG22 . 34365 1 1291 . 1 . 1 174 174 THR HG23 H 1 0.970 0.044 . . . . . . A 174 THR HG23 . 34365 1 1292 . 1 . 1 174 174 THR C C 13 171.378 0.057 . . . . . . A 174 THR C . 34365 1 1293 . 1 . 1 174 174 THR CA C 13 58.968 0.070 . . . . . . A 174 THR CA . 34365 1 1294 . 1 . 1 174 174 THR CB C 13 69.921 0.064 . . . . . . A 174 THR CB . 34365 1 1295 . 1 . 1 174 174 THR CG2 C 13 21.236 0.104 . . . . . . A 174 THR CG2 . 34365 1 1296 . 1 . 1 174 174 THR N N 15 116.477 0.152 . . . . . . A 174 THR N . 34365 1 1297 . 1 . 1 175 175 ASP H H 1 7.531 0.040 . . . . . . A 175 ASP H . 34365 1 1298 . 1 . 1 175 175 ASP HA H 1 5.009 0.004 . . . . . . A 175 ASP HA . 34365 1 1299 . 1 . 1 175 175 ASP HB2 H 1 2.436 0.006 . . . . . . A 175 ASP HB2 . 34365 1 1300 . 1 . 1 175 175 ASP HB3 H 1 2.074 0.019 . . . . . . A 175 ASP HB3 . 34365 1 1301 . 1 . 1 175 175 ASP C C 13 174.738 0.033 . . . . . . A 175 ASP C . 34365 1 1302 . 1 . 1 175 175 ASP CA C 13 54.336 0.079 . . . . . . A 175 ASP CA . 34365 1 1303 . 1 . 1 175 175 ASP CB C 13 44.068 0.051 . . . . . . A 175 ASP CB . 34365 1 1304 . 1 . 1 175 175 ASP N N 15 123.264 0.140 . . . . . . A 175 ASP N . 34365 1 1305 . 1 . 1 176 176 VAL H H 1 8.352 0.051 . . . . . . A 176 VAL H . 34365 1 1306 . 1 . 1 176 176 VAL HA H 1 4.593 0.011 . . . . . . A 176 VAL HA . 34365 1 1307 . 1 . 1 176 176 VAL HB H 1 1.593 0.007 . . . . . . A 176 VAL HB . 34365 1 1308 . 1 . 1 176 176 VAL HG11 H 1 0.565 0.012 . . . . . . A 176 VAL HG11 . 34365 1 1309 . 1 . 1 176 176 VAL HG12 H 1 0.565 0.012 . . . . . . A 176 VAL HG12 . 34365 1 1310 . 1 . 1 176 176 VAL HG13 H 1 0.565 0.012 . . . . . . A 176 VAL HG13 . 34365 1 1311 . 1 . 1 176 176 VAL HG21 H 1 0.487 0.015 . . . . . . A 176 VAL HG21 . 34365 1 1312 . 1 . 1 176 176 VAL HG22 H 1 0.487 0.015 . . . . . . A 176 VAL HG22 . 34365 1 1313 . 1 . 1 176 176 VAL HG23 H 1 0.487 0.015 . . . . . . A 176 VAL HG23 . 34365 1 1314 . 1 . 1 176 176 VAL C C 13 174.829 0.064 . . . . . . A 176 VAL C . 34365 1 1315 . 1 . 1 176 176 VAL CA C 13 60.465 0.123 . . . . . . A 176 VAL CA . 34365 1 1316 . 1 . 1 176 176 VAL CB C 13 34.992 0.089 . . . . . . A 176 VAL CB . 34365 1 1317 . 1 . 1 176 176 VAL CG1 C 13 21.306 0.167 . . . . . . A 176 VAL CG1 . 34365 1 1318 . 1 . 1 176 176 VAL CG2 C 13 20.925 0.063 . . . . . . A 176 VAL CG2 . 34365 1 1319 . 1 . 1 176 176 VAL N N 15 121.697 0.168 . . . . . . A 176 VAL N . 34365 1 1320 . 1 . 1 177 177 THR H H 1 8.184 0.022 . . . . . . A 177 THR H . 34365 1 1321 . 1 . 1 177 177 THR HA H 1 4.956 0.018 . . . . . . A 177 THR HA . 34365 1 1322 . 1 . 1 177 177 THR HB H 1 4.203 0.028 . . . . . . A 177 THR HB . 34365 1 1323 . 1 . 1 177 177 THR HG21 H 1 0.998 0.035 . . . . . . A 177 THR HG21 . 34365 1 1324 . 1 . 1 177 177 THR HG22 H 1 0.998 0.035 . . . . . . A 177 THR HG22 . 34365 1 1325 . 1 . 