data_27070 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 27070 _Entry.Title ; human FKBP25 ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2017-04-12 _Entry.Accession_date 2017-04-12 _Entry.Last_release_date 2017-04-12 _Entry.Original_release_date 2017-04-12 _Entry.Origination author _Entry.Format_name . _Entry.NMR_STAR_version 3.2.0.16 _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Source_data_format . _Entry.Source_data_format_version . _Entry.Generated_software_name . _Entry.Generated_software_version . _Entry.Generated_software_ID . _Entry.Generated_software_label . _Entry.Generated_date . _Entry.DOI . _Entry.UUID . _Entry.Related_coordinate_file_name . _Entry.Details . 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 Santosh Upadhyay . K. . . 27070 2 Cameron Mackereth . D. . . 27070 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 27070 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 632 27070 '15N chemical shifts' 207 27070 '1H chemical shifts' 207 27070 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 . . 2018-02-01 2017-04-12 update BMRB 'update entry citation' 27070 1 . . 2017-11-10 2017-04-12 original author 'original release' 27070 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID BMRB 27071 'BTHB domain from human FKBP25' 27070 SP Q00688 'Peptidyl-prolyl cis-trans isomerase FKBP3' 27070 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 27070 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 29036638 _Citation.Full_citation . _Citation.Title ; The basic tilted helix bundle domain of the prolyl isomerase FKBP25 is a novel double-stranded RNA binding module. ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Nucleic Acids Res.' _Citation.Journal_name_full 'Nucleic acids research' _Citation.Journal_volume 45 _Citation.Journal_issue 20 _Citation.Journal_ASTM . _Citation.Journal_ISSN 1362-4962 _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first 11989 _Citation.Page_last 12004 _Citation.Year 2017 _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 David Dilworth D. . . . 27070 1 2 Santosh Upadhyay S. K. . . 27070 1 3 Pierre Bonnafous P. . . . 27070 1 4 'Amiirah Bibi' Edoo A. B. . . 27070 1 5 Sarah Bourbigot S. . . . 27070 1 6 Francy Pesek-Jardim F. . . . 27070 1 7 Geoff Gudavicius G. . . . 27070 1 8 Jason Serpa J. J. . . 27070 1 9 Evgeniy Petrotchenko E. V. . . 27070 1 10 Christoph Borchers C. H. . . 27070 1 11 Christopher Nelson C. J. . . 27070 1 12 Cameron Mackereth C. D. . . 27070 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 27070 _Assembly.ID 1 _Assembly.Name FKBP25 _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 5.2.1.8 _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 FKBP25 1 $FKBP25 A . yes native no no . . . 27070 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_FKBP25 _Entity.Sf_category entity _Entity.Sf_framecode FKBP25 _Entity.Entry_ID 27070 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name FKBP25 _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; GAMAAAVPQRAWTVEQLRSE QLPKKDIIKFLQEHGSDSFL AEHKLLGNIKNVAKTANKDH LVTAYNHLFETKRFKGTESI SKVSEQVKNVKLNEDKPKET KSEETLDEGPPKYTKSVLKK GDKTNFPKKGDVVHCWYTGT LQDGTVFDTNIQTSAKKKKN AKPLSFKVGVGKVIRGWDEA LLTMSKGEKARLEIEPEWAY GKKGQPDAKIPPNAKLTFEV ELVDID ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 226 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number 5.2.1.8 _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 yes UNP Q00688 . FKBP3 . . . . . . . . . . . . . . 27070 1 stop_ loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 -1 GLY . 27070 1 2 0 ALA . 27070 1 3 1 MET . 27070 1 4 2 ALA . 27070 1 5 3 ALA . 27070 1 6 4 ALA . 27070 1 7 5 VAL . 27070 1 8 6 PRO . 27070 1 9 7 GLN . 27070 1 10 8 ARG . 27070 1 11 9 ALA . 27070 1 12 10 TRP . 27070 1 13 11 THR . 27070 1 14 12 VAL . 27070 1 15 13 GLU . 27070 1 16 14 GLN . 27070 1 17 15 LEU . 27070 1 18 16 ARG . 27070 1 19 17 SER . 27070 1 20 18 GLU . 27070 1 21 19 GLN . 27070 1 22 20 LEU . 27070 1 23 21 PRO . 27070 1 24 22 LYS . 27070 1 25 23 LYS . 27070 1 26 24 ASP . 27070 1 27 25 ILE . 27070 1 28 26 ILE . 27070 1 29 27 LYS . 27070 1 30 28 PHE . 27070 1 31 29 LEU . 27070 1 32 30 GLN . 27070 1 33 31 GLU . 27070 1 34 32 HIS . 27070 1 35 33 GLY . 27070 1 36 34 SER . 27070 1 37 35 ASP . 27070 1 38 36 SER . 27070 1 39 37 PHE . 27070 1 40 38 LEU . 27070 1 41 39 ALA . 27070 1 42 40 GLU . 27070 1 43 41 HIS . 27070 1 44 42 LYS . 27070 1 45 43 LEU . 27070 1 46 44 LEU . 27070 1 47 45 GLY . 27070 1 48 46 ASN . 27070 1 49 47 ILE . 27070 1 50 48 LYS . 27070 1 51 49 ASN . 27070 1 52 50 VAL . 27070 1 53 51 ALA . 27070 1 54 52 LYS . 27070 1 55 53 THR . 27070 1 56 54 ALA . 27070 1 57 55 ASN . 27070 1 58 56 LYS . 27070 1 59 57 ASP . 27070 1 60 58 HIS . 27070 1 61 59 LEU . 27070 1 62 60 VAL . 27070 1 63 61 THR . 27070 1 64 62 ALA . 27070 1 65 63 TYR . 27070 1 66 64 ASN . 27070 1 67 65 HIS . 27070 1 68 66 LEU . 27070 1 69 67 PHE . 27070 1 70 68 GLU . 27070 1 71 69 THR . 27070 1 72 70 LYS . 27070 1 73 71 ARG . 27070 1 74 72 PHE . 27070 1 75 73 LYS . 27070 1 76 74 GLY . 27070 1 77 75 THR . 27070 1 78 76 GLU . 27070 1 79 77 SER . 27070 1 80 78 ILE . 27070 1 81 79 SER . 27070 1 82 80 LYS . 27070 1 83 81 VAL . 27070 1 84 82 SER . 27070 1 85 83 GLU . 27070 1 86 84 GLN . 27070 1 87 85 VAL . 27070 1 88 86 LYS . 27070 1 89 87 ASN . 27070 1 90 88 VAL . 27070 1 91 89 LYS . 27070 1 92 90 LEU . 27070 1 93 91 ASN . 27070 1 94 92 GLU . 27070 1 95 93 ASP . 27070 1 96 94 LYS . 27070 1 97 95 PRO . 27070 1 98 96 LYS . 27070 1 99 97 GLU . 27070 1 100 98 THR . 27070 1 101 99 LYS . 27070 1 102 100 SER . 27070 1 103 101 GLU . 27070 1 104 102 GLU . 27070 1 105 103 THR . 27070 1 106 104 LEU . 27070 1 107 105 ASP . 27070 1 108 106 GLU . 27070 1 109 107 GLY . 27070 1 110 108 PRO . 27070 1 111 109 PRO . 27070 1 112 110 LYS . 27070 1 113 111 TYR . 27070 1 114 112 THR . 27070 1 115 113 LYS . 27070 1 116 114 SER . 27070 1 117 115 VAL . 27070 1 118 116 LEU . 27070 1 119 117 LYS . 27070 1 120 118 LYS . 27070 1 121 119 GLY . 27070 1 122 120 ASP . 27070 1 123 121 LYS . 27070 1 124 122 THR . 27070 1 125 123 ASN . 27070 1 126 124 PHE . 27070 1 127 125 PRO . 27070 1 128 126 LYS . 27070 1 129 127 LYS . 27070 1 130 128 GLY . 27070 1 131 129 ASP . 27070 1 132 130 VAL . 27070 1 133 131 VAL . 27070 1 134 132 HIS . 27070 1 135 133 CYS . 27070 1 136 134 TRP . 27070 1 137 135 TYR . 27070 1 138 136 THR . 27070 1 139 137 GLY . 27070 1 140 138 THR . 27070 1 141 139 LEU . 27070 1 142 140 GLN . 27070 1 143 141 ASP . 27070 1 144 142 GLY . 27070 1 145 143 THR . 27070 1 146 144 VAL . 27070 1 147 145 PHE . 27070 1 148 146 ASP . 27070 1 149 147 THR . 27070 1 150 148 ASN . 27070 1 151 149 ILE . 27070 1 152 150 GLN . 27070 1 153 151 THR . 27070 1 154 152 SER . 27070 1 155 153 ALA . 27070 1 156 154 LYS . 27070 1 157 155 LYS . 27070 1 158 156 LYS . 27070 1 159 157 LYS . 27070 1 160 158 ASN . 27070 1 161 159 ALA . 27070 1 162 160 LYS . 27070 1 163 161 PRO . 27070 1 164 162 LEU . 27070 1 165 163 SER . 27070 1 166 164 PHE . 27070 1 167 165 LYS . 27070 1 168 166 VAL . 27070 1 169 167 GLY . 27070 1 170 168 VAL . 27070 1 171 169 GLY . 27070 1 172 170 LYS . 27070 1 173 171 VAL . 27070 1 174 172 ILE . 27070 1 175 173 ARG . 27070 1 176 174 GLY . 27070 1 177 175 TRP . 27070 1 178 176 ASP . 27070 1 179 177 GLU . 27070 1 180 178 ALA . 27070 1 181 179 LEU . 27070 1 182 180 LEU . 27070 1 183 181 THR . 27070 1 184 182 MET . 27070 1 185 183 SER . 27070 1 186 184 LYS . 27070 1 187 185 GLY . 27070 1 188 186 GLU . 27070 1 189 187 LYS . 27070 1 190 188 ALA . 27070 1 191 189 ARG . 27070 1 192 190 LEU . 27070 1 193 191 GLU . 27070 1 194 192 ILE . 27070 1 195 193 GLU . 27070 1 196 194 PRO . 27070 1 197 195 GLU . 27070 1 198 196 TRP . 27070 1 199 197 ALA . 27070 1 200 198 TYR . 27070 1 201 199 GLY . 27070 1 202 200 LYS . 27070 1 203 201 LYS . 27070 1 204 202 GLY . 27070 1 205 203 GLN . 27070 1 206 204 PRO . 27070 1 207 205 ASP . 27070 1 208 206 ALA . 27070 1 209 207 LYS . 27070 1 210 208 ILE . 27070 1 211 209 PRO . 27070 1 212 210 PRO . 27070 1 213 211 ASN . 27070 1 214 212 ALA . 27070 1 215 213 LYS . 27070 1 216 214 LEU . 27070 1 217 215 THR . 27070 1 218 216 PHE . 27070 1 219 217 GLU . 27070 1 220 218 VAL . 27070 1 221 219 GLU . 27070 1 222 220 LEU . 27070 1 223 221 VAL . 27070 1 224 222 ASP . 27070 1 225 223 ILE . 27070 1 226 224 ASP . 27070 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . GLY 1 1 27070 1 . ALA 2 2 27070 1 . MET 3 3 27070 1 . ALA 4 4 27070 1 . ALA 5 5 27070 1 . ALA 6 6 27070 1 . VAL 7 7 27070 1 . PRO 8 8 27070 1 . GLN 9 9 27070 1 . ARG 10 10 27070 1 . ALA 11 11 27070 1 . TRP 12 12 27070 1 . THR 13 13 27070 1 . VAL 14 14 27070 1 . GLU 15 15 27070 1 . GLN 16 16 27070 1 . LEU 17 17 27070 1 . ARG 18 18 27070 1 . SER 19 19 27070 1 . GLU 20 20 27070 1 . GLN 21 21 27070 1 . LEU 22 22 27070 1 . PRO 23 23 27070 1 . LYS 24 24 27070 1 . LYS 25 25 27070 1 . ASP 26 26 27070 1 . ILE 27 27 27070 1 . ILE 28 28 27070 1 . LYS 29 29 27070 1 . PHE 30 30 27070 1 . LEU 31 31 27070 1 . GLN 32 32 27070 1 . GLU 33 33 27070 1 . HIS 34 34 27070 1 . GLY 35 35 27070 1 . SER 36 36 27070 1 . ASP 37 37 27070 1 . SER 38 38 27070 1 . PHE 39 39 27070 1 . LEU 40 40 27070 1 . ALA 41 41 27070 1 . GLU 42 42 27070 1 . HIS 43 43 27070 1 . LYS 44 44 27070 1 . LEU 45 45 27070 1 . LEU 46 46 27070 1 . GLY 47 47 27070 1 . ASN 48 48 27070 1 . ILE 49 49 27070 1 . LYS 50 50 27070 1 . ASN 51 51 27070 1 . VAL 52 52 27070 1 . ALA 53 53 27070 1 . LYS 54 54 27070 1 . THR 55 55 27070 1 . ALA 56 56 27070 1 . ASN 57 57 27070 1 . LYS 58 58 27070 1 . ASP 59 59 27070 1 . HIS 60 60 27070 1 . LEU 61 61 27070 1 . VAL 62 62 27070 1 . THR 63 63 27070 1 . ALA 64 64 27070 1 . TYR 65 65 27070 1 . ASN 66 66 27070 1 . HIS 67 67 27070 1 . LEU 68 68 27070 1 . PHE 69 69 27070 1 . GLU 70 70 27070 1 . THR 71 71 27070 1 . LYS 72 72 27070 1 . ARG 73 73 27070 1 . PHE 74 74 27070 1 . LYS 75 75 27070 1 . GLY 76 76 27070 1 . THR 77 77 27070 1 . GLU 78 78 27070 1 . SER 79 79 27070 1 . ILE 80 80 27070 1 . SER 81 81 27070 1 . LYS 82 82 27070 1 . VAL 83 83 27070 1 . SER 84 84 27070 1 . GLU 85 85 27070 1 . GLN 86 86 27070 1 . VAL 87 87 27070 1 . LYS 88 88 27070 1 . ASN 89 89 27070 1 . VAL 90 90 27070 1 . LYS 91 91 27070 1 . LEU 92 92 27070 1 . ASN 93 93 27070 1 . GLU 94 94 27070 1 . ASP 95 95 27070 1 . LYS 96 96 27070 1 . PRO 97 97 27070 1 . LYS 98 98 27070 1 . GLU 99 99 27070 1 . THR 100 100 27070 1 . LYS 101 101 27070 1 . SER 102 102 27070 1 . GLU 103 103 27070 1 . GLU 104 104 27070 1 . THR 105 105 27070 1 . LEU 106 106 27070 1 . ASP 107 107 27070 1 . GLU 108 108 27070 1 . GLY 109 109 27070 1 . PRO 110 110 27070 1 . PRO 111 111 27070 1 . LYS 112 112 27070 1 . TYR 113 113 27070 1 . THR 114 114 27070 1 . LYS 115 115 27070 1 . SER 116 116 27070 1 . VAL 117 117 27070 1 . LEU 118 118 27070 1 . LYS 119 119 27070 1 . LYS 120 120 27070 1 . GLY 121 121 27070 1 . ASP 122 122 27070 1 . LYS 123 123 27070 1 . THR 124 124 27070 1 . ASN 125 125 27070 1 . PHE 126 126 27070 1 . PRO 127 127 27070 1 . LYS 128 128 27070 1 . LYS 129 129 27070 1 . GLY 130 130 27070 1 . ASP 131 131 27070 1 . VAL 132 132 27070 1 . VAL 133 133 27070 1 . HIS 134 134 27070 1 . CYS 135 135 27070 1 . TRP 136 136 27070 1 . TYR 137 137 27070 1 . THR 138 138 27070 1 . GLY 139 139 27070 1 . THR 140 140 27070 1 . LEU 141 141 27070 1 . GLN 142 142 27070 1 . ASP 143 143 27070 1 . GLY 144 144 27070 1 . THR 145 145 27070 1 . VAL 146 146 27070 1 . PHE 147 147 27070 1 . ASP 148 148 27070 1 . THR 149 149 27070 1 . ASN 150 150 27070 1 . ILE 151 151 27070 1 . GLN 152 152 27070 1 . THR 153 153 27070 1 . SER 154 154 27070 1 . ALA 155 155 27070 1 . LYS 156 156 27070 1 . LYS 157 157 27070 1 . LYS 158 158 27070 1 . LYS 159 159 27070 1 . ASN 160 160 27070 1 . ALA 161 161 27070 1 . LYS 162 162 27070 1 . PRO 163 163 27070 1 . LEU 164 164 27070 1 . SER 165 165 27070 1 . PHE 166 166 27070 1 . LYS 167 167 27070 1 . VAL 168 168 27070 1 . GLY 169 169 27070 1 . VAL 170 170 27070 1 . GLY 171 171 27070 1 . LYS 172 172 27070 1 . VAL 173 173 27070 1 . ILE 174 174 27070 1 . ARG 175 175 27070 1 . GLY 176 176 27070 1 . TRP 177 177 27070 1 . ASP 178 178 27070 1 . GLU 179 179 27070 1 . ALA 180 180 27070 1 . LEU 181 181 27070 1 . LEU 182 182 27070 1 . THR 183 183 27070 1 . MET 184 184 27070 1 . SER 185 185 27070 1 . LYS 186 186 27070 1 . GLY 187 187 27070 1 . GLU 188 188 27070 1 . LYS 189 189 27070 1 . ALA 190 190 27070 1 . ARG 191 191 27070 1 . LEU 192 192 27070 1 . GLU 193 193 27070 1 . ILE 194 194 27070 1 . GLU 195 195 27070 1 . PRO 196 196 27070 1 . GLU 197 197 27070 1 . TRP 198 198 27070 1 . ALA 199 199 27070 1 . TYR 200 200 27070 1 . GLY 201 201 27070 1 . LYS 202 202 27070 1 . LYS 203 203 27070 1 . GLY 204 204 27070 1 . GLN 205 205 27070 1 . PRO 206 206 27070 1 . ASP 207 207 27070 1 . ALA 208 208 27070 1 . LYS 209 209 27070 1 . ILE 210 210 27070 1 . PRO 211 211 27070 1 . PRO 212 212 27070 1 . ASN 213 213 27070 1 . ALA 214 214 27070 1 . LYS 215 215 27070 1 . LEU 216 216 27070 1 . THR 217 217 27070 1 . PHE 218 218 27070 1 . GLU 219 219 27070 1 . VAL 220 220 27070 1 . GLU 221 221 27070 1 . LEU 222 222 27070 1 . VAL 223 223 27070 1 . ASP 224 224 27070 1 . ILE 225 225 27070 1 . ASP 226 226 27070 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 27070 _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 $FKBP25 . 