1 177 177 THR HG23 H 1 0.998 0.035 . . . . . . A 177 THR HG23 . 34365 1 1326 . 1 . 1 177 177 THR C C 13 172.554 0.101 . . . . . . A 177 THR C . 34365 1 1327 . 1 . 1 177 177 THR CA C 13 58.931 0.073 . . . . . . A 177 THR CA . 34365 1 1328 . 1 . 1 177 177 THR CB C 13 73.177 0.062 . . . . . . A 177 THR CB . 34365 1 1329 . 1 . 1 177 177 THR CG2 C 13 22.218 0.091 . . . . . . A 177 THR CG2 . 34365 1 1330 . 1 . 1 177 177 THR N N 15 115.999 0.138 . . . . . . A 177 THR N . 34365 1 1331 . 1 . 1 178 178 GLY H H 1 7.744 0.033 . . . . . . A 178 GLY H . 34365 1 1332 . 1 . 1 178 178 GLY HA2 H 1 3.775 0.027 . . . . . . A 178 GLY HA2 . 34365 1 1333 . 1 . 1 178 178 GLY HA3 H 1 4.049 0.019 . . . . . . A 178 GLY HA3 . 34365 1 1334 . 1 . 1 178 178 GLY C C 13 172.027 0.092 . . . . . . A 178 GLY C . 34365 1 1335 . 1 . 1 178 178 GLY CA C 13 45.754 0.096 . . . . . . A 178 GLY CA . 34365 1 1336 . 1 . 1 178 178 GLY N N 15 103.141 0.087 . . . . . . A 178 GLY N . 34365 1 1337 . 1 . 1 179 179 THR H H 1 9.264 0.022 . . . . . . A 179 THR H . 34365 1 1338 . 1 . 1 179 179 THR HA H 1 4.998 0.026 . . . . . . A 179 THR HA . 34365 1 1339 . 1 . 1 179 179 THR HB H 1 3.793 0.019 . . . . . . A 179 THR HB . 34365 1 1340 . 1 . 1 179 179 THR HG21 H 1 0.768 0.019 . . . . . . A 179 THR HG21 . 34365 1 1341 . 1 . 1 179 179 THR HG22 H 1 0.768 0.019 . . . . . . A 179 THR HG22 . 34365 1 1342 . 1 . 1 179 179 THR HG23 H 1 0.768 0.019 . . . . . . A 179 THR HG23 . 34365 1 1343 . 1 . 1 179 179 THR C C 13 172.558 0.126 . . . . . . A 179 THR C . 34365 1 1344 . 1 . 1 179 179 THR CA C 13 60.007 0.091 . . . . . . A 179 THR CA . 34365 1 1345 . 1 . 1 179 179 THR CB C 13 71.374 0.086 . . . . . . A 179 THR CB . 34365 1 1346 . 1 . 1 179 179 THR CG2 C 13 21.206 0.075 . . . . . . A 179 THR CG2 . 34365 1 1347 . 1 . 1 179 179 THR N N 15 114.542 0.111 . . . . . . A 179 THR N . 34365 1 1348 . 1 . 1 180 180 LEU H H 1 8.874 0.020 . . . . . . A 180 LEU H . 34365 1 1349 . 1 . 1 180 180 LEU HA H 1 4.703 0.023 . . . . . . A 180 LEU HA . 34365 1 1350 . 1 . 1 180 180 LEU HB2 H 1 1.184 0.037 . . . . . . A 180 LEU HB2 . 34365 1 1351 . 1 . 1 180 180 LEU HB3 H 1 1.397 0.008 . . . . . . A 180 LEU HB3 . 34365 1 1352 . 1 . 1 180 180 LEU HG H 1 1.429 0.000 . . . . . . A 180 LEU HG . 34365 1 1353 . 1 . 1 180 180 LEU C C 13 176.526 0.141 . . . . . . A 180 LEU C . 34365 1 1354 . 1 . 1 180 180 LEU CA C 13 52.385 0.089 . . . . . . A 180 LEU CA . 34365 1 1355 . 1 . 1 180 180 LEU CB C 13 42.233 0.120 . . . . . . A 180 LEU CB . 34365 1 1356 . 1 . 1 180 180 LEU CG C 13 27.040 0.064 . . . . . . A 180 LEU CG . 34365 1 1357 . 1 . 1 180 180 LEU N N 15 126.022 0.159 . . . . . . A 180 LEU N . 34365 1 1358 . 1 . 1 181 181 GLY H H 1 8.819 0.044 . . . . . . A 181 GLY H . 34365 1 1359 . 1 . 1 181 181 GLY HA2 H 1 3.395 0.007 . . . . . . A 181 GLY HA2 . 34365 1 1360 . 