9606 organism . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . 27070 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 27070 _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 $FKBP25 . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli BL21 pLysY . . . . pET-His1a . . . 27070 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 27070 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 FKBP25 '[U-99% 13C; U-99% 15N]' . . 1 $FKBP25 . . 200 . . uM . . . . 27070 1 2 'sodium phosphate' 'natural abundance' . . . . . . 20 . . mM . . . . 27070 1 3 'sodium chloride' 'natural abundance' . . . . . . 150 . . mM . . . . 27070 1 4 D2O '[U-99% 2H]' . . . . . . 10 . . '% v/v' . . . . 27070 1 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID 27070 _Sample_condition_list.ID 1 _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' 170 . mM 27070 1 pH 6.5 . pH 27070 1 pressure 1 . atm 27070 1 temperature 298 . K 27070 1 stop_ save_ ############################ # Computer software used # ############################ save_NMRPipe _Software.Sf_category software _Software.Sf_framecode NMRPipe _Software.Entry_ID 27070 _Software.ID 2 _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' . . 27070 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 27070 2 stop_ save_ save_SPARKY _Software.Sf_category software _Software.Sf_framecode SPARKY _Software.Entry_ID 27070 _Software.ID 3 _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 . . 27070 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 27070 3 'data analysis' 27070 3 'peak picking' 27070 3 stop_ save_ save_TOPSPIN _Software.Sf_category software _Software.Sf_framecode TOPSPIN _Software.Entry_ID 27070 _Software.ID 1 _Software.Type . _Software.Name TOPSPIN _Software.Version 2.1 _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bruker Biospin' . . 27070 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection 27070 1 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_1 _NMR_spectrometer.Entry_ID 27070 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 700 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 27070 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 Bruker Avance . 700 . . . 27070 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 27070 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 27070 1 2 '3D HNCO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 27070 1 3 '3D HN(CA)CO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 27070 1 4 '3D HNCA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 27070 1 5 '3D HN(CO)CA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 27070 1 6 '3D CBCA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 27070 1 7 '3D HNCACB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 27070 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_reference_1 _Chem_shift_reference.Entry_ID 27070 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.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 external indirect 0.251449530 . . . . . 27070 1 H 1 water protons . . . . ppm 4.759 internal direct 1 . . . . . 27070 1 N 15 DSS 'methyl protons' . . . . ppm 0 external indirect 0.101329118 . . . . . 27070 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 27070 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' . . . 27070 1 2 '3D HNCO' . . . 27070 1 3 '3D HN(CA)CO' . . . 27070 1 4 '3D HNCA' . . . 27070 1 5 '3D HN(CO)CA' . . . 27070 1 6 '3D CBCA(CO)NH' . . . 27070 1 7 '3D HNCACB' . . . 27070 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Ambiguity_set_ID _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 3 3 MET H H 1 8.461 0.02 . 1 . . . . . 1 MET HN . 27070 1 2 . 1 1 3 3 MET C C 13 175.916 0.2 . 1 . . . . . 1 MET C . 27070 1 3 . 1 1 3 3 MET CA C 13 55.445 0.2 . 1 . . . . . 1 MET CA . 27070 1 4 . 1 1 3 3 MET CB C 13 33.008 0.2 . 1 . . . . . 1 MET CB . 27070 1 5 . 1 1 3 3 MET N N 15 120.184 0.2 . 1 . . . . . 1 MET N . 27070 1 6 . 1 1 4 4 ALA H H 1 8.328 0.02 . 1 . . . . . 2 ALA HN . 27070 1 7 . 1 1 4 4 ALA C C 13 177.159 0.2 . 1 . . . . . 2 ALA C . 27070 1 8 . 1 1 4 4 ALA CA C 13 52.332 0.2 . 1 . . . . . 2 ALA CA . 27070 1 9 . 1 1 4 4 ALA CB C 13 19.311 0.2 . 1 . . . . . 2 ALA CB . 27070 1 10 . 1 1 4 4 ALA N N 15 126.028 0.2 . 1 . . . . . 2 ALA N . 27070 1 11 . 1 1 5 5 ALA H H 1 8.194 0.02 . 1 . . . . . 3 ALA HN . 27070 1 12 . 1 1 5 5 ALA C C 13 177.133 0.2 . 1 . . . . . 3 ALA C . 27070 1 13 . 1 1 5 5 ALA CA C 13 52.265 0.2 . 1 . . . . . 3 ALA CA . 27070 1 14 . 1 1 5 5 ALA CB C 13 19.277 0.2 . 1 . . . . . 3 ALA CB . 27070 1 15 . 1 1 5 5 ALA N N 15 123.714 0.2 . 1 . . . . . 3 ALA N . 27070 1 16 . 1 1 6 6 ALA H H 1 8.194 0.02 . 1 . . . . . 4 ALA HN . 27070 1 17 . 1 1 6 6 ALA C C 13 177.128 0.2 . 1 . . . . . 4 ALA C . 27070 1 18 . 1 1 6 6 ALA CA C 13 52.133 0.2 . 1 . . . . . 4 ALA CA . 27070 1 19 . 1 1 6 6 ALA CB C 13 19.169 0.2 . 1 . . . . . 4 ALA CB . 27070 1 20 . 1 1 6 6 ALA N N 15 123.623 0.2 . 1 . . . . . 4 ALA N . 27070 1 21 . 1 1 7 7 VAL H H 1 7.877 0.02 . 1 . . . . . 5 VAL HN . 27070 1 22 . 1 1 7 7 VAL C C 13 173.986 0.2 . 1 . . . . . 5 VAL C . 27070 1 23 . 1 1 7 7 VAL CA C 13 59.281 0.2 . 1 . . . . . 5 VAL CA . 27070 1 24 . 1 1 7 7 VAL CB C 13 32.345 0.2 . 1 . . . . . 5 VAL CB . 27070 1 25 . 1 1 7 7 VAL N N 15 120.242 0.2 . 1 . . . . . 5 VAL N . 27070 1 26 . 1 1 8 8 PRO C C 13 175.353 0.2 . 1 . . . . . 6 PRO C . 27070 1 27 . 1 1 8 8 PRO CA C 13 62.502 0.2 . 1 . . . . . 6 PRO CA . 27070 1 28 . 1 1 8 8 PRO CB C 13 31.729 0.2 . 1 . . . . . 6 PRO CB . 27070 1 29 . 1 1 9 9 GLN H H 1 8.183 0.02 . 1 . . . . . 7 GLN HN . 27070 1 30 . 1 1 9 9 GLN C C 13 175.747 0.2 . 1 . . . . . 7 GLN C . 27070 1 31 . 1 1 9 9 GLN CA C 13 54.729 0.2 . 1 . . . . . 7 GLN CA . 27070 1 32 . 1 1 9 9 GLN CB C 13 30.087 0.2 . 1 . . . . . 7 GLN CB . 27070 1 33 . 1 1 9 9 GLN N N 15 118.341 0.2 . 1 . . . . . 7 GLN N . 27070 1 34 . 1 1 10 10 ARG H H 1 8.372 0.02 . 1 . . . . . 8 ARG HN . 27070 1 35 . 1 1 10 10 ARG C C 13 175.427 0.2 . 1 . . . . . 8 ARG C . 27070 1 36 . 1 1 10 10 ARG CA C 13 55.954 0.2 . 1 . . . . . 8 ARG CA . 27070 1 37 . 1 1 10 10 ARG CB C 13 28.882 0.2 . 1 . . . . . 8 ARG CB . 27070 1 38 . 1 1 10 10 ARG N N 15 124.752 0.2 . 1 . . . . . 8 ARG N . 27070 1 39 . 1 1 11 11 ALA H H 1 7.257 0.02 . 1 . . . . . 9 ALA HN . 27070 1 40 . 1 1 11 11 ALA C C 13 177.12 0.2 . 1 . . . . . 9 ALA C . 27070 1 41 . 1 1 11 11 ALA CA C 13 53.012 0.2 . 1 . . . . . 9 ALA CA . 27070 1 42 . 1 1 11 11 ALA CB C 13 19.291 0.2 . 1 . . . . . 9 ALA CB . 27070 1 43 . 1 1 11 11 ALA N N 15 128.475 0.2 . 1 . . . . . 9 ALA N . 27070 1 44 . 1 1 12 12 TRP H H 1 7.132 0.02 . 1 . . . . . 10 TRP HN . 27070 1 45 . 1 1 12 12 TRP C C 13 177.058 0.2 . 1 . . . . . 10 TRP C . 27070 1 46 . 1 1 12 12 TRP CA C 13 55.532 0.2 . 1 . . . . . 10 TRP CA . 27070 1 47 . 1 1 12 12 TRP CB C 13 30.998 0.2 . 1 . . . . . 10 TRP CB . 27070 1 48 . 1 1 12 12 TRP N N 15 114.998 0.2 . 1 . . . . . 10 TRP N . 27070 1 49 . 1 1 13 13 THR H H 1 8.848 0.02 . 1 . . . . . 11 THR HN . 27070 1 50 . 1 1 13 13 THR C C 13 175.63 0.2 . 1 . . . . . 11 THR C . 27070 1 51 . 1 1 13 13 THR CA C 13 60.176 0.2 . 1 . . . . . 11 THR CA . 27070 1 52 . 1 1 13 13 THR CB C 13 71.082 0.2 . 1 . . . . . 11 THR CB . 27070 1 53 . 1 1 13 13 THR N N 15 114.531 0.2 . 1 . . . . . 11 THR N . 27070 1 54 . 1 1 14 14 VAL H H 1 8.909 0.02 . 1 . . . . . 12 VAL HN . 27070 1 55 . 1 1 14 14 VAL C C 13 177.064 0.2 . 1 . . . . . 12 VAL C . 27070 1 56 . 1 1 14 14 VAL CA C 13 67.477 0.2 . 1 . . . . . 12 VAL CA . 27070 1 57 . 1 1 14 14 VAL CB C 13 31.283 0.2 . 1 . . . . . 12 VAL CB . 27070 1 58 . 1 1 14 14 VAL N N 15 120.477 0.2 . 1 . . . . . 12 VAL N . 27070 1 59 . 1 1 15 15 GLU H H 1 8.405 0.02 . 1 . . . . . 13 GLU HN . 27070 1 60 . 1 1 15 15 GLU C C 13 179.764 0.2 . 1 . . . . . 13 GLU C . 27070 1 61 . 1 1 15 15 GLU CA C 13 60.354 0.2 . 1 . . . . . 13 GLU CA . 27070 1 62 . 1 1 15 15 GLU CB C 13 28.733 0.2 . 1 . . . . . 13 GLU CB . 27070 1 63 . 1 1 15 15 GLU N N 15 118.378 0.2 . 1 . . . . . 13 GLU N . 27070 1 64 . 1 1 16 16 GLN H H 1 7.616 0.02 . 1 . . . . . 14 GLN HN . 27070 1 65 . 1 1 16 16 GLN C C 13 179.076 0.2 . 1 . . . . . 14 GLN C . 27070 1 66 . 1 1 16 16 GLN CA C 13 58.916 0.2 . 1 . . . . . 14 GLN CA . 27070 1 67 . 1 1 16 16 GLN CB C 13 28.756 0.2 . 1 . . . . . 14 GLN CB . 27070 1 68 . 1 1 16 16 GLN N N 15 118.859 0.2 . 1 . . . . . 14 GLN N . 27070 1 69 . 1 1 17 17 LEU H H 1 8.134 0.02 . 1 . . . . . 15 LEU HN . 27070 1 70 . 1 1 17 17 LEU C C 13 178.138 0.2 . 1 . . . . . 15 LEU C . 27070 1 71 . 1 1 17 17 LEU CA C 13 57.648 0.2 . 1 . . . . . 15 LEU CA . 27070 1 72 . 1 1 17 17 LEU CB C 13 43.362 0.2 . 1 . . . . . 15 LEU CB . 27070 1 73 . 1 1 17 17 LEU N N 15 118.386 0.2 . 1 . . . . . 15 LEU N . 27070 1 74 . 1 1 18 18 ARG H H 1 7.653 0.02 . 1 . . . . . 16 ARG HN . 27070 1 75 . 1 1 18 18 ARG C C 13 176.17 0.2 . 1 . . . . . 16 ARG C . 27070 1 76 . 1 1 18 18 ARG CA C 13 57.682 0.2 . 1 . . . . . 16 ARG CA . 27070 1 77 . 1 1 18 18 ARG CB C 13 30.543 0.2 . 1 . . . . . 16 ARG CB . 27070 1 78 . 1 1 18 18 ARG N N 15 113.68 0.2 . 1 . . . . . 16 ARG N . 27070 1 79 . 1 1 19 19 SER H H 1 7.269 0.02 . 1 . . . . . 17 SER HN . 27070 1 80 . 1 1 19 19 SER C C 13 175.46 0.2 . 1 . . . . . 17 SER C . 27070 1 81 . 1 1 19 19 SER CA C 13 58.306 0.2 . 1 . . . . . 17 SER CA . 27070 1 82 . 1 1 19 19 SER CB C 13 64.226 0.2 . 1 . . . . . 17 SER CB . 27070 1 83 . 1 1 19 19 SER N N 15 115.873 0.2 . 1 . . . . . 17 SER N . 27070 1 84 . 1 1 20 20 GLU H H 1 8.943 0.02 . 1 . . . . . 18 GLU HN . 27070 1 85 . 1 1 20 20 GLU C C 13 177.534 0.2 . 1 . . . . . 18 GLU C . 27070 1 86 . 1 1 20 20 GLU CA C 13 57.707 0.2 . 1 . . . . . 18 GLU CA . 27070 1 87 . 1 1 20 20 GLU CB C 13 29.081 0.2 . 1 . . . . . 18 GLU CB . 27070 1 88 . 1 1 20 20 GLU N N 15 124.357 0.2 . 1 . . . . . 18 GLU N . 27070 1 89 . 1 1 21 21 GLN H H 1 8.047 0.02 . 1 . . . . . 19 GLN HN . 27070 1 90 . 1 1 21 21 GLN C C 13 175.021 0.2 . 1 . . . . . 19 GLN C . 27070 1 91 . 1 1 21 21 GLN CA C 13 57.111 0.2 . 1 . . . . . 19 GLN CA . 27070 1 92 . 1 1 21 21 GLN CB C 13 28.52 0.2 . 1 . . . . . 19 GLN CB . 27070 1 93 . 1 1 21 21 GLN N N 15 116.05 0.2 . 1 . . . . . 19 GLN N . 27070 1 94 . 1 1 22 22 LEU H H 1 7.133 0.02 . 1 . . . . . 20 LEU HN . 27070 1 95 . 1 1 22 22 LEU C C 13 173.046 0.2 . 