1 . 1 181 181 GLY HA3 H 1 4.110 0.024 . . . . . . A 181 GLY HA3 . 34365 1 1361 . 1 . 1 181 181 GLY C C 13 173.804 0.078 . . . . . . A 181 GLY C . 34365 1 1362 . 1 . 1 181 181 GLY CA C 13 44.861 0.101 . . . . . . A 181 GLY CA . 34365 1 1363 . 1 . 1 181 181 GLY N N 15 115.445 0.119 . . . . . . A 181 GLY N . 34365 1 1364 . 1 . 1 182 182 PRO HA H 1 4.498 0.037 . . . . . . A 182 PRO HA . 34365 1 1365 . 1 . 1 182 182 PRO HB2 H 1 1.817 0.016 . . . . . . A 182 PRO HB2 . 34365 1 1366 . 1 . 1 182 182 PRO HB3 H 1 2.140 0.024 . . . . . . A 182 PRO HB3 . 34365 1 1367 . 1 . 1 182 182 PRO HG2 H 1 1.633 0.004 . . . . . . A 182 PRO HG2 . 34365 1 1368 . 1 . 1 182 182 PRO HG3 H 1 1.942 0.003 . . . . . . A 182 PRO HG3 . 34365 1 1369 . 1 . 1 182 182 PRO C C 13 176.060 0.079 . . . . . . A 182 PRO C . 34365 1 1370 . 1 . 1 182 182 PRO CA C 13 63.229 0.197 . . . . . . A 182 PRO CA . 34365 1 1371 . 1 . 1 182 182 PRO CB C 13 32.478 0.094 . . . . . . A 182 PRO CB . 34365 1 1372 . 1 . 1 182 182 PRO CG C 13 26.301 0.083 . . . . . . A 182 PRO CG . 34365 1 1373 . 1 . 1 182 182 PRO CD C 13 49.582 0.042 . . . . . . A 182 PRO CD . 34365 1 1374 . 1 . 1 183 183 VAL H H 1 8.550 0.030 . . . . . . A 183 VAL H . 34365 1 1375 . 1 . 1 183 183 VAL HA H 1 5.042 0.016 . . . . . . A 183 VAL HA . 34365 1 1376 . 1 . 1 183 183 VAL HB H 1 1.564 0.000 . . . . . . A 183 VAL HB . 34365 1 1377 . 1 . 1 183 183 VAL C C 13 172.942 0.191 . . . . . . A 183 VAL C . 34365 1 1378 . 1 . 1 183 183 VAL CA C 13 60.350 0.087 . . . . . . A 183 VAL CA . 34365 1 1379 . 1 . 1 183 183 VAL CB C 13 35.059 0.078 . . . . . . A 183 VAL CB . 34365 1 1380 . 1 . 1 183 183 VAL N N 15 121.932 0.078 . . . . . . A 183 VAL N . 34365 1 1381 . 1 . 1 184 184 PRO HA H 1 4.450 0.031 . . . . . . A 184 PRO HA . 34365 1 1382 . 1 . 1 184 184 PRO HB2 H 1 1.800 0.006 . . . . . . A 184 PRO HB2 . 34365 1 1383 . 1 . 1 184 184 PRO HB3 H 1 2.175 0.007 . . . . . . A 184 PRO HB3 . 34365 1 1384 . 1 . 1 184 184 PRO HG2 H 1 1.879 0.050 . . . . . . A 184 PRO HG2 . 34365 1 1385 . 1 . 1 184 184 PRO HG3 H 1 1.931 0.000 . . . . . . A 184 PRO HG3 . 34365 1 1386 . 1 . 1 184 184 PRO HD2 H 1 3.671 0.009 . . . . . . A 184 PRO HD2 . 34365 1 1387 . 1 . 1 184 184 PRO HD3 H 1 3.958 0.000 . . . . . . A 184 PRO HD3 . 34365 1 1388 . 1 . 1 184 184 PRO C C 13 176.025 0.031 . . . . . . A 184 PRO C . 34365 1 1389 . 1 . 1 184 184 PRO CA C 13 63.472 0.108 . . . . . . A 184 PRO CA . 34365 1 1390 . 1 . 1 184 184 PRO CB C 13 32.589 0.051 . . . . . . A 184 PRO CB . 34365 1 1391 . 1 . 1 184 184 PRO CG C 13 27.683 0.058 . . . . . . A 184 PRO CG . 34365 1 1392 . 1 . 1 184 184 PRO CD C 13 51.207 0.070 . . . . . . A 184 PRO CD . 34365 1 1393 . 1 . 1 185 185 VAL H H 1 8.593 0.035 . . . . . . A 185 VAL H . 34365 1 1394 . 1 . 1 185 185 VAL HA H 1 4.852 0.010 . . . . . . A 185 VAL HA . 34365 1 1395 . 1 . 1 185 185 VAL HB H 1 1.420 0.009 . . . . . . A 185 VAL HB . 34365 1 1396 . 1 . 1 185 185 VAL HG11 H 1 0.709 0.007 . . . . . . A 185 VAL HG11 . 34365 1 1397 . 1 . 1 185 185 VAL HG12 H 1 0.709 0.007 . . . . . . A 185 VAL HG12 . 34365 1 1398 . 1 . 1 185 185 VAL HG13 H 1 0.709 0.007 . . . . . . A 185 VAL HG13 . 34365 1 1399 . 1 . 1 185 185 VAL C C 13 175.464 0.045 . . . . . . A 185 VAL C . 34365 1 1400 . 1 . 1 185 185 VAL CA C 13 60.442 0.069 . . . . . . A 185 VAL CA . 34365 1 1401 . 1 . 1 185 185 VAL CB C 13 35.087 0.130 . . . . . . A 185 VAL CB . 34365 1 1402 . 1 . 1 185 185 VAL CG1 C 13 21.187 0.045 . . . . . . A 185 VAL CG1 . 34365 1 1403 . 1 . 1 185 185 VAL N N 15 121.934 0.087 . . . . . . A 185 VAL N . 34365 1 1404 . 1 . 1 186 186 SER H H 1 8.653 0.025 . . . . . . A 186 SER H . 34365 1 1405 . 1 . 1 186 186 SER HA H 1 5.102 0.022 . . . . . . A 186 SER HA . 34365 1 1406 . 1 . 1 186 186 SER HB2 H 1 3.749 0.015 . . . . . . A 186 SER HB2 . 34365 1 1407 . 1 . 1 186 186 SER HB3 H 1 3.776 0.017 . . . . . . A 186 SER HB3 . 34365 1 1408 . 1 . 1 186 186 SER C C 13 172.709 0.028 . . . . . . A 186 SER C . 34365 1 1409 . 1 . 1 186 186 SER CA C 13 57.108 0.076 . . . . . . A 186 SER CA . 34365 1 1410 . 1 . 1 186 186 SER CB C 13 65.767 0.109 . . . . . . A 186 SER CB . 34365 1 1411 . 1 . 1 186 186 SER N N 15 119.694 0.155 . . . . . . A 186 SER N . 34365 1 1412 . 1 . 1 187 187 THR H H 1 8.803 0.022 . . . . . . A 187 THR H . 34365 1 1413 . 1 . 1 187 187 THR HA H 1 4.720 0.019 . . . . . . A 187 THR HA . 34365 1 1414 . 1 . 1 187 187 THR HB H 1 4.078 0.039 . . . . . . A 187 THR HB . 34365 1 1415 . 1 . 1 187 187 THR HG21 H 1 0.565 0.043 . . . . . . A 187 THR HG21 . 34365 1 1416 . 1 . 1 187 187 THR HG22 H 1 0.565 0.043 . . . . . . A 187 THR HG22 . 34365 1 1417 . 1 . 1 187 187 THR HG23 H 1 0.565 0.043 . . . . . . A 187 THR HG23 . 34365 1 1418 . 1 . 1 187 187 THR C C 13 171.769 0.043 . . . . . . A 187 THR C . 34365 1 1419 . 1 . 1 187 187 THR CA C 13 60.392 0.109 . . . . . . A 187 THR CA . 34365 1 1420 . 1 . 1 187 187 THR CB C 13 68.694 0.157 . . . . . . A 187 THR CB . 34365 1 1421 . 1 . 1 187 187 THR CG2 C 13 17.771 0.228 . . . . . . A 187 THR CG2 . 34365 1 1422 . 1 . 1 187 187 THR N N 15 117.653 0.153 . . . . . . A 187 THR N . 34365 1 1423 . 1 . 1 188 188 LYS H H 1 8.349 0.044 . . . . . . A 188 LYS H . 34365 1 1424 . 1 . 1 188 188 LYS HA H 1 5.211 0.020 . . . . . . A 188 LYS HA . 34365 1 1425 . 1 . 1 188 188 LYS HB2 H 1 1.453 0.013 . . . . . . A 188 LYS HB2 . 34365 1 1426 . 1 . 1 188 188 LYS HB3 H 1 1.571 0.018 . . . . . . A 188 LYS HB3 . 34365 1 1427 . 1 . 1 188 188 LYS HG2 H 1 1.408 0.022 . . . . . . A 188 LYS HG2 . 34365 1 1428 . 1 . 1 188 188 LYS HG3 H 1 1.206 0.022 . . . . . . A 188 LYS HG3 . 34365 1 1429 . 1 . 