1 . . . . . 20 LEU C . 27070 1 96 . 1 1 22 22 LEU CA C 13 51.091 0.2 . 1 . . . . . 20 LEU CA . 27070 1 97 . 1 1 22 22 LEU CB C 13 42.403 0.2 . 1 . . . . . 20 LEU CB . 27070 1 98 . 1 1 22 22 LEU N N 15 123.338 0.2 . 1 . . . . . 20 LEU N . 27070 1 99 . 1 1 23 23 PRO C C 13 177.85 0.2 . 1 . . . . . 21 PRO C . 27070 1 100 . 1 1 23 23 PRO CA C 13 62.377 0.2 . 1 . . . . . 21 PRO CA . 27070 1 101 . 1 1 23 23 PRO CB C 13 32.695 0.2 . 1 . . . . . 21 PRO CB . 27070 1 102 . 1 1 24 24 LYS H H 1 8.83 0.02 . 1 . . . . . 22 LYS HN . 27070 1 103 . 1 1 24 24 LYS C C 13 179.133 0.2 . 1 . . . . . 22 LYS C . 27070 1 104 . 1 1 24 24 LYS CA C 13 61.102 0.2 . 1 . . . . . 22 LYS CA . 27070 1 105 . 1 1 24 24 LYS CB C 13 32.423 0.2 . 1 . . . . . 22 LYS CB . 27070 1 106 . 1 1 24 24 LYS N N 15 121.453 0.2 . 1 . . . . . 22 LYS N . 27070 1 107 . 1 1 25 25 LYS H H 1 8.904 0.02 . 1 . . . . . 23 LYS HN . 27070 1 108 . 1 1 25 25 LYS C C 13 176.928 0.2 . 1 . . . . . 23 LYS C . 27070 1 109 . 1 1 25 25 LYS CA C 13 60.142 0.2 . 1 . . . . . 23 LYS CA . 27070 1 110 . 1 1 25 25 LYS CB C 13 31.538 0.2 . 1 . . . . . 23 LYS CB . 27070 1 111 . 1 1 25 25 LYS N N 15 115.512 0.2 . 1 . . . . . 23 LYS N . 27070 1 112 . 1 1 26 26 ASP H H 1 7.245 0.02 . 1 . . . . . 24 ASP HN . 27070 1 113 . 1 1 26 26 ASP C C 13 179.354 0.2 . 1 . . . . . 24 ASP C . 27070 1 114 . 1 1 26 26 ASP CA C 13 57.641 0.2 . 1 . . . . . 24 ASP CA . 27070 1 115 . 1 1 26 26 ASP CB C 13 40.097 0.2 . 1 . . . . . 24 ASP CB . 27070 1 116 . 1 1 26 26 ASP N N 15 120.545 0.2 . 1 . . . . . 24 ASP N . 27070 1 117 . 1 1 27 27 ILE H H 1 7.225 0.02 . 1 . . . . . 25 ILE HN . 27070 1 118 . 1 1 27 27 ILE C C 13 178.149 0.2 . 1 . . . . . 25 ILE C . 27070 1 119 . 1 1 27 27 ILE CA C 13 65.286 0.2 . 1 . . . . . 25 ILE CA . 27070 1 120 . 1 1 27 27 ILE CB C 13 38.542 0.2 . 1 . . . . . 25 ILE CB . 27070 1 121 . 1 1 27 27 ILE N N 15 120.847 0.2 . 1 . . . . . 25 ILE N . 27070 1 122 . 1 1 28 28 ILE H H 1 8.389 0.02 . 1 . . . . . 26 ILE HN . 27070 1 123 . 1 1 28 28 ILE C C 13 177.141 0.2 . 1 . . . . . 26 ILE C . 27070 1 124 . 1 1 28 28 ILE CA C 13 66.599 0.2 . 1 . . . . . 26 ILE CA . 27070 1 125 . 1 1 28 28 ILE CB C 13 38.205 0.2 . 1 . . . . . 26 ILE CB . 27070 1 126 . 1 1 28 28 ILE N N 15 118.94 0.2 . 1 . . . . . 26 ILE N . 27070 1 127 . 1 1 29 29 LYS H H 1 8.529 0.02 . 1 . . . . . 27 LYS HN . 27070 1 128 . 1 1 29 29 LYS C C 13 178.106 0.2 . 1 . . . . . 27 LYS C . 27070 1 129 . 1 1 29 29 LYS CA C 13 60.434 0.2 . 1 . . . . . 27 LYS CA . 27070 1 130 . 1 1 29 29 LYS CB C 13 32.777 0.2 . 1 . . . . . 27 LYS CB . 27070 1 131 . 1 1 29 29 LYS N N 15 119.868 0.2 . 1 . . . . . 27 LYS N . 27070 1 132 . 1 1 30 30 PHE H H 1 7.692 0.02 . 1 . . . . . 28 PHE HN . 27070 1 133 . 1 1 30 30 PHE C C 13 178.346 0.2 . 1 . . . . . 28 PHE C . 27070 1 134 . 1 1 30 30 PHE CA C 13 62.562 0.2 . 1 . . . . . 28 PHE CA . 27070 1 135 . 1 1 30 30 PHE CB C 13 39.578 0.2 . 1 . . . . . 28 PHE CB . 27070 1 136 . 1 1 30 30 PHE N N 15 118.241 0.2 . 1 . . . . . 28 PHE N . 27070 1 137 . 1 1 31 31 LEU H H 1 8.717 0.02 . 1 . . . . . 29 LEU HN . 27070 1 138 . 1 1 31 31 LEU C C 13 178.749 0.2 . 1 . . . . . 29 LEU C . 27070 1 139 . 1 1 31 31 LEU CA C 13 58.822 0.2 . 1 . . . . . 29 LEU CA . 27070 1 140 . 1 1 31 31 LEU CB C 13 41.859 0.2 . 1 . . . . . 29 LEU CB . 27070 1 141 . 1 1 31 31 LEU N N 15 119.791 0.2 . 1 . . . . . 29 LEU N . 27070 1 142 . 1 1 32 32 GLN H H 1 9.103 0.02 . 1 . . . . . 30 GLN HN . 27070 1 143 . 1 1 32 32 GLN C C 13 178.032 0.2 . 1 . . . . . 30 GLN C . 27070 1 144 . 1 1 32 32 GLN CA C 13 59.26 0.2 . 1 . . . . . 30 GLN CA . 27070 1 145 . 1 1 32 32 GLN CB C 13 28.02 0.2 . 1 . . . . . 30 GLN CB . 27070 1 146 . 1 1 32 32 GLN N N 15 116.812 0.2 . 1 . . . . . 30 GLN N . 27070 1 147 . 1 1 33 33 GLU H H 1 7.958 0.02 . 1 . . . . . 31 GLU HN . 27070 1 148 . 1 1 33 33 GLU C C 13 177.69 0.2 . 1 . . . . . 31 GLU C . 27070 1 149 . 1 1 33 33 GLU CA C 13 57.964 0.2 . 1 . . . . . 31 GLU CA . 27070 1 150 . 1 1 33 33 GLU CB C 13 29.986 0.2 . 1 . . . . . 31 GLU CB . 27070 1 151 . 1 1 33 33 GLU N N 15 116.9 0.2 . 1 . . . . . 31 GLU N . 27070 1 152 . 1 1 34 34 HIS H H 1 7.361 0.02 . 1 . . . . . 32 HIS HN . 27070 1 153 . 1 1 34 34 HIS C C 13 175.819 0.2 . 1 . . . . . 32 HIS C . 27070 1 154 . 1 1 34 34 HIS CA C 13 57.503 0.2 . 1 . . . . . 32 HIS CA . 27070 1 155 . 1 1 34 34 HIS CB C 13 31.559 0.2 . 1 . . . . . 32 HIS CB . 27070 1 156 . 1 1 34 34 HIS N N 15 111.837 0.2 . 1 . . . . . 32 HIS N . 27070 1 157 . 1 1 35 35 GLY H H 1 8.796 0.02 . 1 . . . . . 33 GLY HN . 27070 1 158 . 1 1 35 35 GLY C C 13 172.083 0.2 . 1 . . . . . 33 GLY C . 27070 1 159 . 1 1 35 35 GLY CA C 13 44.598 0.2 . 1 . . . . . 33 GLY CA . 27070 1 160 . 1 1 35 35 GLY N N 15 110.919 0.2 . 1 . . . . . 33 GLY N . 27070 1 161 . 1 1 36 36 SER H H 1 8.283 0.02 . 1 . . . . . 34 SER HN . 27070 1 162 . 1 1 36 36 SER C C 13 174.028 0.2 . 1 . . . . . 34 SER C . 27070 1 163 . 1 1 36 36 SER CA C 13 57.877 0.2 . 1 . . . . . 34 SER CA . 27070 1 164 . 1 1 36 36 SER CB C 13 64.224 0.2 . 1 . . . . . 34 SER CB . 27070 1 165 . 1 1 36 36 SER N N 15 117.826 0.2 . 1 . . . . . 34 SER N . 27070 1 166 . 1 1 37 37 ASP H H 1 9.02 0.02 . 1 . . . . . 35 ASP HN . 27070 1 167 . 1 1 37 37 ASP C C 13 179.007 0.2 . 1 . . . . . 35 ASP C . 27070 1 168 . 1 1 37 37 ASP CA C 13 58.589 0.2 . 1 . . . . . 35 ASP CA . 27070 1 169 . 1 1 37 37 ASP CB C 13 39.923 0.2 . 1 . . . . . 35 ASP CB . 27070 1 170 . 1 1 37 37 ASP N N 15 122.483 0.2 . 1 . . . . . 35 ASP N . 27070 1 171 . 1 1 38 38 SER H H 1 8.587 0.02 . 1 . . . . . 36 SER HN . 27070 1 172 . 1 1 38 38 SER C C 13 176.78 0.2 . 1 . . . . . 36 SER C . 27070 1 173 . 1 1 38 38 SER CA C 13 61.051 0.2 . 1 . . . . . 36 SER CA . 27070 1 174 . 1 1 38 38 SER CB C 13 61.439 0.2 . 1 . . . . . 36 SER CB . 27070 1 175 . 1 1 38 38 SER N N 15 114.776 0.2 . 1 . . . . . 36 SER N . 27070 1 176 . 1 1 39 39 PHE H H 1 7.882 0.02 . 1 . . . . . 37 PHE HN . 27070 1 177 . 1 1 39 39 PHE C C 13 177.821 0.2 . 1 . . . . . 37 PHE C . 27070 1 178 . 1 1 39 39 PHE CA C 13 62.305 0.2 . 1 . . . . . 37 PHE CA . 27070 1 179 . 1 1 39 39 PHE CB C 13 39.337 0.2 . 1 . . . . . 37 PHE CB . 27070 1 180 . 1 1 39 39 PHE N N 15 127.013 0.2 . 1 . . . . . 37 PHE N . 27070 1 181 . 1 1 40 40 LEU H H 1 8.86 0.02 . 1 . . . . . 38 LEU HN . 27070 1 182 . 1 1 40 40 LEU C C 13 179.781 0.2 . 1 . . . . . 38 LEU C . 27070 1 183 . 1 1 40 40 LEU CA C 13 58.11 0.2 . 1 . . . . . 38 LEU CA . 27070 1 184 . 1 1 40 40 LEU CB C 13 41.974 0.2 . 1 . . . . . 38 LEU CB . 27070 1 185 . 1 1 40 40 LEU N N 15 121.064 0.2 . 1 . . . . . 38 LEU N . 27070 1 186 . 1 1 41 41 ALA H H 1 8.583 0.02 . 1 . . . . . 39 ALA HN . 27070 1 187 . 1 1 41 41 ALA C C 13 181.96 0.2 . 1 . . . . . 39 ALA C . 27070 1 188 . 1 1 41 41 ALA CA C 13 55.33 0.2 . 1 . . . . . 39 ALA CA . 27070 1 189 . 1 1 41 41 ALA CB C 13 17.971 0.2 . 1 . . . . . 39 ALA CB . 27070 1 190 . 1 1 41 41 ALA N N 15 122.778 0.2 . 1 . . . . . 39 ALA N . 27070 1 191 . 1 1 42 42 GLU H H 1 8.059 0.02 . 1 . . . . . 40 GLU HN . 27070 1 192 . 1 1 42 42 GLU C C 13 177.673 0.2 . 1 . . . . . 40 GLU C . 27070 1 193 . 1 1 42 42 GLU CA C 13 59.078 0.2 . 1 . . . . . 40 GLU CA . 27070 1 194 . 1 1 42 42 GLU CB C 13 29.614 0.2 . 1 . . . . . 40 GLU CB . 27070 1 195 . 1 1 42 42 GLU N N 15 120.032 0.2 . 1 . . . . . 40 GLU N . 27070 1 196 . 1 1 43 43 HIS H H 1 7.119 0.02 . 1 . . . . . 41 HIS HN . 27070 1 197 . 1 1 43 43 HIS C C 13 172.735 0.2 . 1 . . . . . 41 HIS C . 27070 1 198 . 1 1 43 43 HIS CA C 13 57.229 0.2 . 1 . . . . . 41 HIS CA . 27070 1 199 . 1 1 43 43 HIS CB C 13 29.777 0.2 . 1 . . . . . 41 HIS CB . 27070 1 200 . 1 1 43 43 HIS N N 15 113.546 0.2 . 1 . . . . . 41 HIS N . 27070 1 201 . 1 1 44 44 LYS H H 1 7.833 0.02 . 1 . . . . . 42 LYS HN . 27070 1 202 . 1 1 44 44 LYS C C 13 176.758 0.2 . 1 . . . . . 42 LYS C . 27070 1 203 . 1 1 44 44 LYS CA C 13 57.676 0.2 . 1 . . . . . 42 LYS CA . 27070 1 204 . 1 1 44 44 LYS CB C 13 28.358 0.2 . 1 . . . . . 42 LYS CB . 27070 1 205 . 1 1 44 44 LYS N N 15 117.251 0.2 . 1 . . . . . 42 LYS N . 27070 1 206 . 1 1 45 45 LEU H H 1 8.326 0.02 . 1 . . . . . 43 LEU HN . 27070 1 207 . 1 1 45 45 LEU C C 13 175.276 0.2 . 1 . . . . . 43 LEU C . 27070 1 208 . 1 1 45 45 LEU CA C 13 53.319 0.2 . 1 . . . . . 43 LEU CA . 27070 1 209 . 1 1 45 45 LEU CB C 13 44.193 0.2 . 1 . . . . . 43 LEU CB . 27070 1 210 . 1 1 45 45 LEU N N 15 115.963 0.2 . 1 . . . . . 43 LEU N . 27070 1 211 . 1 1 46 46 LEU H H 1 7.411 0.02 . 1 . . . . . 44 LEU HN . 27070 1 212 . 1 1 46 46 LEU C C 13 176.801 0.2 . 1 . . . . . 44 LEU C . 27070 1 213 . 1 1 46 46 LEU CA C 13 54.685 0.2 . 1 . . . . . 44 LEU CA . 27070 1 214 . 1 1 46 46 LEU CB C 13 42.919 0.2 . 1 . . . . . 44 LEU CB . 27070 1 215 . 1 1 46 46 LEU N N 15 118.948 0.2 . 1 . . . . . 44 LEU N . 27070 1 216 . 1 1 47 47 GLY H H 1 8.314 0.02 . 1 . . . . . 45 GLY HN . 27070 1 217 . 1 1 47 47 GLY C C 13 172.843 0.2 . 1 . . . . . 45 GLY C . 27070 1 218 . 1 1 47 47 GLY CA C 13 43.649 0.2 . 1 . . . . . 45 GLY CA . 27070 1 219 . 1 1 47 47 GLY N N 15 110.009 0.2 . 1 . . . . . 45 GLY N . 27070 1 220 . 1 1 48 48 ASN H H 1 8.505 0.02 . 1 . . . . . 46 ASN HN . 27070 1 221 . 1 1 48 48 ASN C C 13 177.52 0.2 . 1 . . . . . 46 ASN C . 27070 1 222 . 1 1 48 48 ASN CA C 13 53.993 0.2 . 1 . . . . . 46 ASN CA . 27070 1 223 . 1 1 48 48 ASN CB C 13 39.316 0.2 . 1 . . . . . 46 ASN CB . 27070 1 224 . 1 1 48 48 ASN N N 15 118.488 0.2 . 1 . . . . . 46 ASN N . 27070 1 225 . 1 1 49 49 ILE H H 1 8.921 0.02 . 1 . . . . . 47 ILE HN . 27070 1 226 . 1 1 49 49 ILE C C 13 176.269 0.2 . 1 . . . . . 47 ILE C . 27070 1 227 . 1 1 49 49 ILE CA C 13 66.178 0.2 . 1 . . . . . 47 ILE CA . 27070 1 228 . 1 1 49 49 ILE CB C 13 37.86 0.2 . 1 . . . . . 47 ILE CB . 27070 1 229 . 1 1 49 49 ILE N N 15 127.053 0.2 . 1 . . . . . 47 ILE N . 27070 1 230 . 1 1 50 50 LYS H H 1 8.196 0.02 . 1 . . . . . 48 LYS HN . 27070 1 231 . 1 1 50 50 LYS C C 13 178.839 0.2 . 1 . . . . . 48 LYS C . 27070 1 232 . 1 1 50 50 LYS CA C 13 59.548 0.2 . 1 . . . . . 48 LYS CA . 27070 1 233 . 1 1 50 50 LYS CB C 13 32.087 0.2 . 1 . . . . . 48 LYS CB . 27070 1 234 . 1 1 50 50 LYS N N 15 119.104 0.2 . 1 . . . . . 48 LYS N . 27070 1 235 . 1 1 51 51 ASN H H 1 7.643 0.02 . 1 . . . . . 49 ASN HN . 27070 1 236 . 1 1 51 51 ASN C C 13 178.079 0.2 . 1 . . . . . 49 ASN C . 27070 1 237 . 1 1 51 51 ASN CA C 13 55.541 0.2 . 1 . . . . . 49 ASN CA . 27070 1 238 . 1 1 51 51 ASN CB C 13 38.349 0.2 . 1 . . . . . 49 ASN CB . 27070 1 239 . 1 1 51 51 ASN N N 15 117.306 0.2 . 1 . . . . . 49 ASN N . 27070 1 240 . 1 1 52 52 VAL H H 1 8.345 0.02 . 1 . . . . . 50 VAL HN . 27070 1 241 . 1 1 52 52 VAL C C 13 178.087 0.2 . 1 . . . . . 50 VAL C . 27070 1 242 . 1 1 52 52 VAL CA C 13 65.703 0.2 . 1 . . . . . 50 VAL CA . 27070 1 243 . 1 1 52 52 VAL CB C 13 32.045 0.2 . 1 . . . . . 50 VAL CB . 27070 1 244 . 1 1 52 52 VAL N N 15 121.785 0.2 . 1 . . . . . 50 VAL N . 27070 1 245 . 1 1 53 53 ALA H H 1 8.492 0.02 . 1 . . . . . 51 ALA HN . 27070 1 246 . 1 1 53 53 ALA C C 13 177.847 0.2 . 1 . . . . . 51 ALA C . 27070 1 247 . 1 1 53 53 ALA CA C 13 54.963 0.2 . 1 . . . . . 51 ALA CA . 27070 1 248 . 1 1 53 53 ALA CB C 13 18.189 0.2 . 1 . . . . . 51 ALA CB . 27070 1 249 . 1 1 53 53 ALA N N 15 119.565 0.2 . 1 . . . . . 51 ALA N . 27070 1 250 . 1 1 54 54 LYS H H 1 7.225 0.02 . 1 . . . . . 52 LYS HN . 27070 1 251 . 1 1 54 54 LYS C C 13 178.398 0.2 . 1 . . . . . 52 LYS C . 27070 1 252 . 1 1 54 54 LYS CA C 13 58.631 0.2 . 1 . . . . . 52 LYS CA . 27070 1 253 . 1 1 54 54 LYS CB C 13 33.008 0.2 . 1 . . . . . 52 LYS CB . 27070 1 254 . 1 1 54 54 LYS N N 15 114.202 0.2 . 1 . . . . . 52 LYS N . 27070 1 255 . 1 1 55 55 THR H H 1 7.422 0.02 . 1 . . . . . 53 THR HN . 27070 1 256 . 1 1 55 55 THR C C 13 174.281 0.2 . 1 . . . . . 53 THR C . 27070 1 257 . 1 1 55 55 THR CA C 13 62.044 0.2 . 1 . . . . . 53 THR CA . 27070 1 258 . 1 1 55 55 THR CB C 13 69.703 0.2 . 1 . . . . . 53 THR CB . 27070 1 259 . 1 1 55 55 THR N N 15 107.245 0.2 . 1 . . . . . 53 THR N . 27070 1 260 . 1 1 56 56 ALA H H 1 7.834 0.02 . 1 . . . . . 54 ALA HN . 27070 1 261 . 1 1 56 56 ALA C C 13 175.843 0.2 . 1 . . . . . 54 ALA C . 27070 1 262 . 1 1 56 56 ALA CA C 13 51.435 0.2 . 1 . . . . . 54 ALA CA . 27070 1 263 . 1 1 56 56 ALA CB C 13 19.832 0.2 . 1 . . . . . 54 ALA CB . 27070 1 264 . 1 1 56 56 ALA N N 15 125.902 0.2 . 1 . . . . . 54 ALA N . 27070 1 265 . 1 1 57 57 ASN H H 1 8.483 0.02 . 1 . . . . . 55 ASN HN . 27070 1 266 . 1 1 57 57 ASN C C 13 175.957 0.2 . 1 . . . . . 55 ASN C . 27070 1 267 . 1 1 57 57 ASN CA C 13 51.268 0.2 . 1 . . . . . 55 ASN CA . 27070 1 268 . 1 1 57 57 ASN CB C 13 39.662 0.2 . 1 . . . . . 55 ASN CB . 27070 1 269 . 1 1 57 57 ASN N N 15 119.683 0.2 . 1 . . . . . 55 ASN N . 27070 1 270 . 1 1 58 58 LYS C C 13 177.881 0.2 . 1 . . . . . 56 LYS C . 27070 1 271 . 1 1 58 58 LYS CA C 13 60.102 0.2 . 1 . . . . . 56 LYS CA . 27070 1 272 . 1 1 58 58 LYS CB C 13 32.06 0.2 . 1 . . . . . 56 LYS CB . 27070 1 273 . 1 1 59 59 ASP H H 1 8.364 0.02 . 1 . . . . . 57 ASP HN . 27070 1 274 . 1 1 59 59 ASP C C 13 178.89 0.2 . 1 . . . . . 57 ASP C . 27070 1 275 . 1 1 59 59 ASP CA C 13 58.25 0.2 . 1 . . . . . 57 ASP CA . 27070 1 276 . 1 1 59 59 ASP CB C 13 40.105 0.2 . 1 . . . . . 57 ASP CB . 27070 1 277 . 1 1 59 59 ASP N N 15 118.606 0.2 . 1 . . . . . 57 ASP N . 27070 1 278 . 1 1 60 60 HIS H H 1 8.058 0.02 . 1 . . . . . 58 HIS HN . 27070 1 279 . 1 1 60 60 HIS C C 13 178.471 0.2 . 1 . . . . . 58 HIS C . 27070 1 280 . 1 1 60 60 HIS CA C 13 59.139 0.2 . 1 . . . . . 58 HIS CA . 27070 1 281 . 1 1 60 60 HIS CB C 13 31.504 0.2 . 1 . . . . . 58 HIS CB . 27070 1 282 . 1 1 60 60 HIS N N 15 120.077 0.2 . 1 . . . . . 58 HIS N . 27070 1 283 . 1 1 61 61 LEU H H 1 7.908 0.02 . 1 . . . . . 59 LEU HN . 27070 1 284 . 1 1 61 61 LEU C C 13 178.241 0.2 . 1 . . . . . 59 LEU C . 27070 1 285 . 1 1 61 61 LEU CA C 13 57.564 0.2 . 1 . . . . . 59 LEU CA . 27070 1 286 . 1 1 61 61 LEU CB C 13 41.382 0.2 . 1 . . . . . 59 LEU CB . 27070 1 287 . 1 1 61 61 LEU N N 15 118.62 0.2 . 1 . . . . . 59 LEU N . 27070 1 288 . 1 1 62 62 VAL H H 1 8.714 0.02 . 1 . . . . . 60 VAL HN . 27070 1 289 . 1 1 62 62 VAL C C 13 177.648 0.2 . 1 . . . . . 60 VAL C . 27070 1 290 . 1 1 62 62 VAL CA C 13 67.481 0.2 . 1 . . . . . 60 VAL CA . 27070 1 291 . 1 1 62 62 VAL CB C 13 31.693 0.2 . 1 . . . . . 60 VAL CB . 27070 1 292 . 1 1 62 62 VAL N N 15 121.115 0.2 . 1 . . . . . 60 VAL N . 27070 1 293 . 1 1 63 63 THR H H 1 7.853 0.02 . 1 . . . . . 61 THR HN . 27070 1 294 . 1 1 63 63 THR C C 13 176.51 0.2 . 1 . . . . . 61 THR C . 27070 1 295 . 1 1 63 63 THR CA C 13 66.742 0.2 . 1 . . . . . 61 THR CA . 27070 1 296 . 1 1 63 63 THR CB C 13 68.382 0.2 . 1 . . . . . 61 THR CB . 27070 1 297 . 1 1 63 63 THR N N 15 115.756 0.2 . 1 . . . . . 61 THR N . 27070 1 298 . 1 1 64 64 ALA H H 1 8.237 0.02 . 1 . . . . . 62 ALA HN . 27070 1 299 . 1 1 64 64 ALA C C 13 178.13 0.2 . 1 . . . . . 62 ALA C . 27070 1 300 . 1 1 64 64 ALA CA C 13 55.675 0.2 . 1 . . . . . 62 ALA CA . 27070 1 301 . 1 1 64 64 ALA CB C 13 18.512 0.2 . 1 . . . . . 62 ALA CB . 27070 1 302 . 1 1 64 64 ALA N N 15 123.176 0.2 . 1 . . . . . 62 ALA N . 27070 1 303 . 1 1 65 65 TYR H H 1 8.8 0.02 . 1 . . . . . 63 TYR HN . 27070 1 304 . 1 1 65 65 TYR C C 13 176.803 0.2 . 1 . . . . . 63 TYR C . 27070 1 305 . 1 1 65 65 TYR CA C 13 62.793 0.2 . 1 . . . . . 63 TYR CA . 27070 1 306 . 1 1 65 65 TYR CB C 13 39.24 0.2 . 1 . . . . . 63 TYR CB . 27070 1 307 . 1 1 65 65 TYR N N 15 120.133 0.2 . 1 . . . . . 63 TYR N . 27070 1 308 . 1 1 66 66 ASN H H 1 8.629 0.02 . 1 . . . . . 64 ASN HN . 27070 1 309 . 1 1 66 66 ASN C C 13 178.892 0.2 . 1 . . . . . 64 ASN C . 27070 1 310 . 1 1 66 66 ASN CA C 13 56.305 0.2 . 1 . . . . . 64 ASN CA . 27070 1 311 . 1 1 66 66 ASN CB C 13 37.372 0.2 . 1 . . . . . 64 ASN CB . 27070 1 312 . 1 1 66 66 ASN N N 15 116.329 0.2 . 1 . . . . . 64 ASN N . 27070 1 313 . 1 1 67 67 HIS H H 1 8.974 0.02 . 1 . . . . . 65 HIS HN . 27070 1 314 . 1 1 67 67 HIS C C 13 178.577 0.2 . 1 . . . . . 65 HIS C . 27070 1 315 . 1 1 67 67 HIS CA C 13 58.325 0.2 . 1 . . . . . 65 HIS CA . 27070 1 316 . 1 1 67 67 HIS CB C 13 30.499 0.2 . 1 . . . . . 65 HIS CB . 27070 1 317 . 1 1 67 67 HIS N N 15 119.782 0.2 . 1 . . . . . 65 HIS N . 27070 1 318 . 1 1 68 68 LEU H H 1 8.609 0.02 . 1 . . . . . 66 LEU HN . 27070 1 319 . 1 1 68 68 LEU C C 13 177.096 0.2 . 1 . . . . . 66 LEU C . 27070 1 320 . 1 1 68 68 LEU CA C 13 58.608 0.2 . 1 . . . . . 66 LEU CA . 27070 1 321 . 1 1 68 68 LEU CB C 13 39.306 0.2 . 1 . . . . . 66 LEU CB . 27070 1 322 . 1 1 68 68 LEU N N 15 124.168 0.2 . 1 . . . . . 66 LEU N . 27070 1 323 . 1 1 69 69 PHE H H 1 6.954 0.02 . 1 . . . . . 67 PHE HN . 27070 1 324 . 1 1 69 69 PHE C C 13 177.872 0.2 . 1 . . . . . 67 PHE C . 27070 1 325 . 1 1 69 69 PHE CA C 13 62.588 0.2 . 1 . . . . . 67 PHE CA . 27070 1 326 . 1 1 69 69 PHE CB C 13 39.587 0.2 . 1 . . . . . 67 PHE CB . 27070 1 327 . 1 1 69 69 PHE N N 15 113.237 0.2 . 1 . . . . . 67 PHE N . 27070 1 328 . 1 1 70 70 GLU H H 1 8.408 0.02 . 1 . . . . . 68 GLU HN . 27070 1 329 . 1 1 70 70 GLU C C 13 178.57 0.2 . 1 . . . . . 68 GLU C . 27070 1 330 . 1 1 70 70 GLU CA C 13 59.237 0.2 . 1 . . . . . 68 GLU CA . 27070 1 331 . 1 1 70 70 GLU CB C 13 30.532 0.2 . 1 . . . . . 68 GLU CB . 27070 1 332 . 1 1 70 70 GLU N N 15 119.852 0.2 . 1 . . . . . 68 GLU N . 27070 1 333 . 1 1 71 71 THR H H 1 7.904 0.02 . 1 . . . . . 69 THR HN . 27070 1 334 . 1 1 71 71 THR C C 13 175.038 0.2 . 1 . . . . . 69 THR C . 27070 1 335 . 1 1 71 71 THR CA C 13 62.533 0.2 . 1 . . . . . 69 THR CA . 27070 1 336 . 1 1 71 71 THR CB C 13 70.878 0.2 . 1 . . . . . 69 THR CB . 27070 1 337 . 1 1 71 71 THR N N 15 106.189 0.2 . 1 . . . . . 69 THR N . 27070 1 338 . 1 1 72 72 LYS H H 1 7.682 0.02 . 1 . . . . . 70 LYS HN . 27070 1 339 . 1 1 72 72 LYS C C 13 176.942 0.2 . 1 . . . . . 70 LYS C . 27070 1 340 . 1 1 72 72 LYS CA C 13 56.921 0.2 . 1 . . . . . 70 LYS CA . 27070 1 341 . 1 1 72 72 LYS CB C 13 28.466 0.2 . 1 . . . . . 70 LYS CB . 27070 1 342 . 1 1 72 72 LYS N N 15 117.561 0.2 . 1 . . . . . 70 LYS N . 27070 1 343 . 1 1 73 73 ARG H H 1 6.299 0.02 . 1 . . . . . 71 ARG HN . 27070 1 344 . 1 1 73 73 ARG C C 13 174.62 0.2 . 1 . . . . . 71 ARG C . 27070 1 345 . 1 1 73 73 ARG CA C 13 55.367 0.2 . 1 . . . . . 71 ARG CA . 27070 1 346 . 1 1 73 73 ARG CB C 13 28.374 0.2 . 1 . . . . . 71 ARG CB . 27070 1 347 . 1 1 73 73 ARG N N 15 121.867 0.2 . 1 . . . . . 71 ARG N . 27070 1 348 . 1 1 74 74 PHE H H 1 7.145 0.02 . 1 . . . . . 72 PHE HN . 27070 1 349 . 1 1 74 74 PHE C C 13 177.472 0.2 . 1 . . . . . 72 PHE C . 27070 1 350 . 1 1 74 74 PHE CA C 13 56.171 0.2 . 1 . . . . . 72 PHE CA . 27070 1 351 . 1 1 74 74 PHE CB C 13 40.492 0.2 . 1 . . . . . 72 PHE CB . 27070 1 352 . 1 1 74 74 PHE N N 15 117.733 0.2 . 1 . . . . . 72 PHE N . 27070 1 353 . 1 1 75 75 LYS H H 1 8.128 0.02 . 1 . . . . . 73 LYS HN . 27070 1 354 . 1 1 75 75 LYS C C 13 177.121 0.2 . 1 . . . . . 73 LYS C . 27070 1 355 . 1 1 75 75 LYS CA C 13 58.315 0.2 . 1 . . . . . 73 LYS CA . 27070 1 356 . 1 1 75 75 LYS CB C 13 32.324 0.2 . 1 . . . . . 73 LYS CB . 27070 1 357 . 1 1 75 75 LYS N N 15 123.28 0.2 . 1 . . . . . 73 LYS N . 27070 1 358 . 1 1 76 76 GLY H H 1 8.966 0.02 . 1 . . . . . 74 GLY HN . 27070 1 359 . 1 1 76 76 GLY C C 13 175.168 0.2 . 1 . . . . . 74 GLY C . 27070 1 360 . 1 1 76 76 GLY CA C 13 45.499 0.2 . 1 . . . . . 74 GLY CA . 27070 1 361 . 1 1 76 76 GLY N N 15 112.228 0.2 . 1 . . . . . 74 GLY N . 27070 1 362 . 1 1 77 77 THR H H 1 7.884 0.02 . 1 . . . . . 75 THR HN . 27070 1 363 . 1 1 77 77 THR C C 13 174.889 0.2 . 1 . . . . . 75 THR C . 27070 1 364 . 1 1 77 77 THR CA C 13 62.298 0.2 . 1 . . . . . 75 THR CA . 27070 1 365 . 1 1 77 77 THR CB C 13 70.222 0.2 . 1 . . . . . 75 THR CB . 27070 1 366 . 1 1 77 77 THR N N 15 110.871 0.2 . 1 . . . . . 75 THR N . 27070 1 367 . 1 1 78 78 GLU H H 1 8.487 0.02 . 1 . . . . . 76 GLU HN . 27070 1 368 . 1 1 78 78 GLU C C 13 176.501 0.2 . 1 . . . . . 76 GLU C . 27070 1 369 . 1 1 78 78 GLU CA C 13 56.912 0.2 . 1 . . . . . 76 GLU CA . 27070 1 370 . 1 1 78 78 GLU CB C 13 30.358 0.2 . 1 . . . . . 76 GLU CB . 27070 1 371 . 1 1 78 78 GLU N N 15 122.518 0.2 . 1 . . . . . 76 GLU N . 27070 1 372 . 1 1 79 79 SER H H 1 8.435 0.02 . 1 . . . . . 77 SER HN . 27070 1 373 . 1 1 79 79 SER C C 13 174.547 0.2 . 1 . . . . . 77 SER C . 27070 1 374 . 1 1 79 79 SER CA C 13 58.385 0.2 . 1 . . . . . 77 SER CA . 27070 1 375 . 1 1 79 79 SER CB C 13 63.767 0.2 . 1 . . . . . 77 SER CB . 27070 1 376 . 1 1 79 79 SER N N 15 117.185 0.2 . 1 . . . . . 77 SER N . 27070 1 377 . 1 1 80 80 ILE H H 1 8.179 0.02 . 1 . . . . . 78 ILE HN . 27070 1 378 . 1 1 80 80 ILE C C 13 176.379 0.2 . 1 . . . . . 78 ILE C . 27070 1 379 . 1 1 80 80 ILE CA C 13 61.354 0.2 . 1 . . . . . 78 ILE CA . 27070 1 380 . 1 1 80 80 ILE CB C 13 38.79 0.2 . 1 . . . . . 78 ILE CB . 27070 1 381 . 1 1 80 80 ILE N N 15 122.606 0.2 . 1 . . . . . 78 ILE N . 27070 1 382 . 1 1 81 81 SER H H 1 8.378 0.02 . 1 . . . . . 79 SER HN . 27070 1 383 . 1 1 81 81 SER C C 13 174.498 0.2 . 1 . . . . . 79 SER C . 27070 1 384 . 1 1 81 81 SER CA C 13 58.356 0.2 . 1 . . . . . 79 SER CA . 27070 1 385 . 1 1 81 81 SER CB C 13 63.841 0.2 . 1 . . . . . 79 SER CB . 27070 1 386 . 1 1 81 81 SER N N 15 119.87 0.2 . 1 . . . . . 79 SER N . 27070 1 387 . 1 1 82 82 LYS H H 1 8.375 0.02 . 1 . . . . . 80 LYS HN . 27070 1 388 . 1 1 82 82 LYS C C 13 176.743 0.2 . 1 . . . . . 80 LYS C . 27070 1 389 . 1 1 82 82 LYS CA C 13 56.379 0.2 . 1 . . . . . 80 LYS CA . 27070 1 390 . 1 1 82 82 LYS CB C 13 33.009 0.2 . 1 . . . . . 80 LYS CB . 27070 1 391 . 1 1 82 82 LYS N N 15 124.05 0.2 . 1 . . . . . 80 LYS N . 27070 1 392 . 1 1 83 83 VAL H H 1 8.159 0.02 . 1 . . . . . 81 VAL HN . 27070 1 393 . 1 1 83 83 VAL C C 13 176.369 0.2 . 1 . . . . . 81 VAL C . 27070 1 394 . 1 1 83 83 VAL CA C 13 62.734 0.2 . 1 . . . . . 81 VAL CA . 27070 1 395 . 1 1 83 83 VAL CB C 13 32.766 0.2 . 1 . . . . . 81 VAL CB . 27070 1 396 . 1 1 83 83 VAL N N 15 121.478 0.2 . 1 . . . . . 81 VAL N . 27070 1 397 . 1 1 84 84 SER H H 1 8.351 0.02 . 1 . . . . . 82 SER HN . 27070 1 398 . 1 1 84 84 SER C C 13 174.67 0.2 . 1 . . . . . 82 SER C . 27070 1 399 . 1 1 84 84 SER CA C 13 58.61 0.2 . 1 . . . . . 82 SER CA . 27070 1 400 . 1 1 84 84 SER CB C 13 63.74 0.2 . 1 . . . . . 82 SER CB . 27070 1 401 . 1 1 84 84 SER N N 15 119.204 0.2 . 1 . . . . . 82 SER N . 27070 1 402 . 1 1 85 85 GLU H H 1 8.399 0.02 . 1 . . . . . 83 GLU HN . 27070 1 403 . 1 1 85 85 GLU C C 13 176.519 0.2 . 1 . . . . . 83 GLU C . 27070 1 404 . 1 1 85 85 GLU CA C 13 56.877 0.2 . 1 . . . . . 83 GLU CA . 27070 1 405 . 1 1 85 85 GLU CB C 13 30.326 0.2 . 1 . . . . . 83 GLU CB . 27070 1 406 . 1 1 85 85 GLU N N 15 123.071 0.2 . 1 . . . . . 83 GLU N . 27070 1 407 . 1 1 86 86 GLN H H 1 8.338 0.02 . 1 . . . . . 84 GLN HN . 27070 1 408 . 1 1 86 86 GLN C C 13 176.167 0.2 . 1 . . . . . 84 GLN C . 27070 1 409 . 1 1 86 86 GLN CA C 13 56.278 0.2 . 1 . . . . . 84 GLN CA . 27070 1 410 . 1 1 86 86 GLN CB C 13 29.268 0.2 . 1 . . . . . 84 GLN CB . 27070 1 411 . 1 1 86 86 GLN N N 15 121.21 0.2 . 1 . . . . . 84 GLN N . 27070 1 412 . 1 1 87 87 VAL H H 1 8.119 0.02 . 1 . . . . . 85 VAL HN . 27070 1 413 . 1 1 87 87 VAL C C 13 176.193 0.2 . 1 . . . . . 85 VAL C . 27070 1 414 . 1 1 87 87 VAL CA C 13 62.759 0.2 . 1 . . . . . 85 VAL CA . 27070 1 415 . 1 1 87 87 VAL CB C 13 32.463 0.2 . 1 . . . . . 85 VAL CB . 27070 1 416 . 1 1 87 87 VAL N N 15 121.521 0.2 . 1 . . . . . 85 VAL N . 27070 1 417 . 1 1 88 88 LYS H H 1 8.322 0.02 . 1 . . . . . 86 LYS HN . 27070 1 418 . 1 1 88 88 LYS C C 13 176.181 0.2 . 1 . . . . . 86 LYS C . 27070 1 419 . 1 1 88 88 LYS CA C 13 56.437 0.2 . 1 . . . . . 86 LYS CA . 27070 1 420 . 1 1 88 88 LYS CB C 13 33.129 0.2 . 1 . . . . . 