1 188 188 LYS HD2 H 1 1.418 0.024 . . . . . . A 188 LYS HD2 . 34365 1 1430 . 1 . 1 188 188 LYS HD3 H 1 1.595 0.000 . . . . . . A 188 LYS HD3 . 34365 1 1431 . 1 . 1 188 188 LYS HE2 H 1 2.753 0.023 . . . . . . A 188 LYS HE2 . 34365 1 1432 . 1 . 1 188 188 LYS HE3 H 1 2.804 0.074 . . . . . . A 188 LYS HE3 . 34365 1 1433 . 1 . 1 188 188 LYS C C 13 174.588 0.206 . . . . . . A 188 LYS C . 34365 1 1434 . 1 . 1 188 188 LYS CA C 13 54.882 0.122 . . . . . . A 188 LYS CA . 34365 1 1435 . 1 . 1 188 188 LYS CB C 13 36.189 0.055 . . . . . . A 188 LYS CB . 34365 1 1436 . 1 . 1 188 188 LYS CG C 13 24.989 0.076 . . . . . . A 188 LYS CG . 34365 1 1437 . 1 . 1 188 188 LYS CD C 13 29.555 0.094 . . . . . . A 188 LYS CD . 34365 1 1438 . 1 . 1 188 188 LYS CE C 13 42.022 0.082 . . . . . . A 188 LYS CE . 34365 1 1439 . 1 . 1 188 188 LYS N N 15 124.152 0.210 . . . . . . A 188 LYS N . 34365 1 1440 . 1 . 1 189 189 ILE H H 1 8.822 0.045 . . . . . . A 189 ILE H . 34365 1 1441 . 1 . 1 189 189 ILE HA H 1 4.728 0.044 . . . . . . A 189 ILE HA . 34365 1 1442 . 1 . 1 189 189 ILE C C 13 172.603 0.145 . . . . . . A 189 ILE C . 34365 1 1443 . 1 . 1 189 189 ILE CA C 13 58.909 0.067 . . . . . . A 189 ILE CA . 34365 1 1444 . 1 . 1 189 189 ILE N N 15 120.118 0.129 . . . . . . A 189 ILE N . 34365 1 1445 . 1 . 1 190 190 GLU H H 1 8.501 0.058 . . . . . . A 190 GLU H . 34365 1 1446 . 1 . 1 190 190 GLU HA H 1 4.363 0.035 . . . . . . A 190 GLU HA . 34365 1 1447 . 1 . 1 190 190 GLU HB2 H 1 1.802 0.000 . . . . . . A 190 GLU HB2 . 34365 1 1448 . 1 . 1 190 190 GLU HB3 H 1 2.030 0.000 . . . . . . A 190 GLU HB3 . 34365 1 1449 . 1 . 1 190 190 GLU C C 13 174.720 0.113 . . . . . . A 190 GLU C . 34365 1 1450 . 1 . 1 190 190 GLU CA C 13 55.210 0.122 . . . . . . A 190 GLU CA . 34365 1 1451 . 1 . 1 190 190 GLU CB C 13 30.590 0.058 . . . . . . A 190 GLU CB . 34365 1 1452 . 1 . 1 190 190 GLU N N 15 128.107 0.281 . . . . . . A 190 GLU N . 34365 1 1453 . 1 . 1 191 191 VAL H H 1 8.630 0.023 . . . . . . A 191 VAL H . 34365 1 1454 . 1 . 1 191 191 VAL HA H 1 4.129 0.041 . . . . . . A 191 VAL HA . 34365 1 1455 . 1 . 1 191 191 VAL HB H 1 0.233 0.024 . . . . . . A 191 VAL HB . 34365 1 1456 . 1 . 1 191 191 VAL HG11 H 1 0.573 0.004 . . . . . . A 191 VAL HG11 . 34365 1 1457 . 1 . 1 191 191 VAL HG12 H 1 0.573 0.004 . . . . . . A 191 VAL HG12 . 34365 1 1458 . 1 . 1 191 191 VAL HG13 H 1 0.573 0.004 . . . . . . A 191 VAL HG13 . 34365 1 1459 . 1 . 1 191 191 VAL HG21 H 1 0.791 0.000 . . . . . . A 191 VAL HG21 . 34365 1 1460 . 1 . 1 191 191 VAL HG22 H 1 0.791 0.000 . . . . . . A 191 VAL HG22 . 34365 1 1461 . 1 . 1 191 191 VAL HG23 H 1 0.791 0.000 . . . . . . A 191 VAL HG23 . 34365 1 1462 . 1 . 1 191 191 VAL C C 13 173.440 0.052 . . . . . . A 191 VAL C . 34365 1 1463 . 1 . 1 191 191 VAL CA C 13 61.010 0.106 . . . . . . A 191 VAL CA . 34365 1 1464 . 