86 LYS CB . 27070 1 421 . 1 1 88 88 LYS N N 15 124.661 0.2 . 1 . . . . . 86 LYS N . 27070 1 422 . 1 1 89 89 ASN H H 1 8.428 0.02 . 1 . . . . . 87 ASN HN . 27070 1 423 . 1 1 89 89 ASN C C 13 175.085 0.2 . 1 . . . . . 87 ASN C . 27070 1 424 . 1 1 89 89 ASN CA C 13 53.267 0.2 . 1 . . . . . 87 ASN CA . 27070 1 425 . 1 1 89 89 ASN CB C 13 38.869 0.2 . 1 . . . . . 87 ASN CB . 27070 1 426 . 1 1 89 89 ASN N N 15 120.186 0.2 . 1 . . . . . 87 ASN N . 27070 1 427 . 1 1 90 90 VAL H H 1 8.056 0.02 . 1 . . . . . 88 VAL HN . 27070 1 428 . 1 1 90 90 VAL C C 13 175.925 0.2 . 1 . . . . . 88 VAL C . 27070 1 429 . 1 1 90 90 VAL CA C 13 62.336 0.2 . 1 . . . . . 88 VAL CA . 27070 1 430 . 1 1 90 90 VAL CB C 13 32.693 0.2 . 1 . . . . . 88 VAL CB . 27070 1 431 . 1 1 90 90 VAL N N 15 120.733 0.2 . 1 . . . . . 88 VAL N . 27070 1 432 . 1 1 91 91 LYS H H 1 8.363 0.02 . 1 . . . . . 89 LYS HN . 27070 1 433 . 1 1 91 91 LYS C C 13 176.388 0.2 . 1 . . . . . 89 LYS C . 27070 1 434 . 1 1 91 91 LYS CA C 13 56.202 0.2 . 1 . . . . . 89 LYS CA . 27070 1 435 . 1 1 91 91 LYS CB C 13 32.834 0.2 . 1 . . . . . 89 LYS CB . 27070 1 436 . 1 1 91 91 LYS N N 15 125.443 0.2 . 1 . . . . . 89 LYS N . 27070 1 437 . 1 1 92 92 LEU H H 1 8.28 0.02 . 1 . . . . . 90 LEU HN . 27070 1 438 . 1 1 92 92 LEU C C 13 177.076 0.2 . 1 . . . . . 90 LEU C . 27070 1 439 . 1 1 92 92 LEU CA C 13 55.264 0.2 . 1 . . . . . 90 LEU CA . 27070 1 440 . 1 1 92 92 LEU CB C 13 42.493 0.2 . 1 . . . . . 90 LEU CB . 27070 1 441 . 1 1 92 92 LEU N N 15 123.96 0.2 . 1 . . . . . 90 LEU N . 27070 1 442 . 1 1 93 93 ASN H H 1 8.433 0.02 . 1 . . . . . 91 ASN HN . 27070 1 443 . 1 1 93 93 ASN C C 13 175.119 0.2 . 1 . . . . . 91 ASN C . 27070 1 444 . 1 1 93 93 ASN CA C 13 53.403 0.2 . 1 . . . . . 91 ASN CA . 27070 1 445 . 1 1 93 93 ASN CB C 13 38.95 0.2 . 1 . . . . . 91 ASN CB . 27070 1 446 . 1 1 93 93 ASN N N 15 119.22 0.2 . 1 . . . . . 91 ASN N . 27070 1 447 . 1 1 94 94 GLU H H 1 8.356 0.02 . 1 . . . . . 92 GLU HN . 27070 1 448 . 1 1 94 94 GLU C C 13 176 0.2 . 1 . . . . . 92 GLU C . 27070 1 449 . 1 1 94 94 GLU CA C 13 56.569 0.2 . 1 . . . . . 92 GLU CA . 27070 1 450 . 1 1 94 94 GLU CB C 13 30.458 0.2 . 1 . . . . . 92 GLU CB . 27070 1 451 . 1 1 94 94 GLU N N 15 121.48 0.2 . 1 . . . . . 92 GLU N . 27070 1 452 . 1 1 95 95 ASP H H 1 8.401 0.02 . 1 . . . . . 93 ASP HN . 27070 1 453 . 1 1 95 95 ASP C C 13 175.804 0.2 . 1 . . . . . 93 ASP C . 27070 1 454 . 1 1 95 95 ASP CA C 13 54.417 0.2 . 1 . . . . . 93 ASP CA . 27070 1 455 . 1 1 95 95 ASP CB C 13 41.123 0.2 . 1 . . . . . 93 ASP CB . 27070 1 456 . 1 1 95 95 ASP N N 15 121.751 0.2 . 1 . . . . . 93 ASP N . 27070 1 457 . 1 1 96 96 LYS H H 1 8.12 0.02 . 1 . . . . . 94 LYS HN . 27070 1 458 . 1 1 96 96 LYS C C 13 174.312 0.2 . 1 . . . . . 94 LYS C . 27070 1 459 . 1 1 96 96 LYS CA C 13 54.191 0.2 . 1 . . . . . 94 LYS CA . 27070 1 460 . 1 1 96 96 LYS CB C 13 32.516 0.2 . 1 . . . . . 94 LYS CB . 27070 1 461 . 1 1 96 96 LYS N N 15 122.594 0.2 . 1 . . . . . 94 LYS N . 27070 1 462 . 1 1 97 97 PRO C C 13 176.961 0.2 . 1 . . . . . 95 PRO C . 27070 1 463 . 1 1 97 97 PRO CA C 13 63.159 0.2 . 1 . . . . . 95 PRO CA . 27070 1 464 . 1 1 97 97 PRO CB C 13 32.25 0.2 . 1 . . . . . 95 PRO CB . 27070 1 465 . 1 1 98 98 LYS H H 1 8.473 0.02 . 1 . . . . . 96 LYS HN . 27070 1 466 . 1 1 98 98 LYS C C 13 176.727 0.2 . 1 . . . . . 96 LYS C . 27070 1 467 . 1 1 98 98 LYS CA C 13 56.532 0.2 . 1 . . . . . 96 LYS CA . 27070 1 468 . 1 1 98 98 LYS CB C 13 33.085 0.2 . 1 . . . . . 96 LYS CB . 27070 1 469 . 1 1 98 98 LYS N N 15 122.226 0.2 . 1 . . . . . 96 LYS N . 27070 1 470 . 1 1 99 99 GLU H H 1 8.491 0.02 . 1 . . . . . 97 GLU HN . 27070 1 471 . 1 1 99 99 GLU C C 13 176.528 0.2 . 1 . . . . . 97 GLU C . 27070 1 472 . 1 1 99 99 GLU CA C 13 56.57 0.2 . 1 . . . . . 97 GLU CA . 27070 1 473 . 1 1 99 99 GLU CB C 13 30.491 0.2 . 1 . . . . . 97 GLU CB . 27070 1 474 . 1 1 99 99 GLU N N 15 122.294 0.2 . 1 . . . . . 97 GLU N . 27070 1 475 . 1 1 100 100 THR H H 1 8.266 0.02 . 1 . . . . . 98 THR HN . 27070 1 476 . 1 1 100 100 THR C C 13 174.323 0.2 . 1 . . . . . 98 THR C . 27070 1 477 . 1 1 100 100 THR CA C 13 61.872 0.2 . 1 . . . . . 98 THR CA . 27070 1 478 . 1 1 100 100 THR CB C 13 69.949 0.2 . 1 . . . . . 98 THR CB . 27070 1 479 . 1 1 100 100 THR N N 15 116.241 0.2 . 1 . . . . . 98 THR N . 27070 1 480 . 1 1 101 101 LYS H H 1 8.452 0.02 . 1 . . . . . 99 LYS HN . 27070 1 481 . 1 1 101 101 LYS C C 13 176.464 0.2 . 1 . . . . . 99 LYS C . 27070 1 482 . 1 1 101 101 LYS CA C 13 56.205 0.2 . 1 . . . . . 99 LYS CA . 27070 1 483 . 1 1 101 101 LYS CB C 13 33.133 0.2 . 1 . . . . . 99 LYS CB . 27070 1 484 . 1 1 101 101 LYS N N 15 124.649 0.2 . 1 . . . . . 99 LYS N . 27070 1 485 . 1 1 102 102 SER H H 1 8.464 0.02 . 1 . . . . . 100 SER HN . 27070 1 486 . 1 1 102 102 SER C C 13 174.628 0.2 . 1 . . . . . 100 SER C . 27070 1 487 . 1 1 102 102 SER CA C 13 58.496 0.2 . 1 . . . . . 100 SER CA . 27070 1 488 . 1 1 102 102 SER CB C 13 63.785 0.2 . 1 . . . . . 100 SER CB . 27070 1 489 . 1 1 102 102 SER N N 15 118.348 0.2 . 1 . . . . . 100 SER N . 27070 1 490 . 1 1 103 103 GLU H H 1 8.583 0.02 . 1 . . . . . 101 GLU HN . 27070 1 491 . 1 1 103 103 GLU C C 13 176.439 0.2 . 1 . . . . . 101 GLU C . 27070 1 492 . 1 1 103 103 GLU CA C 13 56.722 0.2 . 1 . . . . . 101 GLU CA . 27070 1 493 . 1 1 103 103 GLU CB C 13 30.142 0.2 . 1 . . . . . 101 GLU CB . 27070 1 494 . 1 1 103 103 GLU N N 15 123.067 0.2 . 1 . . . . . 101 GLU N . 27070 1 495 . 1 1 104 104 GLU H H 1 8.413 0.02 . 1 . . . . . 102 GLU HN . 27070 1 496 . 1 1 104 104 GLU C C 13 176.5 0.2 . 1 . . . . . 102 GLU C . 27070 1 497 . 1 1 104 104 GLU CA C 13 56.649 0.2 . 1 . . . . . 102 GLU CA . 27070 1 498 . 1 1 104 104 GLU CB C 13 30.475 0.2 . 1 . . . . . 102 GLU CB . 27070 1 499 . 1 1 104 104 GLU N N 15 122.084 0.2 . 1 . . . . . 102 GLU N . 27070 1 500 . 1 1 105 105 THR H H 1 8.265 0.02 . 1 . . . . . 103 THR HN . 27070 1 501 . 1 1 105 105 THR C C 13 174.322 0.2 . 1 . . . . . 103 THR C . 27070 1 502 . 1 1 105 105 THR CA C 13 61.859 0.2 . 1 . . . . . 103 THR CA . 27070 1 503 . 1 1 105 105 THR CB C 13 69.683 0.2 . 1 . . . . . 103 THR CB . 27070 1 504 . 1 1 105 105 THR N N 15 116.443 0.2 . 1 . . . . . 103 THR N . 27070 1 505 . 1 1 106 106 LEU H H 1 8.349 0.02 . 1 . . . . . 104 LEU HN . 27070 1 506 . 1 1 106 106 LEU C C 13 176.864 0.2 . 1 . . . . . 104 LEU C . 27070 1 507 . 1 1 106 106 LEU CA C 13 55.034 0.2 . 1 . . . . . 104 LEU CA . 27070 1 508 . 1 1 106 106 LEU CB C 13 42.436 0.2 . 1 . . . . . 104 LEU CB . 27070 1 509 . 1 1 106 106 LEU N N 15 125.465 0.2 . 1 . . . . . 104 LEU N . 27070 1 510 . 1 1 107 107 ASP H H 1 8.38 0.02 . 1 . . . . . 105 ASP HN . 27070 1 511 . 1 1 107 107 ASP C C 13 176.13 0.2 . 1 . . . . . 105 ASP C . 27070 1 512 . 1 1 107 107 ASP CA C 13 54.237 0.2 . 1 . . . . . 105 ASP CA . 27070 1 513 . 1 1 107 107 ASP CB C 13 41.172 0.2 . 1 . . . . . 105 ASP CB . 27070 1 514 . 1 1 107 107 ASP N N 15 122.161 0.2 . 1 . . . . . 105 ASP N . 27070 1 515 . 1 1 108 108 GLU C C 13 176.761 0.2 . 1 . . . . . 106 GLU C . 27070 1 516 . 1 1 108 108 GLU CA C 13 56.532 0.2 . 1 . . . . . 106 GLU CA . 27070 1 517 . 1 1 108 108 GLU CB C 13 30.651 0.2 . 1 . . . . . 106 GLU CB . 27070 1 518 . 1 1 109 109 GLY H H 1 8.303 0.02 . 1 . . . . . 107 GLY HN . 27070 1 519 . 1 1 109 109 GLY C C 13 171.094 0.2 . 1 . . . . . 107 GLY C . 27070 1 520 . 1 1 109 109 GLY CA C 13 44.555 0.2 . 1 . . . . . 107 GLY CA . 27070 1 521 . 1 1 109 109 GLY N N 15 109.99 0.2 . 1 . . . . . 107 GLY N . 27070 1 522 . 1 1 112 112 LYS C C 13 174.024 0.2 . 1 . . . . . 110 LYS C . 27070 1 523 . 1 1 112 112 LYS CA C 13 54.717 0.2 . 1 . . . . . 110 LYS CA . 27070 1 524 . 1 1 112 112 LYS CB C 13 29.916 0.2 . 1 . . . . . 110 LYS CB . 27070 1 525 . 1 1 113 113 TYR H H 1 6.871 0.02 . 1 . . . . . 111 TYR HN . 27070 1 526 . 1 1 113 113 TYR C C 13 173.341 0.2 . 1 . . . . . 111 TYR C . 27070 1 527 . 1 1 113 113 TYR CA C 13 56.09 0.2 . 1 . . . . . 111 TYR CA . 27070 1 528 . 1 1 113 113 TYR CB C 13 42.205 0.2 . 1 . . . . . 111 TYR CB . 27070 1 529 . 1 1 113 113 TYR N N 15 111.822 0.2 . 1 . . . . . 111 TYR N . 27070 1 530 . 1 1 114 114 THR H H 1 8.829 0.02 . 1 . . . . . 112 THR HN . 27070 1 531 . 1 1 114 114 THR C C 13 173.179 0.2 . 1 . . . . . 112 THR C . 27070 1 532 . 1 1 114 114 THR CA C 13 60.905 0.2 . 1 . . . . . 112 THR CA . 27070 1 533 . 1 1 114 114 THR CB C 13 71.535 0.2 . 1 . . . . . 112 THR CB . 27070 1 534 . 1 1 114 114 THR N N 15 112.573 0.2 . 1 . . . . . 112 THR N . 27070 1 535 . 1 1 115 115 LYS H H 1 9.142 0.02 . 1 . . . . . 113 LYS HN . 27070 1 536 . 1 1 115 115 LYS C C 13 175.2 0.2 . 1 . . . . . 113 LYS C . 27070 1 537 . 1 1 115 115 LYS CA C 13 55.331 0.2 . 1 . . . . . 113 LYS CA . 27070 1 538 . 1 1 115 115 LYS CB C 13 36.442 0.2 . 1 . . . . . 113 LYS CB . 27070 1 539 . 1 1 115 115 LYS N N 15 125.74 0.2 . 1 . . . . . 113 LYS N . 27070 1 540 . 1 1 116 116 SER H H 1 9.121 0.02 . 1 . . . . . 114 SER HN . 27070 1 541 . 1 1 116 116 SER C C 13 173.855 0.2 . 1 . . . . . 114 SER C . 27070 1 542 . 1 1 116 116 SER CA C 13 56.797 0.2 . 1 . . . . . 114 SER CA . 27070 1 543 . 1 1 116 116 SER CB C 13 64.624 0.2 . 1 . . . . . 114 SER CB . 27070 1 544 . 1 1 116 116 SER N N 15 122.919 0.2 . 1 . . . . . 114 SER N . 27070 1 545 . 1 1 117 117 VAL H H 1 9.267 0.02 . 1 . . . . . 115 VAL HN . 27070 1 546 . 1 1 117 117 VAL C C 13 175.712 0.2 . 1 . . . . . 115 VAL C . 27070 1 547 . 1 1 117 117 VAL CA C 13 65.304 0.2 . 1 . . . . . 115 VAL CA . 27070 1 548 . 1 1 117 117 VAL CB C 13 31.677 0.2 . 1 . . . . . 115 VAL CB . 27070 1 549 . 1 1 117 117 VAL N N 15 127.904 0.2 . 1 . . . . . 115 VAL N . 27070 1 550 . 1 1 118 118 LEU H H 1 9.184 0.02 . 1 . . . . . 116 LEU HN . 27070 1 551 . 1 1 118 118 LEU C C 13 177.319 0.2 . 1 . . . . . 116 LEU C . 27070 1 552 . 1 1 118 118 LEU CA C 13 55.727 0.2 . 1 . . . . . 116 LEU CA . 27070 1 553 . 1 1 118 118 LEU CB C 13 42.245 0.2 . 1 . . . . . 116 LEU CB . 27070 1 554 . 1 1 118 118 LEU N N 15 130.074 0.2 . 1 . . . . . 116 LEU N . 27070 1 555 . 1 1 119 119 LYS H H 1 8.13 0.02 . 1 . . . . . 117 LYS HN . 27070 1 556 . 1 1 119 119 LYS C C 13 174.745 0.2 . 1 . . . . . 117 LYS C . 27070 1 557 . 1 1 119 119 LYS CA C 13 55.909 0.2 . 1 . . . . . 117 LYS CA . 27070 1 558 . 1 1 119 119 LYS CB C 13 35.906 0.2 . 1 . . . . . 117 LYS CB . 27070 1 559 . 1 1 119 119 LYS N N 15 121.234 0.2 . 1 . . . . . 117 LYS N . 27070 1 560 . 1 1 120 120 LYS H H 1 8.742 0.02 . 1 . . . . . 118 LYS HN . 27070 1 561 . 1 1 120 120 LYS C C 13 177.438 0.2 . 1 . . . . . 118 LYS C . 27070 1 562 . 1 1 120 120 LYS CA C 13 57.74 0.2 . 1 . . . . . 118 LYS CA . 27070 1 563 . 1 1 120 120 LYS CB C 13 33.245 0.2 . 1 . . . . . 118 LYS CB . 27070 1 564 . 1 1 120 120 LYS N N 15 126.121 0.2 . 1 . . . . . 118 LYS N . 27070 1 565 . 1 1 121 121 GLY H H 1 8.93 0.02 . 1 . . . . . 119 GLY HN . 27070 1 566 . 1 1 121 121 GLY C C 13 173.619 0.2 . 1 . . . . . 119 GLY C . 27070 1 567 . 1 1 121 121 GLY CA C 13 44.059 0.2 . 1 . . . . . 119 GLY CA . 27070 1 568 . 1 1 121 121 GLY N N 15 109.882 0.2 . 1 . . . . . 119 GLY N . 27070 1 569 . 1 1 122 122 ASP H H 1 8.301 0.02 . 1 . . . . . 120 ASP HN . 27070 1 570 . 1 1 122 122 ASP C C 13 178.479 0.2 . 1 . . . . . 120 ASP C . 27070 1 571 . 1 1 122 122 ASP CA C 13 54.624 0.2 . 1 . . . . . 120 ASP CA . 27070 1 572 . 1 1 122 122 ASP CB C 13 40.42 0.2 . 1 . . . . . 120 ASP CB . 27070 1 573 . 1 1 122 122 ASP N N 15 117.591 0.2 . 1 . . . . . 120 ASP N . 27070 1 574 . 1 1 123 123 LYS H H 1 8.866 0.02 . 1 . . . . . 121 LYS HN . 27070 1 575 . 1 1 123 123 LYS C C 13 174.972 0.2 . 1 . . . . . 121 LYS C . 27070 1 576 . 1 1 123 123 LYS CA C 13 58.15 0.2 . 1 . . . . . 121 LYS CA . 27070 1 577 . 1 1 123 123 LYS CB C 13 30.673 0.2 . 1 . . . . . 121 LYS CB . 27070 1 578 . 1 1 123 123 LYS N N 15 116.048 0.2 . 1 . . . . . 121 LYS N . 27070 1 579 . 1 1 124 124 THR H H 1 9.037 0.02 . 