1 . 1 191 191 VAL CB C 13 32.908 0.155 . . . . . . A 191 VAL CB . 34365 1 1465 . 1 . 1 191 191 VAL CG1 C 13 21.124 0.029 . . . . . . A 191 VAL CG1 . 34365 1 1466 . 1 . 1 191 191 VAL CG2 C 13 21.592 0.020 . . . . . . A 191 VAL CG2 . 34365 1 1467 . 1 . 1 191 191 VAL N N 15 126.076 0.151 . . . . . . A 191 VAL N . 34365 1 1468 . 1 . 1 193 193 PRO HA H 1 5.355 0.020 . . . . . . A 193 PRO HA . 34365 1 1469 . 1 . 1 193 193 PRO HB2 H 1 1.586 0.054 . . . . . . A 193 PRO HB2 . 34365 1 1470 . 1 . 1 193 193 PRO HB3 H 1 1.697 0.009 . . . . . . A 193 PRO HB3 . 34365 1 1471 . 1 . 1 193 193 PRO HG2 H 1 1.282 0.060 . . . . . . A 193 PRO HG2 . 34365 1 1472 . 1 . 1 193 193 PRO HG3 H 1 1.897 0.043 . . . . . . A 193 PRO HG3 . 34365 1 1473 . 1 . 1 193 193 PRO HD2 H 1 1.151 0.049 . . . . . . A 193 PRO HD2 . 34365 1 1474 . 1 . 1 193 193 PRO HD3 H 1 3.515 0.005 . . . . . . A 193 PRO HD3 . 34365 1 1475 . 1 . 1 193 193 PRO C C 13 175.125 0.003 . . . . . . A 193 PRO C . 34365 1 1476 . 1 . 1 193 193 PRO CA C 13 61.165 0.070 . . . . . . A 193 PRO CA . 34365 1 1477 . 1 . 1 193 193 PRO CB C 13 30.347 0.135 . . . . . . A 193 PRO CB . 34365 1 1478 . 1 . 1 193 193 PRO CG C 13 27.181 0.127 . . . . . . A 193 PRO CG . 34365 1 1479 . 1 . 1 193 193 PRO CD C 13 47.346 0.087 . . . . . . A 193 PRO CD . 34365 1 1480 . 1 . 1 194 194 PHE H H 1 9.236 0.035 . . . . . . A 194 PHE H . 34365 1 1481 . 1 . 1 194 194 PHE HA H 1 5.392 0.028 . . . . . . A 194 PHE HA . 34365 1 1482 . 1 . 1 194 194 PHE HB2 H 1 2.502 0.004 . . . . . . A 194 PHE HB2 . 34365 1 1483 . 1 . 1 194 194 PHE HB3 H 1 2.782 0.003 . . . . . . A 194 PHE HB3 . 34365 1 1484 . 1 . 1 194 194 PHE C C 13 174.909 0.115 . . . . . . A 194 PHE C . 34365 1 1485 . 1 . 1 194 194 PHE CA C 13 55.980 0.075 . . . . . . A 194 PHE CA . 34365 1 1486 . 1 . 1 194 194 PHE CB C 13 41.634 0.098 . . . . . . A 194 PHE CB . 34365 1 1487 . 1 . 1 194 194 PHE N N 15 122.731 0.110 . . . . . . A 194 PHE N . 34365 1 1488 . 1 . 1 195 195 ILE H H 1 9.338 0.022 . . . . . . A 195 ILE H . 34365 1 1489 . 1 . 1 195 195 ILE HA H 1 4.752 0.060 . . . . . . A 195 ILE HA . 34365 1 1490 . 1 . 1 195 195 ILE HB H 1 1.526 0.061 . . . . . . A 195 ILE HB . 34365 1 1491 . 1 . 1 195 195 ILE HG12 H 1 0.693 0.010 . . . . . . A 195 ILE HG12 . 34365 1 1492 . 1 . 1 195 195 ILE HG13 H 1 1.370 0.013 . . . . . . A 195 ILE HG13 . 34365 1 1493 . 1 . 1 195 195 ILE HG21 H 1 0.502 0.015 . . . . . . A 195 ILE HG21 . 34365 1 1494 . 1 . 1 195 195 ILE HG22 H 1 0.502 0.015 . . . . . . A 195 ILE HG22 . 34365 1 1495 . 1 . 1 195 195 ILE HG23 H 1 0.502 0.015 . . . . . . A 195 ILE HG23 . 34365 1 1496 . 1 . 1 195 195 ILE HD11 H 1 0.433 0.005 . . . . . . A 195 ILE HD11 . 34365 1 1497 . 1 . 1 195 195 ILE HD12 H 1 0.433 0.005 . . . . . . A 195 ILE HD12 . 34365 1 1498 . 1 . 1 195 195 ILE HD13 H 1 0.433 0.005 . . . . . . A 195 ILE HD13 . 34365 1 1499 . 1 . 1 195 195 ILE C C 13 175.766 0.054 . . . . . . A 195 ILE C . 34365 1 1500 . 1 . 1 195 195 ILE CA C 13 60.326 0.079 . . . . . . A 195 ILE CA . 34365 1 1501 . 1 . 1 195 195 ILE CB C 13 39.341 0.144 . . . . . . A 195 ILE CB . 34365 1 1502 . 1 . 1 195 195 ILE CG1 C 13 26.974 0.056 . . . . . . A 195 ILE CG1 . 34365 1 1503 . 1 . 1 195 195 ILE CG2 C 13 17.754 0.126 . . . . . . A 195 ILE CG2 . 34365 1 1504 . 1 . 1 195 195 ILE CD1 C 13 13.329 0.081 . . . . . . A 195 ILE CD1 . 34365 1 1505 . 1 . 1 195 195 ILE N N 15 121.796 0.148 . . . . . . A 195 ILE N . 34365 1 1506 . 1 . 1 196 196 LEU H H 1 9.696 0.028 . . . . . . A 196 LEU H . 34365 1 1507 . 1 . 1 196 196 LEU HA H 1 4.947 0.008 . . . . . . A 196 LEU HA . 34365 1 1508 . 1 . 1 196 196 LEU HB2 H 1 2.090 0.000 . . . . . . A 196 LEU HB2 . 34365 1 1509 . 1 . 1 196 196 LEU HB3 H 1 2.494 0.000 . . . . . . A 196 LEU HB3 . 34365 1 1510 . 1 . 1 196 196 LEU C C 13 174.634 0.138 . . . . . . A 196 LEU C . 34365 1 1511 . 1 . 1 196 196 LEU CA C 13 54.440 0.046 . . . . . . A 196 LEU CA . 34365 1 1512 . 1 . 1 196 196 LEU CB C 13 43.727 0.000 . . . . . . A 196 LEU CB . 34365 1 1513 . 1 . 1 196 196 LEU N N 15 134.505 0.065 . . . . . . A 196 LEU N . 34365 1 1514 . 1 . 1 197 197 SER H H 1 9.429 0.022 . . . . . . A 197 SER H . 34365 1 1515 . 1 . 1 197 197 SER HA H 1 5.336 0.031 . . . . . . A 197 SER HA . 34365 1 1516 . 1 . 1 197 197 SER HB2 H 1 2.939 0.004 . . . . . . A 197 SER HB2 . 34365 1 1517 . 1 . 1 197 197 SER HB3 H 1 3.654 0.035 . . . . . . A 197 SER HB3 . 34365 1 1518 . 1 . 1 197 197 SER C C 13 172.070 0.026 . . . . . . A 197 SER C . 34365 1 1519 . 1 . 1 197 197 SER CA C 13 58.700 0.064 . . . . . . A 197 SER CA . 34365 1 1520 . 1 . 1 197 197 SER CB C 13 64.761 0.086 . . . . . . A 197 SER CB . 34365 1 1521 . 1 . 1 197 197 SER N N 15 124.217 0.284 . . . . . . A 197 SER N . 34365 1 1522 . 1 . 1 198 198 LEU H H 1 8.856 0.040 . . . . . . A 198 LEU H . 34365 1 1523 . 1 . 1 198 198 LEU HA H 1 5.137 0.027 . . . . . . A 198 LEU HA . 34365 1 1524 . 1 . 1 198 198 LEU HB2 H 1 1.417 0.032 . . . . . . A 198 LEU HB2 . 34365 1 1525 . 1 . 1 198 198 LEU HB3 H 1 1.704 0.039 . . . . . . A 198 LEU HB3 . 34365 1 1526 . 1 . 1 198 198 LEU C C 13 175.777 0.116 . . . . . . A 198 LEU C . 34365 1 1527 . 1 . 1 198 198 LEU CA C 13 53.529 0.112 . . . . . . A 198 LEU CA . 34365 1 1528 . 1 . 1 198 198 LEU CB C 13 46.700 0.059 . . . . . . A 198 LEU CB . 34365 1 1529 . 1 . 1 198 198 LEU N N 15 124.968 0.088 . . . . . . A 198 LEU N . 34365 1 1530 . 1 . 1 199 199 GLY H H 1 8.802 0.029 . . . . . . A 199 GLY H . 34365 1 1531 . 1 . 1 199 199 GLY HA2 H 1 3.802 0.044 . . . . . . A 199 GLY HA2 . 34365 1 1532 . 1 . 1 199 199 GLY HA3 H 1 4.808 0.053 . . . . . . A 199 GLY HA3 . 34365 1 1533 . 1 . 