1 . . . . . 122 THR HN . 27070 1 580 . 1 1 124 124 THR C C 13 172.785 0.2 . 1 . . . . . 122 THR C . 27070 1 581 . 1 1 124 124 THR CA C 13 64.734 0.2 . 1 . . . . . 122 THR CA . 27070 1 582 . 1 1 124 124 THR CB C 13 72.154 0.2 . 1 . . . . . 122 THR CB . 27070 1 583 . 1 1 124 124 THR N N 15 114.781 0.2 . 1 . . . . . 122 THR N . 27070 1 584 . 1 1 125 125 ASN H H 1 9.831 0.02 . 1 . . . . . 123 ASN HN . 27070 1 585 . 1 1 125 125 ASN C C 13 171.661 0.2 . 1 . . . . . 123 ASN C . 27070 1 586 . 1 1 125 125 ASN CA C 13 53.631 0.2 . 1 . . . . . 123 ASN CA . 27070 1 587 . 1 1 125 125 ASN CB C 13 39.618 0.2 . 1 . . . . . 123 ASN CB . 27070 1 588 . 1 1 125 125 ASN N N 15 125.266 0.2 . 1 . . . . . 123 ASN N . 27070 1 589 . 1 1 126 126 PHE H H 1 8.442 0.02 . 1 . . . . . 124 PHE HN . 27070 1 590 . 1 1 126 126 PHE C C 13 176.801 0.2 . 1 . . . . . 124 PHE C . 27070 1 591 . 1 1 126 126 PHE CA C 13 54.324 0.2 . 1 . . . . . 124 PHE CA . 27070 1 592 . 1 1 126 126 PHE CB C 13 41.233 0.2 . 1 . . . . . 124 PHE CB . 27070 1 593 . 1 1 126 126 PHE N N 15 122.442 0.2 . 1 . . . . . 124 PHE N . 27070 1 594 . 1 1 127 127 PRO C C 13 174.293 0.2 . 1 . . . . . 125 PRO C . 27070 1 595 . 1 1 127 127 PRO CA C 13 62.46 0.2 . 1 . . . . . 125 PRO CA . 27070 1 596 . 1 1 127 127 PRO CB C 13 32.688 0.2 . 1 . . . . . 125 PRO CB . 27070 1 597 . 1 1 128 128 LYS H H 1 9.159 0.02 . 1 . . . . . 126 LYS HN . 27070 1 598 . 1 1 128 128 LYS C C 13 175.678 0.2 . 1 . . . . . 126 LYS C . 27070 1 599 . 1 1 128 128 LYS CA C 13 53.452 0.2 . 1 . . . . . 126 LYS CA . 27070 1 600 . 1 1 128 128 LYS CB C 13 34.509 0.2 . 1 . . . . . 126 LYS CB . 27070 1 601 . 1 1 128 128 LYS N N 15 121.42 0.2 . 1 . . . . . 126 LYS N . 27070 1 602 . 1 1 129 129 LYS H H 1 8.483 0.02 . 1 . . . . . 127 LYS HN . 27070 1 603 . 1 1 129 129 LYS C C 13 177.743 0.2 . 1 . . . . . 127 LYS C . 27070 1 604 . 1 1 129 129 LYS CA C 13 59.305 0.2 . 1 . . . . . 127 LYS CA . 27070 1 605 . 1 1 129 129 LYS CB C 13 31.892 0.2 . 1 . . . . . 127 LYS CB . 27070 1 606 . 1 1 129 129 LYS N N 15 119.144 0.2 . 1 . . . . . 127 LYS N . 27070 1 607 . 1 1 130 130 GLY H H 1 9.24 0.02 . 1 . . . . . 128 GLY HN . 27070 1 608 . 1 1 130 130 GLY C C 13 174.09 0.2 . 1 . . . . . 128 GLY C . 27070 1 609 . 1 1 130 130 GLY CA C 13 45.165 0.2 . 1 . . . . . 128 GLY CA . 27070 1 610 . 1 1 130 130 GLY N N 15 114.932 0.2 . 1 . . . . . 128 GLY N . 27070 1 611 . 1 1 131 131 ASP H H 1 8.318 0.02 . 1 . . . . . 129 ASP HN . 27070 1 612 . 1 1 131 131 ASP C C 13 174.977 0.2 . 1 . . . . . 129 ASP C . 27070 1 613 . 1 1 131 131 ASP CA C 13 54.887 0.2 . 1 . . . . . 129 ASP CA . 27070 1 614 . 1 1 131 131 ASP CB C 13 41.405 0.2 . 1 . . . . . 129 ASP CB . 27070 1 615 . 1 1 131 131 ASP N N 15 121.998 0.2 . 1 . . . . . 129 ASP N . 27070 1 616 . 1 1 132 132 VAL H H 1 8.601 0.02 . 1 . . . . . 130 VAL HN . 27070 1 617 . 1 1 132 132 VAL C C 13 175.315 0.2 . 1 . . . . . 130 VAL C . 27070 1 618 . 1 1 132 132 VAL CA C 13 62.515 0.2 . 1 . . . . . 130 VAL CA . 27070 1 619 . 1 1 132 132 VAL CB C 13 31.919 0.2 . 1 . . . . . 130 VAL CB . 27070 1 620 . 1 1 132 132 VAL N N 15 120.929 0.2 . 1 . . . . . 130 VAL N . 27070 1 621 . 1 1 133 133 VAL H H 1 8.035 0.02 . 1 . . . . . 131 VAL HN . 27070 1 622 . 1 1 133 133 VAL C C 13 173.404 0.2 . 1 . . . . . 131 VAL C . 27070 1 623 . 1 1 133 133 VAL CA C 13 58.055 0.2 . 1 . . . . . 131 VAL CA . 27070 1 624 . 1 1 133 133 VAL CB C 13 33.625 0.2 . 1 . . . . . 131 VAL CB . 27070 1 625 . 1 1 133 133 VAL N N 15 117.397 0.2 . 1 . . . . . 131 VAL N . 27070 1 626 . 1 1 134 134 HIS H H 1 7.365 0.02 . 1 . . . . . 132 HIS HN . 27070 1 627 . 1 1 134 134 HIS C C 13 176.747 0.2 . 1 . . . . . 132 HIS C . 27070 1 628 . 1 1 134 134 HIS CA C 13 54.123 0.2 . 1 . . . . . 132 HIS CA . 27070 1 629 . 1 1 134 134 HIS CB C 13 33.289 0.2 . 1 . . . . . 132 HIS CB . 27070 1 630 . 1 1 134 134 HIS N N 15 117.147 0.2 . 1 . . . . . 132 HIS N . 27070 1 631 . 1 1 135 135 CYS H H 1 9.573 0.02 . 1 . . . . . 133 CYS HN . 27070 1 632 . 1 1 135 135 CYS C C 13 175.028 0.2 . 1 . . . . . 133 CYS C . 27070 1 633 . 1 1 135 135 CYS CA C 13 57.389 0.2 . 1 . . . . . 133 CYS CA . 27070 1 634 . 1 1 135 135 CYS CB C 13 33.334 0.2 . 1 . . . . . 133 CYS CB . 27070 1 635 . 1 1 135 135 CYS N N 15 117.984 0.2 . 1 . . . . . 133 CYS N . 27070 1 636 . 1 1 136 136 TRP H H 1 8.717 0.02 . 1 . . . . . 134 TRP HN . 27070 1 637 . 1 1 136 136 TRP C C 13 176.415 0.2 . 1 . . . . . 134 TRP C . 27070 1 638 . 1 1 136 136 TRP CA C 13 55.49 0.2 . 1 . . . . . 134 TRP CA . 27070 1 639 . 1 1 136 136 TRP CB C 13 32.883 0.2 . 1 . . . . . 134 TRP CB . 27070 1 640 . 1 1 136 136 TRP N N 15 124.133 0.2 . 1 . . . . . 134 TRP N . 27070 1 641 . 1 1 137 137 TYR H H 1 9.87 0.02 . 1 . . . . . 135 TYR HN . 27070 1 642 . 1 1 137 137 TYR C C 13 173.279 0.2 . 1 . . . . . 135 TYR C . 27070 1 643 . 1 1 137 137 TYR CA C 13 57.117 0.2 . 1 . . . . . 135 TYR CA . 27070 1 644 . 1 1 137 137 TYR CB C 13 43.827 0.2 . 1 . . . . . 135 TYR CB . 27070 1 645 . 1 1 137 137 TYR N N 15 121.343 0.2 . 1 . . . . . 135 TYR N . 27070 1 646 . 1 1 138 138 THR H H 1 8.593 0.02 . 1 . . . . . 136 THR HN . 27070 1 647 . 1 1 138 138 THR C C 13 173.127 0.2 . 1 . . . . . 136 THR C . 27070 1 648 . 1 1 138 138 THR CA C 13 63.423 0.2 . 1 . . . . . 136 THR CA . 27070 1 649 . 1 1 138 138 THR CB C 13 72.012 0.2 . 1 . . . . . 136 THR CB . 27070 1 650 . 1 1 138 138 THR N N 15 115.856 0.2 . 1 . . . . . 136 THR N . 27070 1 651 . 1 1 139 139 GLY H H 1 9.355 0.02 . 1 . . . . . 137 GLY HN . 27070 1 652 . 1 1 139 139 GLY C C 13 171.851 0.2 . 1 . . . . . 137 GLY C . 27070 1 653 . 1 1 139 139 GLY CA C 13 45.039 0.2 . 1 . . . . . 137 GLY CA . 27070 1 654 . 1 1 139 139 GLY N N 15 118.046 0.2 . 1 . . . . . 137 GLY N . 27070 1 655 . 1 1 140 140 THR H H 1 9.413 0.02 . 1 . . . . . 138 THR HN . 27070 1 656 . 1 1 140 140 THR C C 13 175.366 0.2 . 1 . . . . . 138 THR C . 27070 1 657 . 1 1 140 140 THR CA C 13 59.423 0.2 . 1 . . . . . 138 THR CA . 27070 1 658 . 1 1 140 140 THR N N 15 117.64 0.2 . 1 . . . . . 138 THR N . 27070 1 659 . 1 1 141 141 LEU H H 1 8.668 0.02 . 1 . . . . . 139 LEU HN . 27070 1 660 . 1 1 141 141 LEU C C 13 180.473 0.2 . 1 . . . . . 139 LEU C . 27070 1 661 . 1 1 141 141 LEU CA C 13 53.668 0.2 . 1 . . . . . 139 LEU CA . 27070 1 662 . 1 1 141 141 LEU CB C 13 42.717 0.2 . 1 . . . . . 139 LEU CB . 27070 1 663 . 1 1 141 141 LEU N N 15 120.07 0.2 . 1 . . . . . 139 LEU N . 27070 1 664 . 1 1 142 142 GLN H H 1 9.695 0.02 . 1 . . . . . 140 GLN HN . 27070 1 665 . 1 1 142 142 GLN C C 13 176.615 0.2 . 1 . . . . . 140 GLN C . 27070 1 666 . 1 1 142 142 GLN CA C 13 58.843 0.2 . 1 . . . . . 140 GLN CA . 27070 1 667 . 1 1 142 142 GLN CB C 13 28.396 0.2 . 1 . . . . . 140 GLN CB . 27070 1 668 . 1 1 142 142 GLN N N 15 121.69 0.2 . 1 . . . . . 140 GLN N . 27070 1 669 . 1 1 143 143 ASP H H 1 7.741 0.02 . 1 . . . . . 141 ASP HN . 27070 1 670 . 1 1 143 143 ASP C C 13 177.113 0.2 . 1 . . . . . 141 ASP C . 27070 1 671 . 1 1 143 143 ASP CA C 13 53.412 0.2 . 1 . . . . . 141 ASP CA . 27070 1 672 . 1 1 143 143 ASP CB C 13 39.964 0.2 . 1 . . . . . 141 ASP CB . 27070 1 673 . 1 1 143 143 ASP N N 15 115.721 0.2 . 1 . . . . . 141 ASP N . 27070 1 674 . 1 1 144 144 GLY H H 1 8.185 0.02 . 1 . . . . . 142 GLY HN . 27070 1 675 . 1 1 144 144 GLY C C 13 174.565 0.2 . 1 . . . . . 142 GLY C . 27070 1 676 . 1 1 144 144 GLY CA C 13 44.701 0.2 . 1 . . . . . 142 GLY CA . 27070 1 677 . 1 1 144 144 GLY N N 15 108.267 0.2 . 1 . . . . . 142 GLY N . 27070 1 678 . 1 1 145 145 THR H H 1 8.175 0.02 . 1 . . . . . 143 THR HN . 27070 1 679 . 1 1 145 145 THR C C 13 174.185 0.2 . 1 . . . . . 143 THR C . 27070 1 680 . 1 1 145 145 THR CA C 13 64.652 0.2 . 1 . . . . . 143 THR CA . 27070 1 681 . 1 1 145 145 THR CB C 13 69.292 0.2 . 1 . . . . . 143 THR CB . 27070 1 682 . 1 1 145 145 THR N N 15 118.549 0.2 . 1 . . . . . 143 THR N . 27070 1 683 . 1 1 146 146 VAL H H 1 8.839 0.02 . 1 . . . . . 144 VAL HN . 27070 1 684 . 1 1 146 146 VAL C C 13 176.447 0.2 . 1 . . . . . 144 VAL C . 27070 1 685 . 1 1 146 146 VAL CA C 13 62.325 0.2 . 1 . . . . . 144 VAL CA . 27070 1 686 . 1 1 146 146 VAL CB C 13 32.135 0.2 . 1 . . . . . 144 VAL CB . 27070 1 687 . 1 1 146 146 VAL N N 15 129.159 0.2 . 1 . . . . . 144 VAL N . 27070 1 688 . 1 1 147 147 PHE H H 1 8.209 0.02 . 1 . . . . . 145 PHE HN . 27070 1 689 . 1 1 147 147 PHE C C 13 175.165 0.2 . 1 . . . . . 145 PHE C . 27070 1 690 . 1 1 147 147 PHE CA C 13 56.557 0.2 . 1 . . . . . 145 PHE CA . 27070 1 691 . 1 1 147 147 PHE CB C 13 40.034 0.2 . 1 . . . . . 145 PHE CB . 27070 1 692 . 1 1 147 147 PHE N N 15 125.788 0.2 . 1 . . . . . 145 PHE N . 27070 1 693 . 1 1 148 148 ASP H H 1 6.736 0.02 . 1 . . . . . 146 ASP HN . 27070 1 694 . 1 1 148 148 ASP C C 13 173.346 0.2 . 1 . . . . . 146 ASP C . 27070 1 695 . 1 1 148 148 ASP CA C 13 54.988 0.2 . 1 . . . . . 146 ASP CA . 27070 1 696 . 1 1 148 148 ASP CB C 13 43.888 0.2 . 1 . . . . . 146 ASP CB . 27070 1 697 . 1 1 148 148 ASP N N 15 119.395 0.2 . 1 . . . . . 146 ASP N . 27070 1 698 . 1 1 149 149 THR H H 1 8.124 0.02 . 1 . . . . . 147 THR HN . 27070 1 699 . 1 1 149 149 THR C C 13 171.118 0.2 . 1 . . . . . 147 THR C . 27070 1 700 . 1 1 149 149 THR CA C 13 59.899 0.2 . 1 . . . . . 147 THR CA . 27070 1 701 . 1 1 149 149 THR N N 15 119.759 0.2 . 1 . . . . . 147 THR N . 27070 1 702 . 1 1 150 150 ASN H H 1 7.717 0.02 . 1 . . . . . 148 ASN HN . 27070 1 703 . 1 1 150 150 ASN C C 13 174.737 0.2 . 1 . . . . . 148 ASN C . 27070 1 704 . 1 1 150 150 ASN CA C 13 51.427 0.2 . 1 . . . . . 148 ASN CA . 27070 1 705 . 1 1 150 150 ASN CB C 13 38.587 0.2 . 1 . . . . . 148 ASN CB . 27070 1 706 . 1 1 150 150 ASN N N 15 123.191 0.2 . 1 . . . . . 148 ASN N . 27070 1 707 . 1 1 151 151 ILE H H 1 8.307 0.02 . 1 . . . . . 149 ILE HN . 27070 1 708 . 1 1 151 151 ILE C C 13 176.44 0.2 . 1 . . . . . 149 ILE C . 27070 1 709 . 1 1 151 151 ILE CA C 13 61.248 0.2 . 1 . . . . . 149 ILE CA . 27070 1 710 . 1 1 151 151 ILE CB C 13 38.364 0.2 . 1 . . . . . 149 ILE CB . 27070 1 711 . 1 1 151 151 ILE N N 15 121.854 0.2 . 1 . . . . . 149 ILE N . 27070 1 712 . 1 1 152 152 GLN H H 1 8.254 0.02 . 1 . . . . . 150 GLN HN . 27070 1 713 . 1 1 152 152 GLN CA C 13 54.923 0.2 . 1 . . . . . 150 GLN CA . 27070 1 714 . 1 1 152 152 GLN CB C 13 29.266 0.2 . 1 . . . . . 150 GLN CB . 27070 1 715 . 1 1 152 152 GLN N N 15 126.09 0.2 . 1 . . . . . 150 GLN N . 27070 1 716 . 1 1 153 153 THR C C 13 174.967 0.2 . 1 . . . . . 151 THR C . 27070 1 717 . 1 1 153 153 THR CA C 13 62.12 0.2 . 1 . . . . . 151 THR CA . 27070 1 718 . 1 1 153 153 THR CB C 13 69.774 0.2 . 1 . . . . . 151 THR CB . 27070 1 719 . 1 1 154 154 SER H H 1 8.187 0.02 . 1 . . . . . 152 SER HN . 27070 1 720 . 1 1 154 154 SER C C 13 174.862 0.2 . 1 . . . . . 152 SER C . 27070 1 721 . 1 1 154 154 SER CA C 13 58.207 0.2 . 1 . . . . . 152 SER CA . 27070 1 722 . 1 1 154 154 SER N N 15 117.456 0.2 . 1 . . . . . 152 SER N . 27070 1 723 . 1 1 155 155 ALA C C 13 178.718 0.2 . 1 . . . . . 153 ALA C . 27070 1 724 . 1 1 155 155 ALA CA C 13 54.161 0.2 . 1 . . . . . 153 ALA CA . 27070 1 725 . 1 1 155 155 ALA CB C 13 18.874 0.2 . 1 . . . . . 153 ALA CB . 27070 1 726 . 1 1 156 156 LYS H H 1 8.095 0.02 . 1 . . . . . 154 LYS HN . 27070 1 727 . 1 1 156 156 LYS C C 13 177.126 0.2 . 1 . . . . . 154 LYS C . 27070 1 728 . 1 1 156 156 LYS CA C 13 57.286 0.2 . 1 . . . . . 154 LYS CA . 27070 1 729 . 1 1 156 156 LYS CB C 13 32.709 0.2 . 1 . . . . . 154 LYS CB . 27070 1 730 . 1 1 156 156 LYS N N 15 117.651 0.2 . 1 . . . . . 154 LYS N . 27070 1 731 . 1 1 157 157 LYS H H 1 7.776 0.02 . 1 . . . . . 155 LYS HN . 27070 1 732 . 1 1 157 157 LYS C C 13 177.254 0.2 . 1 . . . . . 155 LYS C . 27070 1 733 . 1 1 157 157 LYS CA C 13 56.889 0.2 . 1 . . . . . 155 LYS CA . 27070 1 734 . 1 1 157 157 LYS CB C 13 32.939 0.2 . 1 . . . . . 155 LYS CB . 27070 1 735 . 1 1 157 157 LYS N N 15 119.581 0.2 . 1 . . . . . 155 LYS N . 27070 1 736 . 1 1 158 158 LYS H H 1 8.246 0.02 . 1 . . . . . 156 LYS HN . 27070 1 737 . 1 1 158 158 LYS C C 13 177.253 0.2 . 1 . . . . . 156 LYS C . 27070 1 738 . 1 1 158 158 LYS CA C 13 57.521 0.2 . 1 . . . . . 156 LYS CA . 27070 1 739 . 1 1 158 158 LYS CB C 13 33.035 0.2 . 1 . . . . . 156 LYS CB . 27070 1 740 . 1 1 158 158 LYS N N 15 121.427 0.2 . 1 . . . . . 156 LYS N . 27070 1 741 . 1 1 159 159 LYS H H 1 8.064 0.02 . 1 . . . . . 157 LYS HN . 27070 1 742 . 1 1 159 159 LYS C C 13 176.57 0.2 . 1 . . . . . 157 LYS C . 27070 1 743 . 1 1 159 159 LYS CA C 13 57.584 0.2 . 1 . . . . . 157 LYS CA . 27070 1 744 . 1 1 159 159 LYS CB C 13 32.821 0.2 . 1 . . . . . 157 LYS CB . 27070 1 745 . 1 1 159 159 LYS N N 15 120.736 0.2 . 1 . . . . . 157 LYS N . 27070 1 746 . 1 1 160 160 ASN H H 1 8.192 0.02 . 1 . . . . . 158 ASN HN . 27070 1 747 . 1 1 160 160 ASN C C 13 174.659 0.2 . 1 . . . . . 158 ASN C . 27070 1 748 . 1 1 160 160 ASN CA C 13 53.05 0.2 . 1 . . . . . 158 ASN CA . 27070 1 749 . 1 1 160 160 ASN CB C 13 38.835 0.2 . 1 . . . . . 158 ASN CB . 27070 1 750 . 1 1 160 160 ASN N N 15 117.47 0.2 . 1 . . . . . 158 ASN N . 27070 1 751 . 1 1 161 161 ALA H H 1 7.834 0.02 . 1 . . . . . 159 ALA HN . 27070 1 752 . 1 1 161 161 ALA C C 13 177.047 0.2 . 1 . . . . . 159 ALA C . 27070 1 753 . 1 1 161 161 ALA CA C 13 52.856 0.2 . 1 . . . . . 159 ALA CA . 27070 1 754 . 1 1 161 161 ALA CB C 13 19.9 0.2 . 1 . . . . . 159 ALA CB . 27070 1 755 . 1 1 161 161 ALA N N 15 123.995 0.2 . 1 . . . . . 159 ALA N . 27070 1 756 . 1 1 162 162 LYS H H 1 8.52 0.02 . 1 . . . . . 160 LYS HN . 27070 1 757 . 1 1 162 162 LYS C C 13 173.351 0.2 . 1 . . . . . 160 LYS C . 27070 1 758 . 1 1 162 162 LYS CA C 13 53.403 0.2 . 1 . . . . . 160 LYS CA . 27070 1 759 . 1 1 162 162 LYS CB C 13 33.917 0.2 . 1 . . . . . 160 LYS CB . 27070 1 760 . 1 1 162 162 LYS N N 15 121.653 0.2 . 1 . . . . . 160 LYS N . 27070 1 761 . 1 1 163 163 PRO C C 13 175.664 0.2 . 1 . . . . . 161 PRO C . 27070 1 762 . 1 1 163 163 PRO CA C 13 61.901 0.2 . 1 . . . . . 161 PRO CA . 27070 1 763 . 1 1 163 163 PRO CB C 13 31.003 0.2 . 1 . . . . . 161 PRO CB . 27070 1 764 . 1 1 164 164 LEU H H 1 8.062 0.02 . 1 . . . . . 162 LEU HN . 27070 1 765 . 1 1 164 164 LEU C C 13 175.798 0.2 . 1 . . . . . 162 LEU C . 27070 1 766 . 1 1 164 164 LEU CA C 13 55.507 0.2 . 1 . . . . . 162 LEU CA . 27070 1 767 . 1 1 164 164 LEU CB C 13 43.379 0.2 . 1 . . . . . 162 LEU CB . 27070 1 768 . 1 1 164 164 LEU N N 15 123.536 0.2 . 1 . . . . . 162 LEU N . 27070 1 769 . 1 1 165 165 SER H H 1 8.516 0.02 . 1 . . . . . 163 SER HN . 27070 1 770 . 1 1 165 165 SER C C 13 174.107 0.2 . 1 . . . . . 163 SER C . 27070 1 771 . 1 1 165 165 SER CA C 13 55.437 0.2 . 1 . . . . . 163 SER CA . 27070 1 772 . 1 1 165 165 SER CB C 13 65.25 0.2 . 1 . . . . . 163 SER CB . 27070 1 773 . 1 1 165 165 SER N N 15 122.74 0.2 . 1 . . . . . 163 SER N . 27070 1 774 . 1 1 166 166 PHE H H 1 7.728 0.02 . 1 . . . . . 164 PHE HN . 27070 1 775 . 1 1 166 166 PHE C C 13 172.228 0.2 . 1 . . . . . 164 PHE C . 27070 1 776 . 1 1 166 166 PHE CA C 13 55.829 0.2 . 1 . . . . . 164 PHE CA . 27070 1 777 . 1 1 166 166 PHE CB C 13 39.68 0.2 . 1 . . . . . 164 PHE CB . 27070 1 778 . 1 1 166 166 PHE N N 15 118.536 0.2 . 1 . . . . . 164 PHE N . 27070 1 779 . 1 1 167 167 LYS H H 1 8.354 0.02 . 1 . . . . . 165 LYS HN . 27070 1 780 . 1 1 167 167 LYS C C 13 175.511 0.2 . 1 . . . . . 165 LYS C . 27070 1 781 . 1 1 167 167 LYS CA C 13 55.561 0.2 . 1 . . . . . 165 LYS CA . 27070 1 782 . 1 1 167 167 LYS CB C 13 33.808 0.2 . 1 . . . . . 165 LYS CB . 27070 1 783 . 1 1 167 167 LYS N N 15 120.588 0.2 . 1 . . . . . 165 LYS N . 27070 1 784 . 1 1 168 168 VAL H H 1 8.974 0.02 . 1 . . . . . 166 VAL HN . 27070 1 785 . 1 1 168 168 VAL C C 13 175.479 0.2 . 1 . . . . . 166 VAL C . 27070 1 786 . 1 1 168 168 VAL CA C 13 62.007 0.2 . 1 . . . . . 166 VAL CA . 27070 1 787 . 1 1 168 168 VAL CB C 13 33.692 0.2 . 1 . . . . . 166 VAL CB . 27070 1 788 . 1 1 168 168 VAL N N 15 126.336 0.2 . 1 . . . . . 166 VAL N . 27070 1 789 . 1 1 169 169 GLY H H 1 9.658 0.02 . 1 . . . . . 167 GLY HN . 27070 1 790 . 1 1 169 169 GLY C C 13 174.592 0.2 . 1 . . . . . 167 GLY C . 27070 1 791 . 1 1 169 169 GLY CA C 13 46.108 0.2 . 1 . . . . . 167 GLY CA . 27070 1 792 . 1 1 169 169 GLY N N 15 115.735 0.2 . 1 . . . . . 167 GLY N . 27070 1 793 . 1 1 170 170 VAL H H 1 8.319 0.02 . 1 . . . . . 168 VAL HN . 27070 1 794 . 1 1 170 170 VAL C C 13 176.455 0.2 . 1 . . . . . 168 VAL C . 27070 1 795 . 1 1 170 170 VAL CA C 13 59.683 0.2 . 1 . . . . . 168 VAL CA . 27070 1 796 . 1 1 170 170 VAL CB C 13 32.059 0.2 . 1 . . . . . 168 VAL CB . 27070 1 797 . 1 1 170 170 VAL N N 15 111.166 0.2 . 1 . . . . . 168 VAL N . 27070 1 798 . 1 1 171 171 GLY H H 1 8.98 0.02 . 1 . . . . . 169 GLY HN . 27070 1 799 . 1 1 171 171 GLY C C 13 176.25 0.2 . 1 . . . . . 169 GLY C . 27070 1 800 . 1 1 171 171 GLY CA C 13 46.522 0.2 . 1 . . . . . 169 GLY CA . 27070 1 801 . 1 1 171 171 GLY N N 15 113.668 0.2 . 1 . . . . . 169 GLY N . 27070 1 802 . 1 1 172 172 LYS H H 1 9.585 0.02 . 1 . . . . . 170 LYS HN . 27070 1 803 . 1 1 172 172 LYS C C 13 176.153 0.2 . 1 . . . . . 170 LYS C . 27070 1 804 . 1 1 172 172 LYS CA C 13 56.597 0.2 . 1 . . . . . 170 LYS CA . 27070 1 805 . 1 1 172 172 LYS CB C 13 31.546 0.2 . 1 . . . . . 170 LYS CB . 27070 1 806 . 1 1 172 172 LYS N N 15 120.653 0.2 . 1 . . . . . 170 LYS N . 27070 1 807 . 1 1 173 173 VAL H H 1 6.523 0.02 . 1 . . . . . 171 VAL HN . 27070 1 808 . 1 1 173 173 VAL C C 13 175.075 0.2 . 1 . . . . . 171 VAL C . 27070 1 809 . 1 1 173 173 VAL N N 15 107.638 0.2 . 1 . . . . . 171 VAL N . 27070 1 810 . 1 1 174 174 ILE H H 1 7.39 0.02 . 1 . . . . . 172 ILE HN . 27070 1 811 . 1 1 174 174 ILE C C 13 176.731 0.2 . 1 . . . . . 172 ILE C . 27070 1 812 . 1 1 174 174 ILE CA C 13 62.079 0.2 . 1 . . . . . 172 ILE CA . 27070 1 813 . 1 1 174 174 ILE CB C 13 38.296 0.2 . 1 . . . . . 172 ILE CB . 27070 1 814 . 1 1 174 174 ILE N N 15 111.058 0.2 . 1 . . . . . 172 ILE N . 27070 1 815 . 1 1 175 175 ARG H H 1 8.541 0.02 . 1 . . . . . 173 ARG HN . 27070 1 816 . 1 1 175 175 ARG C C 13 178.298 0.2 . 1 . . . . . 173 ARG C . 27070 1 817 . 1 1 175 175 ARG CA C 13 59.721 0.2 . 1 . . . . . 173 ARG CA . 27070 1 818 . 1 1 175 175 ARG CB C 13 29.668 0.2 . 1 . . . . . 173 ARG CB . 27070 1 819 . 1 1 175 175 ARG N N 15 124.582 0.2 . 1 . . . . . 173 ARG N . 27070 1 820 . 1 1 176 176 GLY H H 1 9.471 0.02 . 1 . . . . . 174 GLY HN . 27070 1 821 . 1 1 176 176 GLY C C 13 173.135 0.2 . 1 . . . . . 174 GLY C . 27070 1 822 . 1 1 176 176 GLY CA C 13 48.005 0.2 . 1 . . . . . 174 GLY CA . 27070 1 823 . 1 1 176 176 GLY N N 15 100.295 0.2 . 1 . . . . . 174 GLY N . 27070 1 824 . 1 1 177 177 TRP H H 1 6.985 0.02 . 1 . . . . . 175 TRP HN . 27070 1 825 . 1 1 177 177 TRP C C 13 176.249 0.2 . 1 . . . . . 175 TRP C . 27070 1 826 . 1 1 177 177 TRP CA C 13 58.376 0.2 . 1 . . . . . 175 TRP CA . 27070 1 827 . 1 1 177 177 TRP CB C 13 29.97 0.2 . 1 . . . . . 175 TRP CB . 27070 1 828 . 1 1 177 177 TRP N N 15 119.02 0.2 . 1 . . . . . 175 TRP N . 27070 1 829 . 1 1 178 178 ASP H H 1 7.694 0.02 . 1 . . . . . 176 ASP HN . 27070 1 830 . 1 1 178 178 ASP C C 13 178.179 0.2 . 1 . . . . . 176 ASP C . 27070 1 831 . 1 1 178 178 ASP CA C 13 57.558 0.2 . 1 . . . . . 176 ASP CA . 27070 1 832 . 1 1 178 178 ASP CB C 13 42.056 0.2 . 1 . . . . . 176 ASP CB . 27070 1 833 . 1 1 178 178 ASP N N 15 120.914 0.2 . 1 . . . . . 176 ASP N . 27070 1 834 . 1 1 179 179 GLU H H 1 8.214 0.02 . 1 . . . . . 177 GLU HN . 27070 1 835 . 1 1 179 179 GLU C C 13 180.243 0.2 . 1 . . . . . 177 GLU C . 27070 1 836 . 1 1 179 179 GLU CA C 13 58.571 0.2 . 1 . . . . . 177 GLU CA . 27070 1 837 . 1 1 179 179 GLU CB C 13 29.428 0.2 . 1 . . . . . 177 GLU CB . 27070 1 838 . 1 1 179 179 GLU N N 15 111.052 0.2 . 1 . . . . . 177 GLU N . 27070 1 839 . 1 1 180 180 ALA H H 1 7.388 0.02 . 1 . . . . . 178 ALA HN . 27070 1 840 . 1 1 180 180 ALA C C 13 182.475 0.2 . 1 . . . . . 178 ALA C . 27070 1 841 . 1 1 180 180 ALA CA C 13 54.91 0.2 . 1 . . . . . 178 ALA CA . 27070 1 842 . 1 1 180 180 ALA CB C 13 20.443 0.2 . 1 . . . . . 178 ALA CB . 27070 1 843 . 1 1 180 180 ALA N N 15 120.979 0.2 . 1 . . . . . 178 ALA N . 27070 1 844 . 1 1 181 181 LEU H H 1 8.199 0.02 . 1 . . . . . 179 LEU HN . 27070 1 845 . 1 1 181 181 LEU C C 13 177.695 0.2 . 1 . . . . . 179 LEU C . 27070 1 846 . 1 1 181 181 LEU CA C 13 58.302 0.2 . 1 . . . . . 179 LEU CA . 27070 1 847 . 1 1 181 181 LEU CB C 13 42.906 0.2 . 1 . . . . . 179 LEU CB . 27070 1 848 . 1 1 181 181 LEU N N 15 119.901 0.2 . 1 . . . . . 179 LEU N . 27070 1 849 . 1 1 182 182 LEU H H 1 6.775 0.02 . 1 . . . . . 180 LEU HN . 27070 1 850 . 1 1 182 182 LEU C C 13 177.99 0.2 . 1 . . . . . 180 LEU C . 27070 1 851 . 1 1 182 182 LEU CA C 13 56.62 0.2 . 1 . . . . . 180 LEU CA . 27070 1 852 . 1 1 182 182 LEU CB C 13 41.165 0.2 . 1 . . . . . 180 LEU CB . 27070 1 853 . 1 1 182 182 LEU N N 15 111.961 0.2 . 1 . . . . . 180 LEU N . 27070 1 854 . 1 1 183 183 THR H H 1 7.857 0.02 . 1 . . . . . 181 THR HN . 27070 1 855 . 1 1 183 183 THR C C 13 174.639 0.2 . 1 . . . . . 181 THR C . 27070 1 856 . 1 1 183 183 THR N N 15 106.129 0.2 . 1 . . . . . 181 THR N . 27070 1 857 . 1 1 184 184 MET H H 1 7.712 0.02 . 1 . . . . . 182 MET HN . 27070 1 858 . 1 1 184 184 MET C C 13 172.177 0.2 . 1 . . . . . 182 MET C . 27070 1 859 . 1 1 184 184 MET CA C 13 55.758 0.2 . 1 . . . . . 182 MET CA . 27070 1 860 . 1 1 184 184 MET CB C 13 35.257 0.2 . 1 . . . . . 182 MET CB . 27070 1 861 . 1 1 184 184 MET N N 15 125.821 0.2 . 1 . . . . . 182 MET N . 27070 1 862 . 1 1 185 185 SER H H 1 7.374 0.02 . 1 . . . . . 183 SER HN . 27070 1 863 . 1 1 185 185 SER C C 13 175.268 0.2 . 1 . . . . . 183 SER C . 27070 1 864 . 1 1 185 185 SER CA C 13 54.883 0.2 . 1 . . . . . 183 SER CA . 27070 1 865 . 1 1 185 185 SER N N 15 110.098 0.2 . 1 . . . . . 183 SER N . 27070 1 866 . 1 1 186 186 LYS H H 1 8.026 0.02 . 1 . . . . . 184 LYS HN . 27070 1 867 . 1 1 186 186 LYS C C 13 176.389 0.2 . 1 . . . . . 184 LYS C . 27070 1 868 . 1 1 186 186 LYS CA C 13 60.572 0.2 . 1 . . . . . 184 LYS CA . 27070 1 869 . 1 1 186 186 LYS CB C 13 32.717 0.2 . 1 . . . . . 184 LYS CB . 27070 1 870 . 1 1 186 186 LYS N N 15 120.955 0.2 . 1 . . . . . 184 LYS N . 27070 1 871 . 1 1 187 187 GLY H H 1 8.921 0.02 . 1 . . . . . 185 GLY HN . 27070 1 872 . 1 1 187 187 GLY C C 13 174.023 0.2 . 1 . . . . . 185 GLY C . 27070 1 873 . 1 1 187 187 GLY CA C 13 44.861 0.2 . 1 . . . . . 185 GLY CA . 27070 1 874 . 1 1 187 187 GLY N N 15 117.593 0.2 . 1 . . . . . 185 GLY N . 27070 1 875 . 1 1 188 188 GLU H H 1 8.716 0.02 . 1 . . . . . 186 GLU HN . 27070 1 876 . 1 1 188 188 GLU C C 13 174.992 0.2 . 1 . . . . . 186 GLU C . 27070 1 877 . 1 1 188 188 GLU CA C 13 56.669 0.2 . 1 . . . . . 186 GLU CA . 27070 1 878 . 1 1 188 188 GLU CB C 13 32.99 0.2 . 1 . . . . . 186 GLU CB . 27070 1 879 . 1 1 188 188 GLU N N 15 123.657 0.2 . 1 . . . . . 186 GLU N . 27070 1 880 . 1 1 189 189 LYS H H 1 8.867 0.02 . 1 . . . . . 187 LYS HN . 27070 1 881 . 1 1 189 189 LYS C C 13 175.101 0.2 . 1 . . . . . 187 LYS C . 27070 1 882 . 1 1 189 189 LYS CA C 13 54.318 0.2 . 1 . . . . . 187 LYS CA . 27070 1 883 . 1 1 189 189 LYS CB C 13 36.44 0.2 . 1 . . . . . 187 LYS CB . 27070 1 884 . 1 1 189 189 LYS N N 15 124.181 0.2 . 1 . . . . . 187 LYS N . 27070 1 885 . 1 1 190 190 ALA H H 1 9.582 0.02 . 1 . . . . . 188 ALA HN . 27070 1 886 . 1 1 190 190 ALA C C 13 174.291 0.2 . 1 . . . . . 188 ALA C . 27070 1 887 . 1 1 190 190 ALA CA C 13 50.571 0.2 . 1 . . . . . 188 ALA CA . 27070 1 888 . 1 1 190 190 ALA CB C 13 23.66 0.2 . 1 . . . . . 188 ALA CB . 27070 1 889 . 1 1 190 190 ALA N N 15 129.203 0.2 . 1 . . . . . 188 ALA N . 27070 1 890 . 1 1 191 191 ARG H H 1 9.304 0.02 . 1 . . . . . 189 ARG HN . 27070 1 891 . 1 1 191 191 ARG C C 13 175.243 0.2 . 1 . . . . . 