1 199 199 GLY C C 13 172.261 0.095 . . . . . . A 199 GLY C . 34365 1 1534 . 1 . 1 199 199 GLY CA C 13 47.817 0.101 . . . . . . A 199 GLY CA . 34365 1 1535 . 1 . 1 199 199 GLY N N 15 111.522 0.160 . . . . . . A 199 GLY N . 34365 1 1536 . 1 . 1 200 200 ALA H H 1 8.642 0.033 . . . . . . A 200 ALA H . 34365 1 1537 . 1 . 1 200 200 ALA HA H 1 5.432 0.014 . . . . . . A 200 ALA HA . 34365 1 1538 . 1 . 1 200 200 ALA HB1 H 1 1.463 0.028 . . . . . . A 200 ALA HB1 . 34365 1 1539 . 1 . 1 200 200 ALA HB2 H 1 1.463 0.028 . . . . . . A 200 ALA HB2 . 34365 1 1540 . 1 . 1 200 200 ALA HB3 H 1 1.463 0.028 . . . . . . A 200 ALA HB3 . 34365 1 1541 . 1 . 1 200 200 ALA C C 13 175.123 0.108 . . . . . . A 200 ALA C . 34365 1 1542 . 1 . 1 200 200 ALA CA C 13 50.567 0.062 . . . . . . A 200 ALA CA . 34365 1 1543 . 1 . 1 200 200 ALA CB C 13 24.005 0.091 . . . . . . A 200 ALA CB . 34365 1 1544 . 1 . 1 200 200 ALA N N 15 123.595 0.160 . . . . . . A 200 ALA N . 34365 1 1545 . 1 . 1 201 201 SER H H 1 9.081 0.026 . . . . . . A 201 SER H . 34365 1 1546 . 1 . 1 201 201 SER HA H 1 5.380 0.044 . . . . . . A 201 SER HA . 34365 1 1547 . 1 . 1 201 201 SER HB2 H 1 2.951 0.000 . . . . . . A 201 SER HB2 . 34365 1 1548 . 1 . 1 201 201 SER HB3 H 1 3.290 0.000 . . . . . . A 201 SER HB3 . 34365 1 1549 . 1 . 1 201 201 SER C C 13 171.616 0.035 . . . . . . A 201 SER C . 34365 1 1550 . 1 . 1 201 201 SER CA C 13 57.749 0.082 . . . . . . A 201 SER CA . 34365 1 1551 . 1 . 1 201 201 SER CB C 13 66.128 0.100 . . . . . . A 201 SER CB . 34365 1 1552 . 1 . 1 201 201 SER N N 15 114.658 0.117 . . . . . . A 201 SER N . 34365 1 1553 . 1 . 1 202 202 TYR H H 1 9.074 0.021 . . . . . . A 202 TYR H . 34365 1 1554 . 1 . 1 202 202 TYR HA H 1 4.409 0.023 . . . . . . A 202 TYR HA . 34365 1 1555 . 1 . 1 202 202 TYR HB2 H 1 2.184 0.000 . . . . . . A 202 TYR HB2 . 34365 1 1556 . 1 . 1 202 202 TYR HB3 H 1 2.626 0.000 . . . . . . A 202 TYR HB3 . 34365 1 1557 . 1 . 1 202 202 TYR C C 13 175.125 0.043 . . . . . . A 202 TYR C . 34365 1 1558 . 1 . 1 202 202 TYR CA C 13 56.390 0.103 . . . . . . A 202 TYR CA . 34365 1 1559 . 1 . 1 202 202 TYR CB C 13 41.661 0.055 . . . . . . A 202 TYR CB . 34365 1 1560 . 1 . 1 202 202 TYR N N 15 124.888 0.133 . . . . . . A 202 TYR N . 34365 1 1561 . 1 . 1 203 203 VAL H H 1 8.437 0.008 . . . . . . A 203 VAL H . 34365 1 1562 . 1 . 1 203 203 VAL C C 13 174.761 0.368 . . . . . . A 203 VAL C . 34365 1 1563 . 1 . 1 203 203 VAL CA C 13 56.706 0.000 . . . . . . A 203 VAL CA . 34365 1 1564 . 1 . 1 203 203 VAL N N 15 120.911 0.028 . . . . . . A 203 VAL N . 34365 1 1565 . 1 . 1 204 204 PHE H H 1 9.287 0.028 . . . . . . A 204 PHE H . 34365 1 1566 . 1 . 1 204 204 PHE CA C 13 56.721 0.000 . . . . . . A 204 PHE CA . 34365 1 1567 . 1 . 1 204 204 PHE N N 15 126.178 0.232 . . . . . . A 204 PHE N . 34365 1 stop_ save_