189 ARG C . 27070 1 892 . 1 1 191 191 ARG CA C 13 54.802 0.2 . 1 . . . . . 189 ARG CA . 27070 1 893 . 1 1 191 191 ARG CB C 13 32.31 0.2 . 1 . . . . . 189 ARG CB . 27070 1 894 . 1 1 191 191 ARG N N 15 121.663 0.2 . 1 . . . . . 189 ARG N . 27070 1 895 . 1 1 192 192 LEU H H 1 10.08 0.02 . 1 . . . . . 190 LEU HN . 27070 1 896 . 1 1 192 192 LEU C C 13 175.844 0.2 . 1 . . . . . 190 LEU C . 27070 1 897 . 1 1 192 192 LEU CA C 13 52.515 0.2 . 1 . . . . . 190 LEU CA . 27070 1 898 . 1 1 192 192 LEU CB C 13 44.582 0.2 . 1 . . . . . 190 LEU CB . 27070 1 899 . 1 1 192 192 LEU N N 15 128.328 0.2 . 1 . . . . . 190 LEU N . 27070 1 900 . 1 1 193 193 GLU H H 1 8.731 0.02 . 1 . . . . . 191 GLU HN . 27070 1 901 . 1 1 193 193 GLU C C 13 176.801 0.2 . 1 . . . . . 191 GLU C . 27070 1 902 . 1 1 193 193 GLU CA C 13 55.594 0.2 . 1 . . . . . 191 GLU CA . 27070 1 903 . 1 1 193 193 GLU CB C 13 30.837 0.2 . 1 . . . . . 191 GLU CB . 27070 1 904 . 1 1 193 193 GLU N N 15 123.467 0.2 . 1 . . . . . 191 GLU N . 27070 1 905 . 1 1 194 194 ILE H H 1 9.706 0.02 . 1 . . . . . 192 ILE HN . 27070 1 906 . 1 1 194 194 ILE C C 13 174.74 0.2 . 1 . . . . . 192 ILE C . 27070 1 907 . 1 1 194 194 ILE CA C 13 61.616 0.2 . 1 . . . . . 192 ILE CA . 27070 1 908 . 1 1 194 194 ILE CB C 13 41.336 0.2 . 1 . . . . . 192 ILE CB . 27070 1 909 . 1 1 194 194 ILE N N 15 126.397 0.2 . 1 . . . . . 192 ILE N . 27070 1 910 . 1 1 195 195 GLU H H 1 8.308 0.02 . 1 . . . . . 193 GLU HN . 27070 1 911 . 1 1 195 195 GLU C C 13 175.536 0.2 . 1 . . . . . 193 GLU C . 27070 1 912 . 1 1 195 195 GLU N N 15 125.479 0.2 . 1 . . . . . 193 GLU N . 27070 1 913 . 1 1 196 196 PRO C C 13 180.062 0.2 . 1 . . . . . 194 PRO C . 27070 1 914 . 1 1 196 196 PRO CA C 13 65.334 0.2 . 1 . . . . . 194 PRO CA . 27070 1 915 . 1 1 197 197 GLU H H 1 9.701 0.02 . 1 . . . . . 195 GLU HN . 27070 1 916 . 1 1 197 197 GLU C C 13 178.022 0.2 . 1 . . . . . 195 GLU C . 27070 1 917 . 1 1 197 197 GLU CA C 13 59.988 0.2 . 1 . . . . . 195 GLU CA . 27070 1 918 . 1 1 197 197 GLU CB C 13 29.069 0.2 . 1 . . . . . 195 GLU CB . 27070 1 919 . 1 1 197 197 GLU N N 15 117.738 0.2 . 1 . . . . . 195 GLU N . 27070 1 920 . 1 1 198 198 TRP H H 1 8.047 0.02 . 1 . . . . . 196 TRP HN . 27070 1 921 . 1 1 198 198 TRP C C 13 172.656 0.2 . 1 . . . . . 196 TRP C . 27070 1 922 . 1 1 198 198 TRP CA C 13 55.963 0.2 . 1 . . . . . 196 TRP CA . 27070 1 923 . 1 1 198 198 TRP CB C 13 28.602 0.2 . 1 . . . . . 196 TRP CB . 27070 1 924 . 1 1 198 198 TRP N N 15 119.904 0.2 . 1 . . . . . 196 TRP N . 27070 1 925 . 1 1 199 199 ALA H H 1 8.033 0.02 . 1 . . . . . 197 ALA HN . 27070 1 926 . 1 1 199 199 ALA C C 13 176.191 0.2 . 1 . . . . . 197 ALA C . 27070 1 927 . 1 1 199 199 ALA CA C 13 51.593 0.2 . 1 . . . . . 197 ALA CA . 27070 1 928 . 1 1 199 199 ALA CB C 13 18.822 0.2 . 1 . . . . . 197 ALA CB . 27070 1 929 . 1 1 199 199 ALA N N 15 124.756 0.2 . 1 . . . . . 197 ALA N . 27070 1 930 . 1 1 200 200 TYR H H 1 9.534 0.02 . 1 . . . . . 198 TYR HN . 27070 1 931 . 1 1 200 200 TYR C C 13 176.834 0.2 . 1 . . . . . 198 TYR C . 27070 1 932 . 1 1 200 200 TYR CA C 13 59.233 0.2 . 1 . . . . . 198 TYR CA . 27070 1 933 . 1 1 200 200 TYR CB C 13 37.743 0.2 . 1 . . . . . 198 TYR CB . 27070 1 934 . 1 1 200 200 TYR N N 15 122.214 0.2 . 1 . . . . . 198 TYR N . 27070 1 935 . 1 1 201 201 GLY H H 1 8.502 0.02 . 1 . . . . . 199 GLY HN . 27070 1 936 . 1 1 201 201 GLY C C 13 175.638 0.2 . 1 . . . . . 199 GLY C . 27070 1 937 . 1 1 201 201 GLY CA C 13 46.871 0.2 . 1 . . . . . 199 GLY CA . 27070 1 938 . 1 1 201 201 GLY N N 15 108.141 0.2 . 1 . . . . . 199 GLY N . 27070 1 939 . 1 1 202 202 LYS C C 13 177.216 0.2 . 1 . . . . . 200 LYS C . 27070 1 940 . 1 1 202 202 LYS CA C 13 58.594 0.2 . 1 . . . . . 200 LYS CA . 27070 1 941 . 1 1 202 202 LYS CB C 13 33.042 0.2 . 1 . . . . . 200 LYS CB . 27070 1 942 . 1 1 203 203 LYS H H 1 8.282 0.02 . 1 . . . . . 201 LYS HN . 27070 1 943 . 1 1 203 203 LYS C C 13 179.332 0.2 . 1 . . . . . 201 LYS C . 27070 1 944 . 1 1 203 203 LYS CA C 13 57.916 0.2 . 1 . . . . . 201 LYS CA . 27070 1 945 . 1 1 203 203 LYS CB C 13 33.216 0.2 . 1 . . . . . 201 LYS CB . 27070 1 946 . 1 1 203 203 LYS N N 15 116.529 0.2 . 1 . . . . . 201 LYS N . 27070 1 947 . 1 1 204 204 GLY H H 1 7.179 0.02 . 1 . . . . . 202 GLY HN . 27070 1 948 . 1 1 204 204 GLY C C 13 171.762 0.2 . 1 . . . . . 202 GLY C . 27070 1 949 . 1 1 204 204 GLY CA C 13 44.809 0.2 . 1 . . . . . 202 GLY CA . 27070 1 950 . 1 1 204 204 GLY N N 15 103.231 0.2 . 1 . . . . . 202 GLY N . 27070 1 951 . 1 1 205 205 GLN H H 1 8.389 0.02 . 1 . . . . . 203 GLN HN . 27070 1 952 . 1 1 205 205 GLN CA C 13 53.663 0.2 . 1 . . . . . 203 GLN CA . 27070 1 953 . 1 1 205 205 GLN CB C 13 30.219 0.2 . 1 . . . . . 203 GLN CB . 27070 1 954 . 1 1 205 205 GLN N N 15 120.124 0.2 . 1 . . . . . 203 GLN N . 27070 1 955 . 1 1 206 206 PRO C C 13 176.47 0.2 . 1 . . . . . 204 PRO C . 27070 1 956 . 1 1 206 206 PRO CA C 13 65.619 0.2 . 1 . . . . . 204 PRO CA . 27070 1 957 . 1 1 206 206 PRO CB C 13 33.321 0.2 . 1 . . . . . 204 PRO CB . 27070 1 958 . 1 1 207 207 ASP H H 1 8.466 0.02 . 1 . . . . . 205 ASP HN . 27070 1 959 . 1 1 207 207 ASP C C 13 176.471 0.2 . 1 . . . . . 205 ASP C . 27070 1 960 . 1 1 207 207 ASP CA C 13 56.593 0.2 . 1 . . . . . 205 ASP CA . 27070 1 961 . 1 1 207 207 ASP CB C 13 40.144 0.2 . 1 . . . . . 205 ASP CB . 27070 1 962 . 1 1 207 207 ASP N N 15 118.154 0.2 . 1 . . . . . 205 ASP N . 27070 1 963 . 1 1 208 208 ALA H H 1 7.546 0.02 . 1 . . . . . 206 ALA HN . 27070 1 964 . 1 1 208 208 ALA C C 13 175.364 0.2 . 1 . . . . . 206 ALA C . 27070 1 965 . 1 1 208 208 ALA CA C 13 51.099 0.2 . 1 . . . . . 206 ALA CA . 27070 1 966 . 1 1 208 208 ALA CB C 13 19.512 0.2 . 1 . . . . . 206 ALA CB . 27070 1 967 . 1 1 208 208 ALA N N 15 121.736 0.2 . 1 . . . . . 206 ALA N . 27070 1 968 . 1 1 209 209 LYS H H 1 7.666 0.02 . 1 . . . . . 207 LYS HN . 27070 1 969 . 1 1 209 209 LYS C C 13 175.13 0.2 . 1 . . . . . 207 LYS C . 27070 1 970 . 1 1 209 209 LYS CA C 13 57.265 0.2 . 1 . . . . . 207 LYS CA . 27070 1 971 . 1 1 209 209 LYS CB C 13 28.787 0.2 . 1 . . . . . 207 LYS CB . 27070 1 972 . 1 1 209 209 LYS N N 15 111.684 0.2 . 1 . . . . . 207 LYS N . 27070 1 973 . 1 1 210 210 ILE H H 1 7.397 0.02 . 1 . . . . . 208 ILE HN . 27070 1 974 . 1 1 210 210 ILE C C 13 175.082 0.2 . 1 . . . . . 208 ILE C . 27070 1 975 . 1 1 210 210 ILE CA C 13 58.223 0.2 . 1 . . . . . 208 ILE CA . 27070 1 976 . 1 1 210 210 ILE CB C 13 38.548 0.2 . 1 . . . . . 208 ILE CB . 27070 1 977 . 1 1 210 210 ILE N N 15 119.098 0.2 . 1 . . . . . 208 ILE N . 27070 1 978 . 1 1 212 212 PRO C C 13 176.013 0.2 . 1 . . . . . 210 PRO C . 27070 1 979 . 1 1 212 212 PRO CA C 13 63.649 0.2 . 1 . . . . . 210 PRO CA . 27070 1 980 . 1 1 212 212 PRO CB C 13 33.219 0.2 . 1 . . . . . 210 PRO CB . 27070 1 981 . 1 1 213 213 ASN H H 1 8.282 0.02 . 1 . . . . . 211 ASN HN . 27070 1 982 . 1 1 213 213 ASN C C 13 173.096 0.2 . 1 . . . . . 211 ASN C . 27070 1 983 . 1 1 213 213 ASN CA C 13 54.37 0.2 . 1 . . . . . 211 ASN CA . 27070 1 984 . 1 1 213 213 ASN CB C 13 37.338 0.2 . 1 . . . . . 211 ASN CB . 27070 1 985 . 1 1 213 213 ASN N N 15 117.527 0.2 . 1 . . . . . 211 ASN N . 27070 1 986 . 1 1 214 214 ALA H H 1 7.823 0.02 . 1 . . . . . 212 ALA HN . 27070 1 987 . 1 1 214 214 ALA C C 13 176.213 0.2 . 1 . . . . . 212 ALA C . 27070 1 988 . 1 1 214 214 ALA CA C 13 52.407 0.2 . 1 . . . . . 212 ALA CA . 27070 1 989 . 1 1 214 214 ALA CB C 13 20.292 0.2 . 1 . . . . . 212 ALA CB . 27070 1 990 . 1 1 214 214 ALA N N 15 121.041 0.2 . 1 . . . . . 212 ALA N . 27070 1 991 . 1 1 215 215 LYS H H 1 8.484 0.02 . 1 . . . . . 213 LYS HN . 27070 1 992 . 1 1 215 215 LYS C C 13 176.776 0.2 . 1 . . . . . 213 LYS C . 27070 1 993 . 1 1 215 215 LYS CA C 13 56.254 0.2 . 1 . . . . . 213 LYS CA . 27070 1 994 . 1 1 215 215 LYS CB C 13 32.753 0.2 . 1 . . . . . 213 LYS CB . 27070 1 995 . 1 1 215 215 LYS N N 15 125.691 0.2 . 1 . . . . . 213 LYS N . 27070 1 996 . 1 1 216 216 LEU H H 1 8.505 0.02 . 1 . . . . . 214 LEU HN . 27070 1 997 . 1 1 216 216 LEU C C 13 175.56 0.2 . 1 . . . . . 214 LEU C . 27070 1 998 . 1 1 216 216 LEU CA C 13 53.797 0.2 . 1 . . . . . 214 LEU CA . 27070 1 999 . 1 1 216 216 LEU CB C 13 45.966 0.2 . 1 . . . . . 214 LEU CB . 27070 1 1000 . 1 1 216 216 LEU N N 15 125.819 0.2 . 1 . . . . . 214 LEU N . 27070 1 1001 . 1 1 217 217 THR H H 1 8.679 0.02 . 1 . . . . . 215 THR HN . 27070 1 1002 . 1 1 217 217 THR C C 13 173.696 0.2 . 1 . . . . . 215 THR C . 27070 1 1003 . 1 1 217 217 THR CA C 13 61.379 0.2 . 1 . . . . . 215 THR CA . 27070 1 1004 . 1 1 217 217 THR N N 15 119.259 0.2 . 1 . . . . . 215 THR N . 27070 1 1005 . 1 1 218 218 PHE H H 1 9.751 0.02 . 1 . . . . . 216 PHE HN . 27070 1 1006 . 1 1 218 218 PHE C C 13 175.684 0.2 . 1 . . . . . 216 PHE C . 27070 1 1007 . 1 1 218 218 PHE CA C 13 56.094 0.2 . 1 . . . . . 216 PHE CA . 27070 1 1008 . 1 1 218 218 PHE CB C 13 44.347 0.2 . 1 . . . . . 216 PHE CB . 27070 1 1009 . 1 1 218 218 PHE N N 15 124.059 0.2 . 1 . . . . . 216 PHE N . 27070 1 1010 . 1 1 219 219 GLU H H 1 8.926 0.02 . 1 . . . . . 217 GLU HN . 27070 1 1011 . 1 1 219 219 GLU C C 13 175.95 0.2 . 1 . . . . . 217 GLU C . 27070 1 1012 . 1 1 219 219 GLU CA C 13 56.148 0.2 . 1 . . . . . 217 GLU CA . 27070 1 1013 . 1 1 219 219 GLU CB C 13 31.513 0.2 . 1 . . . . . 217 GLU CB . 27070 1 1014 . 1 1 219 219 GLU N N 15 122.827 0.2 . 1 . . . . . 217 GLU N . 27070 1 1015 . 1 1 220 220 VAL H H 1 9.127 0.02 . 1 . . . . . 218 VAL HN . 27070 1 1016 . 1 1 220 220 VAL C C 13 173.074 0.2 . 1 . . . . . 218 VAL C . 27070 1 1017 . 1 1 220 220 VAL CA C 13 60.587 0.2 . 1 . . . . . 218 VAL CA . 27070 1 1018 . 1 1 220 220 VAL CB C 13 35.934 0.2 . 1 . . . . . 218 VAL CB . 27070 1 1019 . 1 1 220 220 VAL N N 15 123.322 0.2 . 1 . . . . . 218 VAL N . 27070 1 1020 . 1 1 221 221 GLU H H 1 9.395 0.02 . 1 . . . . . 219 GLU HN . 27070 1 1021 . 1 1 221 221 GLU C C 13 175.423 0.2 . 1 . . . . . 219 GLU C . 27070 1 1022 . 1 1 221 221 GLU CA C 13 53.903 0.2 . 1 . . . . . 219 GLU CA . 27070 1 1023 . 1 1 221 221 GLU CB C 13 33.79 0.2 . 1 . . . . . 219 GLU CB . 27070 1 1024 . 1 1 221 221 GLU N N 15 128.388 0.2 . 1 . . . . . 219 GLU N . 27070 1 1025 . 1 1 222 222 LEU H H 1 8.824 0.02 . 1 . . . . . 220 LEU HN . 27070 1 1026 . 1 1 222 222 LEU C C 13 174.485 0.2 . 1 . . . . . 220 LEU C . 27070 1 1027 . 1 1 222 222 LEU CA C 13 53.955 0.2 . 1 . . . . . 220 LEU CA . 27070 1 1028 . 1 1 222 222 LEU CB C 13 41.703 0.2 . 1 . . . . . 220 LEU CB . 27070 1 1029 . 1 1 222 222 LEU N N 15 130.185 0.2 . 1 . . . . . 220 LEU N . 27070 1 1030 . 1 1 223 223 VAL H H 1 8.863 0.02 . 1 . . . . . 221 VAL HN . 27070 1 1031 . 1 1 223 223 VAL C C 13 175.939 0.2 . 1 . . . . . 221 VAL C . 27070 1 1032 . 1 1 223 223 VAL CA C 13 64.056 0.2 . 1 . . . . . 221 VAL CA . 27070 1 1033 . 1 1 223 223 VAL CB C 13 33.033 0.2 . 1 . . . . . 221 VAL CB . 27070 1 1034 . 1 1 223 223 VAL N N 15 126.49 0.2 . 1 . . . . . 221 VAL N . 27070 1 1035 . 1 1 224 224 ASP H H 1 7.601 0.02 . 1 . . . . . 222 ASP HN . 27070 1 1036 . 1 1 224 224 ASP C C 13 173.106 0.2 . 1 . . . . . 222 ASP C . 27070 1 1037 . 1 1 224 224 ASP CA C 13 52.961 0.2 . 1 . . . . . 222 ASP CA . 27070 1 1038 . 1 1 224 224 ASP CB C 13 44.046 0.2 . 1 . . . . . 222 ASP CB . 27070 1 1039 . 1 1 224 224 ASP N N 15 113.847 0.2 . 1 . . . . . 222 ASP N . 27070 1 1040 . 1 1 225 225 ILE H H 1 8.832 0.02 . 1 . . . . . 223 ILE HN . 27070 1 1041 . 1 1 225 225 ILE C C 13 174.886 0.2 . 1 . . . . . 223 ILE C . 27070 1 1042 . 1 1 225 225 ILE CA C 13 60.785 0.2 . 1 . . . . . 223 ILE CA . 27070 1 1043 . 1 1 225 225 ILE CB C 13 42.775 0.2 . 1 . . . . . 223 ILE CB . 27070 1 1044 . 1 1 225 225 ILE N N 15 120.672 0.2 . 1 . . . . . 223 ILE N . 27070 1 1045 . 1 1 226 226 ASP H H 1 9.174 0.02 . 1 . . . . . 224 ASP HN . 27070 1 1046 . 1 1 226 226 ASP N N 15 133.186 0.2 . 1 . . . . . 224 ASP N . 27070 1 stop_ save_